A0A3Q0KIW0_SCHMA Loading...

Putative polyglutamine binding protein

AlphaFold DB , UniProt , Accession A0A3Q0KIW0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 492 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	64.3	Low	85.1	Confident	227 Å²	227	101.9 Å²	101.9	100%	1.118	58%	0.576	S	S	*	*				0	113.4	0	-64.7	-72.9	-86.9	0	0	107.3
2	P	81.2	Confident	85.4	Confident	130 Å²	130	101.3 Å²	101.3	84%	0.844	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-62.3	137.3	175.6	27.1	-31.9	0	0	0	109.5
3	L	82.5	Confident	85.6	Confident	89 Å²	89	108.5 Å²	108.5	47%	0.466	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-66.2	137.7	177.9	-75.3	159.4	0	0	0	109.4	L11	L3-L11 HydrophobicContact CD1-CD1 3.86Å
4	P	88.8	Confident	86	Confident	73 Å²	73	114.6 Å²	114.6	47%	0.474	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-52.8	138.6	172.5	-23.6	31.6	0	0	0	110.6	A6 L7 L8	P4-A6 PolarHBondContact O-N 3.11Å; P4-L7 HydrophobicContact CG-CD1 4.34Å; P4-L7 WeakPolarHBondContact O-CA 3.4Å; P4-L7 PolarHBondContact O-N 3.37Å; P4-L8 PolarHBondContact O-N 3.17Å
5	P	88.9	Confident	85.9	Confident	111 Å²	111	111.4 Å²	111.4	72%	0.721	60%	0.601	S	S	*	*	H	α-helix	trans	-52.8	-35.5	-176	-26	31.6	0	0	0	113.5	L7 L8 A9	P5-L7 PolarHBondContact O-N 2.96Å; P5-L8 PolarHBondContact O-N 3.33Å; P5-A9 WeakPolarHBondContact O-CB 3.49Å; P5-A9 PolarHBondContact O-N 3.07Å
6	A	87.8	Confident	85.6	Confident	75 Å²	75	111.8 Å²	111.8	62%	0.62	60%	0.601	S	S	*	*	H	α-helix	trans	-65.7	-35.2	176.8	0	0	0	0	0	113.6	P4 R10	P4-A6 PolarHBondContact O-N 3.11Å; A6-R10 PolarHBondContact O-N 2.96Å
7	L	85.8	Confident	85.1	Confident	86 Å²	86	108.1 Å²	108.1	45%	0.45	58%	0.583	S	S	.	*	H	α-helix	trans	-75.2	-40.3	173.8	-94.2	172.2	0	0	0	111.1	P4 P5 A9 R10 L11	P4-L7 HydrophobicContact CG-CD1 4.34Å; P4-L7 WeakPolarHBondContact O-CA 3.4Å; P4-L7 PolarHBondContact O-N 3.37Å; P5-L7 PolarHBondContact O-N 2.96Å; L7-A9 VanDerWaalsContact C-N 3.33Å; L7-A9 PolarHBondContact O-N 3.05Å; L7-R10 PolarHBondContact O-N 2.98Å; L7-R10 VanDerWaalsContact O-N 3.16Å; L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 VanDerWaalsContact O-CG 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.39Å
8	L	89.3	Confident	84.3	Confident	55 Å²	55	108.1 Å²	108.1	29%	0.288	59%	0.593	S	S	.	*	H	α-helix	trans	-60.7	-43.6	176.6	-143.3	176.3	0	0	0	110.8	P4 P5 R10 L11 K12 V17	P4-L8 PolarHBondContact O-N 3.17Å; P5-L8 PolarHBondContact O-N 3.33Å; L8-R10 PolarHBondContact O-N 3.32Å; L8-L11 PolarHBondContact O-N 2.9Å; L8-K12 HydrophobicContact CD2-CD 3.85Å; L8-K12 HydrophobicContact CD2-CG 3.85Å; L8-K12 WeakPolarHBondContact O-CB 3.49Å; L8-K12 WeakPolarHBondContact O-CG 3.39Å; L8-K12 PolarHBondContact O-N 3.26Å; L8-V17 HydrophobicContact CD2-CG1 4.32Å
9	A	85.7	Confident	82.9	Confident	58 Å²	58	106.5 Å²	106.5	48%	0.479	60%	0.596	S	S	.	*	H	α-helix	trans	-61.1	-42.3	173.5	0	0	0	0	0	112.4	P5 L7 K13	P5-A9 WeakPolarHBondContact O-CB 3.49Å; P5-A9 PolarHBondContact O-N 3.07Å; L7-A9 VanDerWaalsContact C-N 3.33Å; L7-A9 PolarHBondContact O-N 3.05Å; A9-K13 WeakPolarHBondContact O-CB 3.31Å; A9-K13 PolarHBondContact O-N 3.35Å
10	R	90.5	Very high	81.8	Confident	179 Å²	179	107.1 Å²	107.1	68%	0.675	60%	0.598	S	S	*	*	H	α-helix	trans	-65.9	-37.9	175.6	-85.8	178	146.7	159.8	-4.7	113	A6 L7 L8 K13 R14	A6-R10 PolarHBondContact O-N 2.96Å; L7-R10 PolarHBondContact O-N 2.98Å; L7-R10 VanDerWaalsContact O-N 3.16Å; L8-R10 PolarHBondContact O-N 3.32Å; R10-K13 PolarHBondContact O-N 3.49Å; R10-R14 WeakPolarHBondContact O-CG 3.46Å; R10-R14 PolarHBondContact O-N 3.05Å
11	L	91.4	Very high	80.2	Confident	38 Å²	38	108.2 Å²	108.2	20%	0.199	61%	0.61	C	S	.	*	H	α-helix	trans	-72.9	-40	177.5	-70.1	170.8	0	0	0	111.9	L3 L7 L8 K13 R14 G15 I16 V17	L3-L11 HydrophobicContact CD1-CD1 3.86Å; L7-L11 WeakPolarHBondContact O-CB 3.39Å; L7-L11 VanDerWaalsContact O-CG 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.37Å; L7-L11 PolarHBondContact O-N 3.39Å; L8-L11 PolarHBondContact O-N 2.9Å; L11-K13 VanDerWaalsContact C-N 3.34Å; L11-R14 CarbonylContact O-C 3.43Å; L11-R14 PolarHBondContact O-N 3.48Å; L11-R14 VanDerWaalsContact O-N 3.15Å; L11-G15 PolarHBondContact O-N 3.16Å; L11-G15 VanDerWaalsContact O-N 3.16Å; L11-I16 HydrophobicContact CD2-CB 4.15Å; L11-I16 HydrophobicContact CD2-CD1 3.88Å; L11-I16 HydrophobicContact CD2-CG2 4.18Å; L11-I16 PolarHBondContact O-N 3.46Å; L11-V17 HydrophobicContact CB-CB 4.45Å; L11-V17 HydrophobicContact CB-CG2 3.83Å; L11-V17 HydrophobicContact CD1-CG2 4.24Å
12	K	88.1	Confident	79.3	Confident	95 Å²	95	105.1 Å²	105.1	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-58.2	-45.1	169	-81.4	-176.2	175	-176.2	0	110.7	L8 R14 G15	L8-K12 HydrophobicContact CD2-CD 3.85Å; L8-K12 HydrophobicContact CD2-CG 3.85Å; L8-K12 WeakPolarHBondContact O-CB 3.49Å; L8-K12 WeakPolarHBondContact O-CG 3.39Å; L8-K12 PolarHBondContact O-N 3.26Å; K12-R14 PolarHBondContact O-N 2.92Å; K12-G15 PolarHBondContact O-N 3.23Å; K12-G15 VanDerWaalsContact O-N 3.11Å
13	K	88.7	Confident	77.6	Confident	195 Å²	195	106.5 Å²	106.5	85%	0.848	59%	0.588	S	S	*	*	H	α-helix	trans	-64.2	-22.2	176.8	-129.9	174.9	-174.2	176.4	0	114	A9 R10 L11	A9-K13 WeakPolarHBondContact O-CB 3.31Å; A9-K13 PolarHBondContact O-N 3.35Å; R10-K13 PolarHBondContact O-N 3.49Å; L11-K13 VanDerWaalsContact C-N 3.34Å
14	R	90.7	Very high	75.9	Confident	193 Å²	193	111 Å²	111	73%	0.728	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-0.4	177.4	-72.7	-179.5	169.9	174.6	-3.4	113.5	R10 L11 K12 I16	R10-R14 WeakPolarHBondContact O-CG 3.46Å; R10-R14 PolarHBondContact O-N 3.05Å; L11-R14 CarbonylContact O-C 3.43Å; L11-R14 PolarHBondContact O-N 3.48Å; L11-R14 VanDerWaalsContact O-N 3.15Å; K12-R14 PolarHBondContact O-N 2.92Å; R14-I16 HydrophobicContact CB-CD1 3.82Å; R14-I16 HydrophobicContact CB-CG1 4Å; R14-I16 PolarHBondContact O-N 3.17Å
15	G	85	Confident	73.9	Confident	67 Å²	67	111.9 Å²	111.9	69%	0.691	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.7	19.7	-178.1	0	0	0	0	0	114.3	L11 K12	L11-G15 PolarHBondContact O-N 3.16Å; L11-G15 VanDerWaalsContact O-N 3.16Å; K12-G15 PolarHBondContact O-N 3.23Å; K12-G15 VanDerWaalsContact O-N 3.11Å
16	I	81.7	Confident	72	Confident	117 Å²	117	112.6 Å²	112.6	60%	0.6	62%	0.621	S	S	*	*	S	Bend	trans	-87.6	-24.1	-178.1	-60.2	169.3	0	0	0	111.1	L11 R14	L11-I16 HydrophobicContact CD2-CB 4.15Å; L11-I16 HydrophobicContact CD2-CD1 3.88Å; L11-I16 HydrophobicContact CD2-CG2 4.18Å; L11-I16 PolarHBondContact O-N 3.46Å; R14-I16 HydrophobicContact CB-CD1 3.82Å; R14-I16 HydrophobicContact CB-CG1 4Å; R14-I16 PolarHBondContact O-N 3.17Å
17	V	75.9	Confident	70.4	Confident	50 Å²	50	117.3 Å²	117.3	30%	0.303	63%	0.631	S	S	.	*	S	Bend	trans	-122.6	121.9	178.5	177.5	0	0	0	0	108.6	L8 L11	L8-V17 HydrophobicContact CD2-CG1 4.32Å; L11-V17 HydrophobicContact CB-CB 4.45Å; L11-V17 HydrophobicContact CB-CG2 3.83Å; L11-V17 HydrophobicContact CD1-CG2 4.24Å
18	S	70.5	Confident	69	Low	107 Å²	107	121.2 Å²	121.2	75%	0.748	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-57.7	133.2	174.8	-51.8	0	0	0	0	110	D20	S18-D20 PolarHBondContact O-N 3.47Å
19	A	58.3	Low	67.1	Low	79 Å²	79	124.9 Å²	124.9	65%	0.653	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-69.6	118.8	176.9	0	0	0	0	0	109.7
20	D	61.4	Low	65.2	Low	118 Å²	118	130.2 Å²	130.2	63%	0.631	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62.1	132.5	163.8	-57.7	-54.7	0	0	0	109.3	S18 Q22	S18-D20 PolarHBondContact O-N 3.47Å; D20-Q22 PolarHBondContact O-N 3.15Å
21	P	48.5	Very low	63.2	Low	131 Å²	131	125.9 Å²	125.9	85%	0.851	69%	0.686	S	S	*	*			trans	-79	101.5	175.9	29.4	-29.4	0	0	0	110.1
22	Q	44.6	Very low	61.1	Low	161 Å²	161	132.3 Å²	132.3	75%	0.752	72%	0.715	S	S	*	*			trans	-140.9	125.9	165.6	-80.4	-168	-33.7	0	0	103.3	D20	D20-Q22 PolarHBondContact O-N 3.15Å
23	E	45.2	Very low	59.4	Low	160 Å²	160	134 Å²	134	75%	0.748	73%	0.729	S	S	*	*				-176.5	-177.4	53.5	-104.8	151.6	-171.3	0	0	105.7
24	E	46.8	Very low	58	Low	184 Å²	184	134.9 Å²	134.9	86%	0.86	73%	0.728	S	S	*	*			trans	87.7	93.2	166.3	-50.5	-179	166.3	0	0	114
25	A	47.6	Very low	56.4	Low	90 Å²	90	132.5 Å²	132.5	74%	0.744	73%	0.73	S	S	*	*				89	140.2	82	0	0	0	0	0	112.4
26	V	49.4	Very low	54.9	Low	127 Å²	127	137.8 Å²	137.8	77%	0.77	74%	0.737	S	S	*	*			trans	85.3	89.7	170.6	-161.7	0	0	0	0	113.5
27	E	52.7	Low	53.8	Low	174 Å²	174	140.7 Å²	140.7	81%	0.813	75%	0.748	S	S	*	*				65.3	99.9	99.7	-93.7	-179.5	162.3	0	0	113.1
28	E	57.6	Low	52.5	Low	168 Å²	168	143.6 Å²	143.6	79%	0.785	77%	0.771	S	S	*	*			trans	-163.3	101.3	144.4	-106.7	168.6	-145.5	0	0	108	F30	E28-F30 HydrophobicContact CB-CD2 4.4Å; E28-F30 HydrophobicContact CB-CE2 3.97Å; E28-F30 HydrophobicContact CG-CE2 3.9Å; E28-F30 HydrophobicContact CG-CZ 4.45Å
29	V	48.4	Very low	51.8	Low	132 Å²	132	146.8 Å²	146.8	80%	0.8	77%	0.773	S	S	*	*			trans	-92.3	109.9	175.3	177.1	0	0	0	0	107.1
30	F	46.2	Very low	51.2	Low	169 Å²	169	149 Å²	149	74%	0.741	78%	0.782	S	S	*	*			trans	-110.3	95.6	165	-68.6	-81.6	0	0	0	108.4	E28	E28-F30 HydrophobicContact CB-CD2 4.4Å; E28-F30 HydrophobicContact CB-CE2 3.97Å; E28-F30 HydrophobicContact CG-CE2 3.9Å; E28-F30 HydrophobicContact CG-CZ 4.45Å
31	A	49.3	Very low	50.8	Low	89 Å²	89	150 Å²	150	74%	0.736	79%	0.791	S	S	*	*			trans	-98.2	101.6	165.9	0	0	0	0	0	107.9
32	E	46.7	Very low	50.9	Low	173 Å²	173	150.5 Å²	150.5	81%	0.808	79%	0.786	S	S	*	*			trans	-110	108.8	160.5	-73.9	-174.2	177.6	0	0	107.9
33	N	52.9	Low	51.2	Low	131 Å²	131	149 Å²	149	70%	0.701	79%	0.79	S	S	*	*			trans	-97.1	112.4	173.7	-176.1	46.3	0	0	0	106.8
34	Y	58.9	Low	51.2	Low	213 Å²	213	147.8 Å²	147.8	84%	0.835	79%	0.793	S	S	*	*			trans	-144.5	91.5	167	-80	-78.2	0	0	0	109.9
35	D	56.9	Low	51.5	Low	143 Å²	143	144.1 Å²	144.1	77%	0.765	79%	0.788	S	S	*	*			trans	-67.3	117.6	151.5	-71	-43.4	0	0	0	108
36	E	54.6	Low	51.3	Low	178 Å²	178	149.4 Å²	149.4	83%	0.832	80%	0.795	S	S	*	*			trans	179.8	112.9	140.1	-105.2	171.4	178.4	0	0	111
37	E	57.9	Low	51.4	Low	177 Å²	177	150.4 Å²	150.4	83%	0.827	80%	0.796	S	S	*	*			trans	43.8	117.6	137.4	-60.3	-176.8	165.7	0	0	120.3
38	S	47.7	Very low	51.3	Low	112 Å²	112	151 Å²	151	78%	0.783	80%	0.799	S	S	*	*				126.2	131.6	122.2	71.7	0	0	0	0	116.5
39	E	56.2	Low	50.8	Low	173 Å²	173	148.6 Å²	148.6	81%	0.808	80%	0.798	S	S	*	*			trans	97.4	129	159.9	-51.4	-144.8	157.5	0	0	119.7	V41	E39-V41 PolarHBondContact O-N 3.21Å
40	P	45	Very low	50.5	Low	127 Å²	127	152 Å²	152	83%	0.825	80%	0.802	S	S	*	*			trans	-83.9	113.9	-164.4	33.5	-32.8	0	0	0	111.5
41	V	53	Low	50.5	Low	138 Å²	138	150.2 Å²	150.2	84%	0.836	80%	0.8	S	S	*	*			trans	-98.3	129.3	172.2	-175.9	0	0	0	0	110.2	E39	E39-V41 PolarHBondContact O-N 3.21Å
42	L	52.4	Low	50.3	Low	142 Å²	142	149.8 Å²	149.8	74%	0.743	80%	0.796	S	S	*	*			trans	-45.2	155.7	-178.1	-57.9	171.5	0	0	0	114.5	V44	L42-V44 PolarHBondContact O-N 2.82Å
43	P	50	Low	50.4	Low	129 Å²	129	150.1 Å²	150.1	84%	0.838	80%	0.795	S	S	*	*			trans	-57.3	112.1	177.1	23.6	-33.4	0	0	0	110.5	S45	P43-S45 PolarHBondContact O-N 3.11Å
44	V	46	Very low	50	Low	134 Å²	134	152 Å²	152	81%	0.812	80%	0.797	S	S	*	*			trans	-69.3	110.9	176.3	-147	0	0	0	0	107.6	L42 F46	L42-V44 PolarHBondContact O-N 2.82Å; V44-F46 PolarHBondContact O-N 3.37Å
45	S	51.9	Low	49	Very low	108 Å²	108	145.5 Å²	145.5	76%	0.755	78%	0.782	S	S	*	*			trans	-60.8	104.5	168.5	49.4	0	0	0	0	109.2	P43 D47	P43-S45 PolarHBondContact O-N 3.11Å; S45-D47 VanDerWaalsContact C-N 3.28Å; S45-D47 PolarHBondContact O-N 3.16Å
46	F	43.5	Very low	48.5	Very low	200 Å²	200	146.8 Å²	146.8	88%	0.877	78%	0.777	S	S	*	*			trans	-74.7	83.3	167.7	-174.3	-91.9	0	0	0	108.1	V44	V44-F46 PolarHBondContact O-N 3.37Å
47	D	51.4	Low	48.1	Very low	149 Å²	149	143.1 Å²	143.1	80%	0.797	77%	0.767	S	S	*	*			trans	-153.7	67.4	165.3	-84	-40.8	0	0	0	108.1	S45	S45-D47 VanDerWaalsContact C-N 3.28Å; S45-D47 PolarHBondContact O-N 3.16Å
48	Q	50.1	Low	47.9	Very low	187 Å²	187	137 Å²	137	87%	0.874	74%	0.742	S	S	*	*			trans	-77.8	120.2	162.7	-145.4	164.3	30.8	0	0	106.8	F50	Q48-F50 PolarHBondContact O-N 3.3Å
49	P	49	Very low	48.2	Very low	117 Å²	117	133.5 Å²	133.5	76%	0.76	72%	0.718	S	S	*	*			trans	-64.2	114.1	-173.2	24.5	-32.3	0	0	0	109	N51	P49-N51 PolarHBondContact O-N 2.77Å; P49-N51 VanDerWaalsContact O-N 3.07Å
50	F	41.3	Very low	48.3	Very low	203 Å²	203	131.4 Å²	131.4	89%	0.89	72%	0.719	S	S	*	*			trans	-50.7	120.7	168.1	-133.7	-92.6	0	0	0	107.1	Q48 A52	Q48-F50 PolarHBondContact O-N 3.3Å; F50-A52 PolarHBondContact O-N 3.27Å
51	N	46.4	Very low	49.1	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	71%	0.709	S	S	*	*			trans	-42.1	97.4	-178	-168.7	-22.4	0	0	0	110	P49 K53	P49-N51 PolarHBondContact O-N 2.77Å; P49-N51 VanDerWaalsContact O-N 3.07Å; N51-K53 PolarHBondContact O-N 3.01Å
52	A	43.8	Very low	49.7	Very low	79 Å²	79	126.8 Å²	126.8	65%	0.653	69%	0.689	S	S	*	*			trans	-73	79	-175.9	0	0	0	0	0	107.8	F50 K54	F50-A52 PolarHBondContact O-N 3.27Å; A52-K54 VanDerWaalsContact C-N 3.31Å; A52-K54 PolarHBondContact O-N 2.83Å
53	K	50.3	Low	50.7	Low	181 Å²	181	122.3 Å²	122.3	79%	0.787	67%	0.666	S	S	*	*			trans	-54	97.5	166.3	-68.8	173.4	-179	172.9	0	107.4	N51 C55	N51-K53 PolarHBondContact O-N 3.01Å; K53-C55 PolarHBondContact O-N 3.01Å
54	K	43.1	Very low	52.1	Low	171 Å²	171	121.6 Å²	121.6	74%	0.743	65%	0.654	S	S	*	*			trans	25.3	68.2	165	-69.8	179.3	178.1	178.1	0	114.1	A52 Y56	A52-K54 VanDerWaalsContact C-N 3.31Å; A52-K54 PolarHBondContact O-N 2.83Å; K54-Y56 HydrophobicContact CB-CE2 4.18Å; K54-Y56 PolarHBondContact O-N 2.76Å
55	C	38.1	Very low	53.5	Low	76 Å²	76	119.7 Å²	119.7	51%	0.514	64%	0.636	S	S	.	*			trans	-75.3	106.5	158.2	48.8	0	0	0	0	106.4	K53 T57	K53-C55 PolarHBondContact O-N 3.01Å; C55-T57 HydrophobicContact CB-CG2 4.36Å; C55-T57 PolarHBondContact O-N 3.18Å
56	Y	47.4	Very low	54.6	Low	169 Å²	169	122.4 Å²	122.4	66%	0.663	64%	0.642	S	S	*	*			trans	-71.7	72	165.5	-71.7	-90	0	0	0	107	K54 V58	K54-Y56 HydrophobicContact CB-CE2 4.18Å; K54-Y56 PolarHBondContact O-N 2.76Å; Y56-V58 PolarHBondContact O-N 3.07Å; Y56-V58 VanDerWaalsContact O-N 3.1Å
57	T	45.1	Very low	56.2	Low	102 Å²	102	116.1 Å²	116.1	63%	0.626	63%	0.633	S	S	*	*			trans	-51.3	120.8	165.4	53.6	0	0	0	0	106.3	C55 S59	C55-T57 HydrophobicContact CB-CG2 4.36Å; C55-T57 PolarHBondContact O-N 3.18Å; T57-S59 PolarHBondContact O-N 3.02Å
58	V	54.5	Low	57.8	Low	49 Å²	49	110 Å²	110	30%	0.297	60%	0.601	S	S	.	*			trans	-41.4	111.5	170.7	178.4	0	0	0	0	106.7	Y56 P60 E72 Y91	Y56-V58 PolarHBondContact O-N 3.07Å; Y56-V58 VanDerWaalsContact O-N 3.1Å; V58-P60 VanDerWaalsContact O-CD 3.31Å; V58-P60 WeakPolarHBondContact O-CD 3.1Å; V58-P60 VanDerWaalsContact O-N 3.16Å; V58-E72 WeakPolarHBondContact CG1-OE2 3.18Å; V58-Y91 HydrophobicContact CG2-CD2 3.55Å; V58-Y91 HydrophobicContact CG2-CE2 3.77Å; V58-Y91 HydrophobicContact CG2-CG 4.05Å
59	S	53.3	Low	59.6	Low	38 Å²	38	102.4 Å²	102.4	27%	0.266	57%	0.567	S	S	.	*			trans	-62.4	121.1	-178.2	49.3	0	0	0	0	106.3	T57 V61 E72 R96	T57-S59 PolarHBondContact O-N 3.02Å; S59-V61 PolarHBondContact O-N 3.3Å; S59-E72 PolarHBondContact OG-OE1 2.87Å; S59-R96 PolarHBondContact OG-NH1 2.84Å; S59-R96 PolarHBondContact OG-NH2 3.34Å
60	P	58.8	Low	61.5	Low	129 Å²	129	97.2 Å²	97.2	84%	0.838	53%	0.533	S	S	*	.	S	Bend	trans	-67	-2.6	175.6	28.7	-34.5	0	0	0	112	V58	V58-P60 VanDerWaalsContact O-CD 3.31Å; V58-P60 WeakPolarHBondContact O-CD 3.1Å; V58-P60 VanDerWaalsContact O-N 3.16Å
61	V	61	Low	63.4	Low	100 Å²	100	92.2 Å²	92.2	61%	0.606	51%	0.512	S	S	*	.	S	Bend	trans	-84.6	123.7	-179.7	-173.5	0	0	0	0	108.7	S59 I63	S59-V61 PolarHBondContact O-N 3.3Å; V61-I63 PolarHBondContact O-N 3.07Å
62	P	67.5	Low	65.1	Low	67 Å²	67	87.6 Å²	87.6	44%	0.435	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-54.9	134.5	173.6	19.4	-30.2	0	0	0	111.3	I64 L69	P62-I64 PolarHBondContact O-N 2.94Å; P62-L69 HydrophobicContact CB-CD1 3.13Å; P62-L69 HydrophobicContact CG-CD1 4.22Å
63	I	72.9	Confident	67.1	Low	48 Å²	48	84.6 Å²	84.6	25%	0.246	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	117.9	171.9	-54.7	176.3	0	0	0	107.5	V61 E65 I70 E72	V61-I63 PolarHBondContact O-N 3.07Å; I63-E65 HydrophobicContact CG2-CG 3.91Å; I63-I70 PolarHBondContact O-N 3.49Å; I63-E72 HydrophobicContact CD1-CG 4.2Å; I63-E72 HydrophobicContact CG1-CG 4.24Å
64	I	79.2	Confident	68.8	Low	114 Å²	114	76 Å²	76	59%	0.585	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.9	107.1	173	-56.9	170.2	0	0	0	106.9	P62 V68	P62-I64 PolarHBondContact O-N 2.94Å; I64-V68 WeakPolarHBondContact CA-O 3.5Å
65	E	74.4	Confident	71	Confident	94 Å²	94	72 Å²	72	44%	0.439	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.8	170.9	-65.8	175.2	-175	0	0	108	I63 G67 V68 I70	I63-E65 HydrophobicContact CG2-CG 3.91Å; E65-G67 PolarHBondContact O-N 2.81Å; E65-G67 VanDerWaalsContact O-N 3.1Å; E65-V68 PolarHBondContact N-O 3.1Å; E65-V68 VanDerWaalsContact N-O 3.11Å; E65-V68 PolarHBondContact O-N 3.1Å; E65-I70 HydrophobicContact CB-CD1 3.54Å; E65-I70 HydrophobicContact CG-CD1 3.58Å; E65-I70 WeakPolarHBondContact OE2-CD1 3.16Å
66	N	74.7	Confident	73.5	Confident	166 Å²	166	68.7 Å²	68.7	89%	0.888	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	31.6	177.2	-54.5	-27.2	0	0	0	114.6	V68	N66-V68 VanDerWaalsContact C-N 3.27Å; N66-V68 PolarHBondContact O-N 2.95Å
67	G	78.9	Confident	75.5	Confident	67 Å²	67	64.8 Å²	64.8	69%	0.691	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-0.4	-178.6	0	0	0	0	0	114.9	E65	E65-G67 PolarHBondContact O-N 2.81Å; E65-G67 VanDerWaalsContact O-N 3.1Å
68	V	84.3	Confident	77.6	Confident	20 Å²	20	63.3 Å²	63.3	12%	0.121	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	130.1	174	-178.7	0	0	0	0	109.1	I64 E65 N66 I70 E124 F133	I64-V68 WeakPolarHBondContact CA-O 3.5Å; E65-V68 PolarHBondContact N-O 3.1Å; E65-V68 VanDerWaalsContact N-O 3.11Å; E65-V68 PolarHBondContact O-N 3.1Å; N66-V68 VanDerWaalsContact C-N 3.27Å; N66-V68 PolarHBondContact O-N 2.95Å; V68-I70 PolarHBondContact O-N 3.46Å; V68-E124 HydrophobicContact CG1-CB 4.47Å; V68-F133 HydrophobicContact CG1-CD1 4.17Å; V68-F133 HydrophobicContact CG1-CE1 4.02Å; V68-F133 HydrophobicContact CG2-CE1 4.39Å
69	L	87.9	Confident	79.1	Confident	29 Å²	29	63.5 Å²	63.5	15%	0.152	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	126.6	172	173.4	60	0	0	0	108.8	P62 I123 E124 V125 G126 W136	P62-L69 HydrophobicContact CB-CD1 3.13Å; P62-L69 HydrophobicContact CG-CD1 4.22Å; L69-I123 HydrophobicContact CB-CD1 4.43Å; L69-I123 HydrophobicContact CD2-CD1 3.61Å; L69-E124 PolarHBondContact N-O 2.9Å; L69-V125 HydrophobicContact CB-CG1 4.34Å; L69-V125 HydrophobicContact CB-CG2 4.25Å; L69-V125 HydrophobicContact CD2-CG1 4.28Å; L69-V125 HydrophobicContact CD2-CG2 3.93Å; L69-V125 HydrophobicContact CG-CG1 4.01Å; L69-V125 HydrophobicContact CG-CG2 4.29Å; L69-V125 CarbonylContact O-C 3.51Å; L69-V125 WeakPolarHBondContact O-CA 3.17Å; L69-V125 WeakPolarHBondContact O-CG1 3.35Å; L69-G126 PolarHBondContact O-N 2.89Å; L69-W136 HydrophobicContact CD2-CE3 3.72Å; L69-W136 HydrophobicContact CD2-CZ3 3.59Å
70	I	88.5	Confident	80.7	Confident	8 Å²	8	67.9 Å²	67.9	4%	0.041	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127.9	176.1	-66	167.6	0	0	0	109.2	I63 E65 V68 E72 F99	I63-I70 PolarHBondContact O-N 3.49Å; E65-I70 HydrophobicContact CB-CD1 3.54Å; E65-I70 HydrophobicContact CG-CD1 3.58Å; E65-I70 WeakPolarHBondContact OE2-CD1 3.16Å; V68-I70 PolarHBondContact O-N 3.46Å; I70-E72 PolarHBondContact O-N 3.28Å; I70-F99 HydrophobicContact CD1-CB 3.77Å; I70-F99 HydrophobicContact CD1-CD1 4.25Å; I70-F99 HydrophobicContact CD1-CG 4.28Å; I70-F99 HydrophobicContact CG1-CB 4.12Å; I70-F99 HydrophobicContact CG1-CD1 4.38Å; I70-F99 HydrophobicContact CG1-CG 4.3Å; I70-F99 HydrophobicContact CG2-CB 3.91Å
71	H	82.1	Confident	82.1	Confident	97 Å²	97	64.6 Å²	64.6	45%	0.449	37%	0.366	S	S	.	.			trans	-68.7	129.5	173.9	-172.7	62.3	0	0	0	110.1	C73 G126 P128	H71-C73 VanDerWaalsContact CD2-SG 3.59Å; H71-C73 PolarHBondContact O-N 3.11Å; H71-G126 PolarHBondContact N-O 2.91Å; H71-P128 VanDerWaalsContact O-CD 3.31Å; H71-P128 WeakPolarHBondContact O-CD 3.4Å; H71-P128 VanDerWaalsContact O-CG 3.23Å; H71-P128 WeakPolarHBondContact O-CG 3.25Å
72	E	80.8	Confident	83.1	Confident	36 Å²	36	65.4 Å²	65.4	17%	0.168	37%	0.374	C	S	.	.			trans	-75.9	123.6	-178.5	-58	-166.9	154.1	0	0	111.1	V58 S59 I63 I70 R96	V58-E72 WeakPolarHBondContact CG1-OE2 3.18Å; S59-E72 PolarHBondContact OG-OE1 2.87Å; I63-E72 HydrophobicContact CD1-CG 4.2Å; I63-E72 HydrophobicContact CG1-CG 4.24Å; I70-E72 PolarHBondContact O-N 3.28Å; E72-R96 IonicContact OE1-CZ 3.88Å; E72-R96 IonicContact OE1-NH1 2.63Å; E72-R96 PolarHBondContact OE1-NH1 2.63Å; E72-R96 IonicContact OE2-NH1 2.79Å; E72-R96 PolarHBondContact OE2-NH1 3.16Å
73	C	85.7	Confident	83.9	Confident	16 Å²	16	72.2 Å²	72.2	11%	0.108	39%	0.392	C	S	.	.			trans	-135.1	139.3	172.7	-73	0	0	0	0	109.7	H71 R97 P128	H71-C73 VanDerWaalsContact CD2-SG 3.59Å; H71-C73 PolarHBondContact O-N 3.11Å; C73-R97 HydrophobicContact CB-CB 4.44Å; C73-R97 PolarHBondContact O-N 3.21Å; C73-P128 HydrophobicContact CB-CG 3.76Å
74	A	87.7	Confident	84.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-73	162.1	170.3	0	0	0	0	0	110.8	C76 Q79 C86 C90 Y91 G95	A74-C76 HydrophobicContact CB-CB 4.22Å; A74-C76 PolarHBondContact O-N 2.79Å; A74-C76 VanDerWaalsContact O-N 3.15Å; A74-Q79 PolarHBondContact O-NE2 2.93Å; A74-Q79 PolarHBondContact O-OE1 3.44Å; A74-C86 HydrophobicContact CB-CB 4.09Å; A74-C90 HydrophobicContact CB-CB 4.08Å; A74-Y91 HydrophobicContact CB-CD1 3.85Å; A74-Y91 HydrophobicContact CB-CE1 3.87Å; A74-Y91 HydrophobicContact CB-CG 4.24Å; A74-G95 CarbonylContact C-O 3.57Å; A74-G95 WeakPolarHBondContact CA-O 3.32Å
75	E	88.5	Confident	85.1	Confident	87 Å²	87	72.7 Å²	72.7	41%	0.407	40%	0.399	S	S	.	.			trans	-87.3	44.6	168.7	-161.9	60.1	-124.3	0	0	110.8	Y94 G95 R97	E75-Y94 VanDerWaalsContact O-CB 3.25Å; E75-Y94 WeakPolarHBondContact O-CB 3.41Å; E75-G95 PolarHBondContact N-O 2.97Å; E75-R97 VanDerWaalsContact CD-NE 3.31Å; E75-R97 IonicContact OE1-CZ 3.8Å; E75-R97 IonicContact OE1-NE 2.81Å; E75-R97 PolarHBondContact OE1-NE 3.45Å; E75-R97 VanDerWaalsContact OE1-NE 3.12Å; E75-R97 IonicContact OE1-NH2 3.92Å; E75-R97 PolarHBondContact OE1-NH2 2.75Å; E75-R97 WeakPolarHBondContact OE2-CB 3.36Å; E75-R97 WeakPolarHBondContact OE2-CD 3.08Å; E75-R97 WeakPolarHBondContact OE2-CG 3.48Å; E75-R97 IonicContact OE2-CZ 2.91Å; E75-R97 IonicContact OE2-NE 3.61Å; E75-R97 PolarHBondContact OE2-NE 3.4Å; E75-R97 IonicContact OE2-NH2 3.68Å
76	C	89.7	Confident	85.7	Confident	6 Å²	6	69.4 Å²	69.4	4%	0.041	39%	0.386	C	S	.	.			trans	-83.1	139.6	-171	84.5	0	0	0	0	111.8	A74 N78 Q79 H84 C86 C90 Y94	A74-C76 HydrophobicContact CB-CB 4.22Å; A74-C76 PolarHBondContact O-N 2.79Å; A74-C76 VanDerWaalsContact O-N 3.15Å; C76-N78 PolarHBondContact O-N 2.97Å; C76-Q79 PolarHBondContact O-N 3.14Å; C76-Q79 VanDerWaalsContact SG-CG 3.55Å; C76-Q79 PolarHBondContact SG-N 3.09Å; C76-H84 PolarHBondContact SG-CD2 2.96Å; C76-H84 PolarHBondContact SG-NE2 3.41Å; C76-C86 PolarHBondContact SG-SG 3.4Å; C76-C90 HydrophobicContact CB-CB 4.09Å; C76-Y94 HydrophobicContact CB-CD2 3.7Å; C76-Y94 HydrophobicContact CB-CE2 4.03Å; C76-Y94 HydrophobicContact CB-CG 4.43Å
77	P	90.8	Very high	86.4	Confident	88 Å²	88	64 Å²	64	57%	0.571	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-68.7	-16.9	178.9	28	-34.8	0	0	0	112.8	Q79 Y94	P77-Q79 VanDerWaalsContact C-N 3.34Å; P77-Y94 VanDerWaalsContact CD-CE1 3.41Å; P77-Y94 VanDerWaalsContact CD-CE2 3.45Å; P77-Y94 WeakPolarHBondContact CD-OH 3.42Å; P77-Y94 HydrophobicContact CG-CE1 3.88Å; P77-Y94 HydrophobicContact CG-CE2 4.25Å; P77-Y94 VanDerWaalsContact CG-OH 3.32Å; P77-Y94 WeakPolarHBondContact CG-OH 3.31Å
78	N	89.1	Confident	86.9	Confident	70 Å²	70	64.5 Å²	64.5	37%	0.374	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-92	8.3	-178	-163.3	25.3	0	0	0	112.9	C76 T80 N81 H84	C76-N78 PolarHBondContact O-N 2.97Å; N78-T80 PolarHBondContact O-N 3.43Å; N78-N81 WeakPolarHBondContact O-CB 3.21Å; N78-N81 PolarHBondContact O-N 3.01Å; N78-N81 VanDerWaalsContact O-N 3.13Å; N78-N81 VanDerWaalsContact OD1-CB 3.25Å; N78-N81 WeakPolarHBondContact OD1-CB 3.43Å; N78-H84 HydrophobicContact CB-CB 4.37Å; N78-H84 WeakPolarHBondContact ND2-CB 3.5Å; N78-H84 PolarHBondContact ND2-ND1 3.13Å; N78-H84 VanDerWaalsContact ND2-ND1 3.16Å; N78-H84 WeakPolarHBondContact O-CB 3.47Å; N78-H84 PolarHBondContact O-CD2 3.15Å; N78-H84 VanDerWaalsContact O-CD2 3.32Å
79	Q	85.6	Confident	87.2	Confident	53 Å²	53	70.1 Å²	70.1	25%	0.248	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-65.7	-22.1	177.4	-108.1	167.8	20.8	0	0	114.3	A74 C76 P77 N81	A74-Q79 PolarHBondContact O-NE2 2.93Å; A74-Q79 PolarHBondContact O-OE1 3.44Å; C76-Q79 PolarHBondContact O-N 3.14Å; C76-Q79 VanDerWaalsContact SG-CG 3.55Å; C76-Q79 PolarHBondContact SG-N 3.09Å; P77-Q79 VanDerWaalsContact C-N 3.34Å; Q79-N81 PolarHBondContact O-N 2.89Å
80	T	86.3	Confident	87.4	Confident	130 Å²	130	69 Å²	69	80%	0.798	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-66.6	-20.4	174.2	51.8	0	0	0	0	112.3	N78 P82	N78-T80 PolarHBondContact O-N 3.43Å; T80-P82 WeakPolarHBondContact O-CD 3.45Å
81	N	87.9	Confident	87.4	Confident	61 Å²	61	70.6 Å²	70.6	33%	0.326	37%	0.373	S	S	.	.	S	Bend	trans	-82.6	117.5	176.4	-177.8	-6.8	0	0	0	110.5	N78 Q79 Y83 H84	N78-N81 WeakPolarHBondContact O-CB 3.21Å; N78-N81 PolarHBondContact O-N 3.01Å; N78-N81 VanDerWaalsContact O-N 3.13Å; N78-N81 VanDerWaalsContact OD1-CB 3.25Å; N78-N81 WeakPolarHBondContact OD1-CB 3.43Å; Q79-N81 PolarHBondContact O-N 2.89Å; N81-Y83 PolarHBondContact O-N 2.94Å; N81-Y83 PolarHBondContact OD1-N 3.29Å; N81-H84 HydrophobicContact CB-CB 3.98Å; N81-H84 WeakPolarHBondContact O-CB 3.3Å; N81-H84 PolarHBondContact O-N 2.81Å
82	P	83.1	Confident	87.7	Confident	117 Å²	117	71.3 Å²	71.3	76%	0.76	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.9	179.7	-24	34.5	0	0	0	114.5	T80	T80-P82 WeakPolarHBondContact O-CD 3.45Å
83	Y	84.5	Confident	88.3	Confident	210 Å²	210	76.7 Å²	76.7	82%	0.824	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-6	-179.7	-56.9	-72.8	0	0	0	113.1	N81 V85	N81-Y83 PolarHBondContact O-N 2.94Å; N81-Y83 PolarHBondContact OD1-N 3.29Å; Y83-V85 PolarHBondContact O-N 2.99Å
84	H	89.7	Confident	88.5	Confident	46 Å²	46	79.9 Å²	79.9	21%	0.213	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-83.6	116.4	177.1	-179.4	57.8	0	0	0	111	C76 N78 N81	C76-H84 PolarHBondContact SG-CD2 2.96Å; C76-H84 PolarHBondContact SG-NE2 3.41Å; N78-H84 HydrophobicContact CB-CB 4.37Å; N78-H84 WeakPolarHBondContact ND2-CB 3.5Å; N78-H84 PolarHBondContact ND2-ND1 3.13Å; N78-H84 VanDerWaalsContact ND2-ND1 3.16Å; N78-H84 WeakPolarHBondContact O-CB 3.47Å; N78-H84 PolarHBondContact O-CD2 3.15Å; N78-H84 VanDerWaalsContact O-CD2 3.32Å; N81-H84 HydrophobicContact CB-CB 3.98Å; N81-H84 WeakPolarHBondContact O-CB 3.3Å; N81-H84 PolarHBondContact O-N 2.81Å
85	V	87	Confident	88.5	Confident	125 Å²	125	81.2 Å²	81.2	76%	0.758	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-99.5	125.9	164.6	-177.5	0	0	0	0	107.6	Y83 S87	Y83-V85 PolarHBondContact O-N 2.99Å; V85-S87 PolarHBondContact O-N 3.07Å; V85-S87 VanDerWaalsContact O-N 3.14Å
86	C	87.7	Confident	88.5	Confident	26 Å²	26	81.6 Å²	81.6	18%	0.176	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-60.2	118	179.3	-67.8	0	0	0	0	109.6	A74 C76 C90 Y91	A74-C86 HydrophobicContact CB-CB 4.09Å; C76-C86 PolarHBondContact SG-SG 3.4Å; C86-C90 HydrophobicContact CB-CB 4.01Å; C86-Y91 HydrophobicContact CB-CE2 3.85Å
87	S	89.7	Confident	88.4	Confident	51 Å²	51	83.6 Å²	83.6	36%	0.357	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-82	166.8	172.5	67	0	0	0	0	110.5	V85 Y89 C90 Y91	V85-S87 PolarHBondContact O-N 3.07Å; V85-S87 VanDerWaalsContact O-N 3.14Å; S87-Y89 PolarHBondContact O-N 3.5Å; S87-Y89 VanDerWaalsContact O-N 3.13Å; S87-C90 WeakPolarHBondContact O-CA 3.38Å; S87-C90 VanDerWaalsContact O-CB 3.25Å; S87-C90 WeakPolarHBondContact O-CB 3.45Å; S87-C90 PolarHBondContact O-N 2.85Å; S87-Y91 VanDerWaalsContact O-CD2 3.3Å; S87-Y91 WeakPolarHBondContact O-CD2 3.49Å; S87-Y91 PolarHBondContact O-N 3.38Å
88	P	89.2	Confident	88.2	Confident	79 Å²	79	87.1 Å²	87.1	51%	0.513	43%	0.43	S	S	.	.	H	α-helix	trans	-50.8	-36.2	173.3	-28.8	36.6	0	0	0	113.1	C90 Y91 E92	P88-C90 VanDerWaalsContact C-N 3.28Å; P88-C90 PolarHBondContact O-N 2.63Å; P88-Y91 WeakPolarHBondContact O-CB 3.22Å; P88-Y91 PolarHBondContact O-N 2.71Å; P88-E92 WeakPolarHBondContact O-CG 3.35Å; P88-E92 PolarHBondContact O-N 2.85Å
89	Y	90.6	Very high	88.1	Confident	137 Å²	137	85 Å²	85	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-57.9	-36.2	173.7	176.1	-101.6	0	0	0	113.4	S87 Y91 E92 R93	S87-Y89 PolarHBondContact O-N 3.5Å; S87-Y89 VanDerWaalsContact O-N 3.13Å; Y89-Y91 VanDerWaalsContact C-N 3.33Å; Y89-E92 PolarHBondContact O-N 3.29Å; Y89-R93 HydrophobicContact CE1-CB 4.48Å; Y89-R93 WeakPolarHBondContact O-CB 3.24Å; Y89-R93 PolarHBondContact O-N 3.47Å; Y89-R93 WeakPolarHBondContact OH-CD 3.47Å; Y89-R93 PolarHBondContact OH-NE 3.39Å
90	C	91.1	Very high	88.2	Confident	7 Å²	7	88.6 Å²	88.6	5%	0.047	44%	0.439	C	S	.	.	H	α-helix	trans	-64.1	-40.9	176	-62.4	0	0	0	0	111.4	A74 C76 C86 S87 P88 Y94	A74-C90 HydrophobicContact CB-CB 4.08Å; C76-C90 HydrophobicContact CB-CB 4.09Å; C86-C90 HydrophobicContact CB-CB 4.01Å; S87-C90 WeakPolarHBondContact O-CA 3.38Å; S87-C90 VanDerWaalsContact O-CB 3.25Å; S87-C90 WeakPolarHBondContact O-CB 3.45Å; S87-C90 PolarHBondContact O-N 2.85Å; P88-C90 VanDerWaalsContact C-N 3.28Å; P88-C90 PolarHBondContact O-N 2.63Å; C90-Y94 HydrophobicContact CB-CD2 4.47Å; C90-Y94 WeakPolarHBondContact O-CB 3.3Å; C90-Y94 WeakPolarHBondContact O-CD2 3.35Å; C90-Y94 PolarHBondContact O-N 3.19Å
91	Y	88.7	Confident	88.2	Confident	40 Å²	40	84.2 Å²	84.2	16%	0.157	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-38.9	177.4	-66.7	-81.5	0	0	0	112	V58 A74 C86 S87 P88 Y89 G95 R96	V58-Y91 HydrophobicContact CG2-CD2 3.55Å; V58-Y91 HydrophobicContact CG2-CE2 3.77Å; V58-Y91 HydrophobicContact CG2-CG 4.05Å; A74-Y91 HydrophobicContact CB-CD1 3.85Å; A74-Y91 HydrophobicContact CB-CE1 3.87Å; A74-Y91 HydrophobicContact CB-CG 4.24Å; C86-Y91 HydrophobicContact CB-CE2 3.85Å; S87-Y91 VanDerWaalsContact O-CD2 3.3Å; S87-Y91 WeakPolarHBondContact O-CD2 3.49Å; S87-Y91 PolarHBondContact O-N 3.38Å; P88-Y91 WeakPolarHBondContact O-CB 3.22Å; P88-Y91 PolarHBondContact O-N 2.71Å; Y89-Y91 VanDerWaalsContact C-N 3.33Å; Y91-G95 WeakPolarHBondContact O-CA 3.46Å; Y91-G95 PolarHBondContact O-N 3.46Å; Y91-R96 HydrophobicContact CD1-CG 4.01Å
92	E	89.2	Confident	88.3	Confident	112 Å²	112	85.3 Å²	85.3	52%	0.523	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-43	177.5	-69.8	173.5	-179.8	0	0	112.2	P88 Y89	P88-E92 WeakPolarHBondContact O-CG 3.35Å; P88-E92 PolarHBondContact O-N 2.85Å; Y89-E92 PolarHBondContact O-N 3.29Å
93	R	91.7	Very high	88.6	Confident	149 Å²	149	84 Å²	84	56%	0.562	40%	0.404	S	S	*	.	H	α-helix	trans	-76.8	-42.1	-175.3	-170.8	180	-160.8	-117.6	-1.4	113.2	Y89	Y89-R93 HydrophobicContact CE1-CB 4.48Å; Y89-R93 WeakPolarHBondContact O-CB 3.24Å; Y89-R93 PolarHBondContact O-N 3.47Å; Y89-R93 WeakPolarHBondContact OH-CD 3.47Å; Y89-R93 PolarHBondContact OH-NE 3.39Å
94	Y	91	Very high	89	Confident	83 Å²	83	77.4 Å²	77.4	33%	0.325	39%	0.385	S	S	.	.	H	α-helix	trans	-108.8	-14.8	-172.9	-54.6	-72.8	0	0	0	113.5	E75 C76 P77 C90	E75-Y94 VanDerWaalsContact O-CB 3.25Å; E75-Y94 WeakPolarHBondContact O-CB 3.41Å; C76-Y94 HydrophobicContact CB-CD2 3.7Å; C76-Y94 HydrophobicContact CB-CE2 4.03Å; C76-Y94 HydrophobicContact CB-CG 4.43Å; P77-Y94 VanDerWaalsContact CD-CE1 3.41Å; P77-Y94 VanDerWaalsContact CD-CE2 3.45Å; P77-Y94 WeakPolarHBondContact CD-OH 3.42Å; P77-Y94 HydrophobicContact CG-CE1 3.88Å; P77-Y94 HydrophobicContact CG-CE2 4.25Å; P77-Y94 VanDerWaalsContact CG-OH 3.32Å; P77-Y94 WeakPolarHBondContact CG-OH 3.31Å; C90-Y94 HydrophobicContact CB-CD2 4.47Å; C90-Y94 WeakPolarHBondContact O-CB 3.3Å; C90-Y94 WeakPolarHBondContact O-CD2 3.35Å; C90-Y94 PolarHBondContact O-N 3.19Å
95	G	88.3	Confident	88.9	Confident	28 Å²	28	77 Å²	77	29%	0.289	39%	0.385	S	S	.	.			trans	80.6	177.9	-174.3	0	0	0	0	0	113.3	A74 E75 Y91	A74-G95 CarbonylContact C-O 3.57Å; A74-G95 WeakPolarHBondContact CA-O 3.32Å; E75-G95 PolarHBondContact N-O 2.97Å; Y91-G95 WeakPolarHBondContact O-CA 3.46Å; Y91-G95 PolarHBondContact O-N 3.46Å
96	R	86.9	Confident	89.1	Confident	95 Å²	95	73.2 Å²	73.2	36%	0.358	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-86.3	135.7	173.7	-64	174.4	-177.7	-124.6	13.4	109.4	S59 E72 Y91	S59-R96 PolarHBondContact OG-NH1 2.84Å; S59-R96 PolarHBondContact OG-NH2 3.34Å; E72-R96 IonicContact OE1-CZ 3.88Å; E72-R96 IonicContact OE1-NH1 2.63Å; E72-R96 PolarHBondContact OE1-NH1 2.63Å; E72-R96 IonicContact OE2-NH1 2.79Å; E72-R96 PolarHBondContact OE2-NH1 3.16Å; Y91-R96 HydrophobicContact CD1-CG 4.01Å
97	R	87.5	Confident	89.4	Confident	48 Å²	48	80.1 Å²	80.1	18%	0.181	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-67.8	130	173.2	-178	170.3	-68.7	144.5	3.3	109.3	C73 E75 P128	C73-R97 HydrophobicContact CB-CB 4.44Å; C73-R97 PolarHBondContact O-N 3.21Å; E75-R97 VanDerWaalsContact CD-NE 3.31Å; E75-R97 IonicContact OE1-CZ 3.8Å; E75-R97 IonicContact OE1-NE 2.81Å; E75-R97 PolarHBondContact OE1-NE 3.45Å; E75-R97 VanDerWaalsContact OE1-NE 3.12Å; E75-R97 IonicContact OE1-NH2 3.92Å; E75-R97 PolarHBondContact OE1-NH2 2.75Å; E75-R97 WeakPolarHBondContact OE2-CB 3.36Å; E75-R97 WeakPolarHBondContact OE2-CD 3.08Å; E75-R97 WeakPolarHBondContact OE2-CG 3.48Å; E75-R97 IonicContact OE2-CZ 2.91Å; E75-R97 IonicContact OE2-NE 3.61Å; E75-R97 PolarHBondContact OE2-NE 3.4Å; E75-R97 IonicContact OE2-NH2 3.68Å; R97-P128 HydrophobicContact CB-CB 4.22Å; R97-P128 WeakPolarHBondContact CD-O 3.25Å; R97-P128 HydrophobicContact CG-CB 3.84Å
98	K	86.4	Confident	89.5	Confident	163 Å²	163	80.4 Å²	80.4	71%	0.709	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-79.9	137.7	174.9	-63.6	-176.7	179	-176.9	0	109.8	N100	K98-N100 PolarHBondContact O-N 3.12Å
99	F	87.9	Confident	89.6	Confident	26 Å²	26	77.8 Å²	77.8	11%	0.114	36%	0.36	C	S	.	.			trans	-78.7	107.7	173.9	178	-107.4	0	0	0	109.6	I70 T101 G126 D127 F133	I70-F99 HydrophobicContact CD1-CB 3.77Å; I70-F99 HydrophobicContact CD1-CD1 4.25Å; I70-F99 HydrophobicContact CD1-CG 4.28Å; I70-F99 HydrophobicContact CG1-CB 4.12Å; I70-F99 HydrophobicContact CG1-CD1 4.38Å; I70-F99 HydrophobicContact CG1-CG 4.3Å; I70-F99 HydrophobicContact CG2-CB 3.91Å; F99-T101 HydrophobicContact CE1-CG2 4.01Å; F99-T101 HydrophobicContact CZ-CG2 4.29Å; F99-G126 VanDerWaalsContact CE2-CA 3.48Å; F99-D127 WeakPolarHBondContact CD2-O 2.93Å; F99-D127 WeakPolarHBondContact CE2-O 3.47Å; F99-F133 HydrophobicContact CE1-CD1 4.44Å; F99-F133 AromaticContact CE1-CE1 3.64Å; F99-F133 HydrophobicContact CE1-CE1 3.64Å; F99-F133 AromaticContact CE1-CZ 3.76Å; F99-F133 HydrophobicContact CE1-CZ 3.76Å; F99-F133 HydrophobicContact CZ-CD1 4.02Å; F99-F133 AromaticContact CZ-CE1 3.6Å; F99-F133 HydrophobicContact CZ-CE1 3.6Å; F99-F133 HydrophobicContact CZ-CE2 4.27Å; F99-F133 AromaticContact CZ-CZ 3.76Å; F99-F133 HydrophobicContact CZ-CZ 3.76Å
100	N	87.2	Confident	89.8	Confident	128 Å²	128	73.9 Å²	73.9	68%	0.684	35%	0.353	S	S	*	.			trans	-114.7	116.4	172	-67.7	-36.9	0	0	0	108.3	K98 G131	K98-N100 PolarHBondContact O-N 3.12Å; N100-G131 WeakPolarHBondContact O-CA 3.19Å
101	T	87.1	Confident	89.9	Confident	37 Å²	37	79.9 Å²	79.9	23%	0.227	37%	0.374	C	S	.	.			trans	-105.9	142.1	175.5	-168.4	0	0	0	0	110.1	F99 N105 I106 G131 F133	F99-T101 HydrophobicContact CE1-CG2 4.01Å; F99-T101 HydrophobicContact CZ-CG2 4.29Å; T101-N105 WeakPolarHBondContact OG1-CB 3.37Å; T101-I106 HydrophobicContact CG2-CD1 3.66Å; T101-I106 HydrophobicContact CG2-CG1 3.45Å; T101-I106 VanDerWaalsContact CG2-CG1 3.45Å; T101-G131 WeakPolarHBondContact CA-O 3.38Å; T101-G131 VanDerWaalsContact CB-O 3.24Å; T101-G131 WeakPolarHBondContact CB-O 3.25Å; T101-G131 PolarHBondContact OG1-O 3.34Å; T101-F133 HydrophobicContact CG2-CE2 3.94Å; T101-F133 HydrophobicContact CG2-CZ 3.8Å
102	D	88.7	Confident	90.2	Very high	85 Å²	85	79.3 Å²	79.3	46%	0.455	37%	0.373	S	S	.	.			trans	-71	147	176	-173	15.5	0	0	0	111.1	T104 N105 I106	D102-T104 VanDerWaalsContact CG-OG1 3.26Å; D102-T104 PolarHBondContact O-N 2.88Å; D102-T104 VanDerWaalsContact O-N 3.14Å; D102-T104 WeakPolarHBondContact OD2-CG2 3.4Å; D102-T104 PolarHBondContact OD2-OG1 2.61Å; D102-N105 WeakPolarHBondContact O-CB 3.14Å; D102-N105 PolarHBondContact O-N 3.26Å; D102-I106 PolarHBondContact O-N 3.46Å; D102-I106 VanDerWaalsContact O-N 3.09Å
103	L	90.6	Very high	90.4	Very high	89 Å²	89	75.5 Å²	75.5	47%	0.466	36%	0.356	S	S	.	.	H	α-helix	trans	-53.7	-34.7	176.3	-79.3	125.7	0	0	0	111.8	I106 R107 Y289	L103-I106 PolarHBondContact O-N 3.46Å; L103-R107 WeakPolarHBondContact O-CB 3.42Å; L103-R107 VanDerWaalsContact O-CG 3.3Å; L103-R107 WeakPolarHBondContact O-CG 3.5Å; L103-R107 PolarHBondContact O-N 3.39Å; L103-Y289 WeakPolarHBondContact CD2-OH 3.47Å
104	T	91.8	Very high	90.5	Very high	71 Å²	71	78.5 Å²	78.5	44%	0.436	37%	0.368	S	S	.	.	H	α-helix	trans	-60.4	-48.6	175.3	63.7	0	0	0	0	111.4	D102 I106 R107 L108	D102-T104 VanDerWaalsContact CG-OG1 3.26Å; D102-T104 PolarHBondContact O-N 2.88Å; D102-T104 VanDerWaalsContact O-N 3.14Å; D102-T104 WeakPolarHBondContact OD2-CG2 3.4Å; D102-T104 PolarHBondContact OD2-OG1 2.61Å; T104-I106 VanDerWaalsContact C-N 3.34Å; T104-I106 PolarHBondContact O-N 3.29Å; T104-R107 PolarHBondContact O-N 3.47Å; T104-L108 WeakPolarHBondContact O-CB 3.5Å; T104-L108 WeakPolarHBondContact O-CG 3.23Å; T104-L108 PolarHBondContact O-N 3.15Å
105	N	89.3	Confident	90.7	Very high	38 Å²	38	81.6 Å²	81.6	20%	0.203	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-38.7	178.5	-71	-56.3	0	0	0	111.6	T101 D102 K109	T101-N105 WeakPolarHBondContact OG1-CB 3.37Å; D102-N105 WeakPolarHBondContact O-CB 3.14Å; D102-N105 PolarHBondContact O-N 3.26Å; N105-K109 VanDerWaalsContact O-CB 3.23Å; N105-K109 WeakPolarHBondContact O-CB 3.37Å; N105-K109 PolarHBondContact O-N 2.87Å
106	I	91.4	Very high	91.1	Very high	46 Å²	46	82.9 Å²	82.9	24%	0.236	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-51	173.9	-62	170.7	0	0	0	110	T101 D102 L103 T104 L108 K109 S110	T101-I106 HydrophobicContact CG2-CD1 3.66Å; T101-I106 HydrophobicContact CG2-CG1 3.45Å; T101-I106 VanDerWaalsContact CG2-CG1 3.45Å; D102-I106 PolarHBondContact O-N 3.46Å; D102-I106 VanDerWaalsContact O-N 3.09Å; L103-I106 PolarHBondContact O-N 3.46Å; T104-I106 VanDerWaalsContact C-N 3.34Å; T104-I106 PolarHBondContact O-N 3.29Å; I106-L108 PolarHBondContact O-N 2.94Å; I106-K109 PolarHBondContact O-N 2.92Å; I106-S110 PolarHBondContact O-N 3.47Å; I106-S110 PolarHBondContact O-OG 2.91Å
107	R	93.2	Very high	91.4	Very high	171 Å²	171	82.1 Å²	82.1	65%	0.645	38%	0.383	S	S	*	.	H	α-helix	trans	-60.9	-45.4	-179.8	-72.8	175.2	-179.6	-179.7	-0.3	112	L103 T104 S110 R111	L103-R107 WeakPolarHBondContact O-CB 3.42Å; L103-R107 VanDerWaalsContact O-CG 3.3Å; L103-R107 WeakPolarHBondContact O-CG 3.5Å; L103-R107 PolarHBondContact O-N 3.39Å; T104-R107 PolarHBondContact O-N 3.47Å; R107-S110 PolarHBondContact O-N 3.32Å; R107-R111 WeakPolarHBondContact O-CB 3.31Å; R107-R111 PolarHBondContact O-N 3.47Å
108	L	91.2	Very high	91.7	Very high	56 Å²	56	82.1 Å²	82.1	29%	0.293	39%	0.386	S	S	.	.	H	α-helix	trans	-60.2	-47.3	177.3	-73	167.9	0	0	0	111.3	T104 I106 R111 M112 G305	T104-L108 WeakPolarHBondContact O-CB 3.5Å; T104-L108 WeakPolarHBondContact O-CG 3.23Å; T104-L108 PolarHBondContact O-N 3.15Å; I106-L108 PolarHBondContact O-N 2.94Å; L108-R111 PolarHBondContact O-N 2.88Å; L108-M112 WeakPolarHBondContact O-CB 3.48Å; L108-M112 PolarHBondContact O-N 3.47Å; L108-G305 WeakPolarHBondContact CD2-O 3.31Å
109	K	92.2	Very high	92	Very high	25 Å²	25	76.2 Å²	76.2	11%	0.109	36%	0.364	C	S	.	.	H	α-helix	trans	-58.2	-52.2	174.6	168.6	-178.9	169.6	-170.9	0	111.4	N105 I106 R111 M112 L113 E124 F133	N105-K109 VanDerWaalsContact O-CB 3.23Å; N105-K109 WeakPolarHBondContact O-CB 3.37Å; N105-K109 PolarHBondContact O-N 2.87Å; I106-K109 PolarHBondContact O-N 2.92Å; K109-R111 VanDerWaalsContact C-N 3.29Å; K109-R111 PolarHBondContact O-N 3.39Å; K109-M112 PolarHBondContact O-N 3.45Å; K109-L113 HydrophobicContact CD-CD1 4.26Å; K109-L113 HydrophobicContact CG-CD1 3.56Å; K109-L113 HydrophobicContact CG-CG 4.27Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.42Å; K109-L113 PolarHBondContact O-N 2.75Å; K109-E124 WeakPolarHBondContact CE-OE1 3.44Å; K109-E124 WeakPolarHBondContact CE-OE2 3.34Å; K109-E124 IonicContact NZ-OE1 3.67Å; K109-E124 IonicContact NZ-OE2 3.73Å; K109-E124 PolarHBondContact NZ-OE2 3.32Å; K109-F133 HydrophobicContact CB-CD2 4.34Å; K109-F133 HydrophobicContact CD-CB 4.11Å; K109-F133 HydrophobicContact CD-CD1 4.01Å; K109-F133 HydrophobicContact CD-CD2 3.42Å; K109-F133 VanDerWaalsContact CD-CD2 3.42Å; K109-F133 HydrophobicContact CD-CE1 4.26Å; K109-F133 HydrophobicContact CD-CE2 3.71Å; K109-F133 HydrophobicContact CD-CG 3.57Å; K109-F133 HydrophobicContact CD-CZ 4.1Å; K109-F133 HydrophobicContact CG-CD2 4.44Å
110	S	93.6	Very high	92	Very high	55 Å²	55	79.1 Å²	79.1	39%	0.385	39%	0.388	S	S	.	.	H	α-helix	trans	-59.7	-40.1	-179.2	-64	0	0	0	0	111.8	I106 R107 R114	I106-S110 PolarHBondContact O-N 3.47Å; I106-S110 PolarHBondContact O-OG 2.91Å; R107-S110 PolarHBondContact O-N 3.32Å; S110-R114 VanDerWaalsContact O-CG 3.24Å; S110-R114 WeakPolarHBondContact O-CG 2.96Å; S110-R114 PolarHBondContact O-N 3.14Å; S110-R114 VanDerWaalsContact O-N 3.09Å
111	R	94.6	Very high	92.3	Very high	133 Å²	133	76.8 Å²	76.8	50%	0.502	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-44.6	175.8	-171.5	-175.2	-65.4	161.5	-5.1	111.9	R107 L108 K109 R114 R115	R107-R111 WeakPolarHBondContact O-CB 3.31Å; R107-R111 PolarHBondContact O-N 3.47Å; L108-R111 PolarHBondContact O-N 2.88Å; K109-R111 VanDerWaalsContact C-N 3.29Å; K109-R111 PolarHBondContact O-N 3.39Å; R111-R114 PolarHBondContact O-N 3.42Å; R111-R115 PolarHBondContact O-N 2.93Å
112	M	93.5	Very high	92.7	Very high	28 Å²	28	76.4 Å²	76.4	14%	0.138	37%	0.367	C	S	.	.	H	α-helix	trans	-63	-45.7	178.2	-178.3	-121.9	-56.9	0	0	111.5	L108 K109 R114 R115 Y116 Y135 L146 S147	L108-M112 WeakPolarHBondContact O-CB 3.48Å; L108-M112 PolarHBondContact O-N 3.47Å; K109-M112 PolarHBondContact O-N 3.45Å; M112-R114 VanDerWaalsContact C-N 3.34Å; M112-R114 PolarHBondContact O-N 3.06Å; M112-R115 PolarHBondContact O-N 3.35Å; M112-R115 VanDerWaalsContact O-N 3.15Å; M112-Y116 HydrophobicContact CG-CD2 4.48Å; M112-Y116 PolarHBondContact O-N 2.92Å; M112-Y135 HydrophobicContact CE-CE2 3.81Å; M112-Y135 WeakPolarHBondContact CE-OH 3.38Å; M112-Y135 HydrophobicContact SD-CE2 4.2Å; M112-L146 HydrophobicContact CE-CD2 4.07Å; M112-S147 VanDerWaalsContact SD-CB 3.51Å; M112-S147 PolarHBondContact SD-N 3.37Å
113	L	93.9	Very high	92.9	Very high	32 Å²	32	75.2 Å²	75.2	17%	0.168	36%	0.36	C	S	.	.	H	α-helix	trans	-70.1	-27.1	-179	-68.8	172.2	0	0	0	113.7	K109 R115 Y116 P117 L118 E124 Y135	K109-L113 HydrophobicContact CD-CD1 4.26Å; K109-L113 HydrophobicContact CG-CD1 3.56Å; K109-L113 HydrophobicContact CG-CG 4.27Å; K109-L113 WeakPolarHBondContact O-CB 3.23Å; K109-L113 VanDerWaalsContact O-CG 3.31Å; K109-L113 WeakPolarHBondContact O-CG 3.42Å; K109-L113 PolarHBondContact O-N 2.75Å; L113-R115 VanDerWaalsContact C-N 3.31Å; L113-Y116 CarbonylContact O-C 3.58Å; L113-P117 WeakPolarHBondContact O-CA 3.45Å; L113-L118 HydrophobicContact CD2-CD1 3.9Å; L113-L118 HydrophobicContact CD2-CD2 4.08Å; L113-L118 HydrophobicContact CD2-CG 3.61Å; L113-E124 WeakPolarHBondContact CD1-OE1 3.06Å; L113-Y135 HydrophobicContact CD2-CE1 3.94Å
114	R	94.5	Very high	93.1	Very high	211 Å²	211	73.3 Å²	73.3	80%	0.796	35%	0.349	S	S	*	.	H	α-helix	trans	-63.8	-37	170.1	-77.3	173	-174.5	-163.4	2.1	112	S110 R111 M112	S110-R114 VanDerWaalsContact O-CG 3.24Å; S110-R114 WeakPolarHBondContact O-CG 2.96Å; S110-R114 PolarHBondContact O-N 3.14Å; S110-R114 VanDerWaalsContact O-N 3.09Å; R111-R114 PolarHBondContact O-N 3.42Å; M112-R114 VanDerWaalsContact C-N 3.34Å; M112-R114 PolarHBondContact O-N 3.06Å
115	R	95.1	Very high	93.2	Very high	149 Å²	149	70 Å²	70	56%	0.562	33%	0.328	S	S	*	.	H	α-helix	trans	-83.4	-37.9	178.1	-67.4	-177.5	179.7	-90	2.7	112.5	R111 M112 L113 P303	R111-R115 PolarHBondContact O-N 2.93Å; M112-R115 PolarHBondContact O-N 3.35Å; M112-R115 VanDerWaalsContact O-N 3.15Å; L113-R115 VanDerWaalsContact C-N 3.31Å; R115-P303 VanDerWaalsContact CZ-O 3.24Å; R115-P303 PolarHBondContact NE-O 3.24Å; R115-P303 PolarHBondContact NH2-O 2.78Å
116	Y	95.5	Very high	93.4	Very high	55 Å²	55	68.1 Å²	68.1	22%	0.216	32%	0.318	C	S	.	.	S	Bend	trans	-129.7	78.1	-172.4	-58.2	-74	0	0	0	110.2	M112 L113 S147 L149 H150	M112-Y116 HydrophobicContact CG-CD2 4.48Å; M112-Y116 PolarHBondContact O-N 2.92Å; L113-Y116 CarbonylContact O-C 3.58Å; Y116-S147 WeakPolarHBondContact O-CB 3.43Å; Y116-S147 PolarHBondContact O-OG 3.26Å; Y116-L149 HydrophobicContact CD1-CB 4.11Å; Y116-L149 WeakPolarHBondContact CD1-O 3.48Å; Y116-H150 HydrophobicContact CD2-CB 4.37Å; Y116-H150 AromaticContact CD2-CD2 3.56Å; Y116-H150 AromaticContact CE2-CD2 3.42Å; Y116-H150 VanDerWaalsContact CE2-CD2 3.42Å; Y116-H150 WeakPolarHBondContact CE2-CD2 3.06Å; Y116-H150 HydrophobicContact CG-CB 4.39Å
117	P	94.8	Very high	93.3	Very high	79 Å²	79	67 Å²	67	51%	0.513	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-61.5	145.9	-178.6	26.6	-34.9	0	0	0	110.8	L113 L149	L113-P117 WeakPolarHBondContact O-CA 3.45Å; P117-L149 WeakPolarHBondContact O-CD1 3.48Å
118	L	92.6	Very high	93.2	Very high	48 Å²	48	59.3 Å²	59.3	25%	0.251	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-66.9	131.4	-176.6	-70.6	164.1	0	0	0	111.2	L113 W122 E124 Y135	L113-L118 HydrophobicContact CD2-CD1 3.9Å; L113-L118 HydrophobicContact CD2-CD2 4.08Å; L113-L118 HydrophobicContact CD2-CG 3.61Å; L118-W122 HydrophobicContact CB-CB 4.4Å; L118-W122 HydrophobicContact CD2-CB 4.25Å; L118-E124 HydrophobicContact CD1-CG 3.41Å; L118-E124 VanDerWaalsContact CD1-CG 3.41Å; L118-Y135 HydrophobicContact CD1-CD1 3.74Å; L118-Y135 HydrophobicContact CD1-CE1 3.77Å; L118-Y135 HydrophobicContact CD2-CD1 3.27Å; L118-Y135 HydrophobicContact CD2-CE1 3.64Å; L118-Y135 HydrophobicContact CD2-CG 3.82Å; L118-Y135 HydrophobicContact CG-CD1 4.1Å; L118-Y135 HydrophobicContact CG-CE1 4.17Å
119	P	92.6	Very high	92.9	Very high	38 Å²	38	60.7 Å²	60.7	25%	0.247	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-62.6	162.1	172.3	-16.7	28.8	0	0	0	111.2	H121 W122 P148 L149	P119-H121 PolarHBondContact O-N 2.85Å; P119-W122 PolarHBondContact O-N 3.46Å; P119-P148 HydrophobicContact CG-CB 4.28Å; P119-P148 HydrophobicContact CG-CG 4.28Å; P119-L149 HydrophobicContact CG-CD1 4.37Å; P119-L149 HydrophobicContact CG-CD2 3.96Å; P119-L149 HydrophobicContact CG-CG 3.88Å
120	S	89.5	Confident	92.8	Very high	88 Å²	88	62.8 Å²	62.8	62%	0.615	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	144	172.2	64	0	0	0	0	110.3	W122	S120-W122 PolarHBondContact O-N 3.09Å
121	H	93.1	Very high	92.6	Very high	78 Å²	78	60.6 Å²	60.6	36%	0.361	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-6.7	-178	-38.2	-55.1	0	0	0	115.9	P119 N137 T138 K139	P119-H121 PolarHBondContact O-N 2.85Å; H121-N137 WeakPolarHBondContact O-CA 3.45Å; H121-T138 PolarHBondContact O-N 2.91Å; H121-T138 PolarHBondContact O-OG1 2.75Å; H121-K139 HydrophobicContact CB-CD 4.14Å; H121-K139 HydrophobicContact CB-CG 4.09Å; H121-K139 PolarHBondContact CD2-NZ 3.19Å; H121-K139 WeakPolarHBondContact CE1-CE 3.33Å; H121-K139 PolarHBondContact CE1-NZ 2.89Å; H121-K139 WeakPolarHBondContact ND1-CE 3.24Å; H121-K139 WeakPolarHBondContact NE2-CE 3.37Å; H121-K139 PolarHBondContact NE2-NZ 3.08Å
122	W	94.9	Very high	92.5	Very high	30 Å²	30	60.8 Å²	60.8	11%	0.114	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.8	169.5	-69.6	82	0	0	0	110.4	L118 P119 S120 W136 N137 D142 C144 P148 I155	L118-W122 HydrophobicContact CB-CB 4.4Å; L118-W122 HydrophobicContact CD2-CB 4.25Å; P119-W122 PolarHBondContact O-N 3.46Å; S120-W122 PolarHBondContact O-N 3.09Å; W122-W136 WeakPolarHBondContact CA-O 3.33Å; W122-N137 HydrophobicContact CD2-CB 3.87Å; W122-N137 HydrophobicContact CE3-CB 4.09Å; W122-N137 HydrophobicContact CH2-CB 4.04Å; W122-N137 HydrophobicContact CZ2-CB 3.8Å; W122-N137 HydrophobicContact CZ3-CB 4.17Å; W122-D142 HydrophobicContact CH2-CB 4.08Å; W122-C144 HydrophobicContact CZ3-CB 4.25Å; W122-P148 HydrophobicContact CB-CG 4.47Å; W122-P148 HydrophobicContact CD2-CB 4.29Å; W122-P148 HydrophobicContact CD2-CG 3.15Å; W122-P148 HydrophobicContact CE3-CG 3.42Å; W122-P148 VanDerWaalsContact CE3-CG 3.42Å; W122-P148 HydrophobicContact CG-CG 3.65Å; W122-P148 HydrophobicContact CH2-CB 4.32Å; W122-P148 HydrophobicContact CH2-CG 3.77Å; W122-P148 HydrophobicContact CZ2-CB 3.91Å; W122-P148 HydrophobicContact CZ2-CG 3.54Å; W122-P148 HydrophobicContact CZ3-CG 3.72Å; W122-I155 HydrophobicContact CH2-CD1 4.47Å; W122-I155 HydrophobicContact CH2-CG1 4.29Å; W122-I155 HydrophobicContact CH2-CG2 4.04Å; W122-I155 HydrophobicContact CZ2-CD1 4.32Å; W122-I155 HydrophobicContact CZ2-CG2 4.49Å
123	I	93.8	Very high	92.4	Very high	59 Å²	59	60.5 Å²	60.5	30%	0.303	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.4	178.3	64	171	0	0	0	110.8	L69 V125 Y135 W136 T138	L69-I123 HydrophobicContact CB-CD1 4.43Å; L69-I123 HydrophobicContact CD2-CD1 3.61Å; I123-V125 HydrophobicContact CG1-CG2 4.17Å; I123-Y135 WeakPolarHBondContact O-CA 3.21Å; I123-W136 HydrophobicContact CD1-CE3 3.58Å; I123-W136 HydrophobicContact CD1-CZ3 3.82Å; I123-W136 HydrophobicContact CG1-CB 4.41Å; I123-W136 HydrophobicContact CG1-CE3 3.99Å; I123-W136 PolarHBondContact N-O 3.44Å; I123-W136 PolarHBondContact O-N 3.43Å; I123-T138 HydrophobicContact CD1-CG2 3.81Å; I123-T138 HydrophobicContact CG1-CG2 3.99Å; I123-T138 HydrophobicContact CG2-CG2 3.99Å
124	E	94.2	Very high	92.4	Very high	49 Å²	49	61 Å²	61	23%	0.229	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	127.2	177.1	-54.3	-173.1	158.5	0	0	109.7	V68 L69 K109 L113 L118 Y135	V68-E124 HydrophobicContact CG1-CB 4.47Å; L69-E124 PolarHBondContact N-O 2.9Å; K109-E124 WeakPolarHBondContact CE-OE1 3.44Å; K109-E124 WeakPolarHBondContact CE-OE2 3.34Å; K109-E124 IonicContact NZ-OE1 3.67Å; K109-E124 IonicContact NZ-OE2 3.73Å; K109-E124 PolarHBondContact NZ-OE2 3.32Å; L113-E124 WeakPolarHBondContact CD1-OE1 3.06Å; L118-E124 HydrophobicContact CD1-CG 3.41Å; L118-E124 VanDerWaalsContact CD1-CG 3.41Å; E124-Y135 HydrophobicContact CG-CD1 4.14Å; E124-Y135 HydrophobicContact CG-CE1 3.95Å
125	V	93.2	Very high	92.5	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.8	179.1	-165.8	0	0	0	0	110.5	L69 I123 F133 Y134 W136	L69-V125 HydrophobicContact CB-CG1 4.34Å; L69-V125 HydrophobicContact CB-CG2 4.25Å; L69-V125 HydrophobicContact CD2-CG1 4.28Å; L69-V125 HydrophobicContact CD2-CG2 3.93Å; L69-V125 HydrophobicContact CG-CG1 4.01Å; L69-V125 HydrophobicContact CG-CG2 4.29Å; L69-V125 CarbonylContact O-C 3.51Å; L69-V125 WeakPolarHBondContact O-CA 3.17Å; L69-V125 WeakPolarHBondContact O-CG1 3.35Å; I123-V125 HydrophobicContact CG1-CG2 4.17Å; V125-F133 CarbonylContact O-C 3.55Å; V125-F133 WeakPolarHBondContact O-CA 3.32Å; V125-Y134 HydrophobicContact CB-CD1 4.07Å; V125-Y134 HydrophobicContact CB-CD2 4.05Å; V125-Y134 HydrophobicContact CB-CE1 3.69Å; V125-Y134 HydrophobicContact CB-CE2 3.67Å; V125-Y134 HydrophobicContact CB-CG 4.25Å; V125-Y134 VanDerWaalsContact CB-CZ 3.49Å; V125-Y134 HydrophobicContact CG1-CD1 4.35Å; V125-Y134 HydrophobicContact CG1-CE1 3.5Å; V125-Y134 HydrophobicContact CG1-CE2 3.94Å; V125-Y134 WeakPolarHBondContact CG1-OH 3.38Å; V125-Y134 HydrophobicContact CG2-CD2 4.46Å; V125-Y134 HydrophobicContact CG2-CE2 3.99Å; V125-Y134 PolarHBondContact N-O 2.81Å; V125-Y134 WeakPolarHBondContact O-CD1 3.47Å; V125-Y134 PolarHBondContact O-N 3.01Å; V125-Y134 VanDerWaalsContact O-O 3.12Å; V125-W136 HydrophobicContact CG2-CB 3.82Å; V125-W136 HydrophobicContact CG2-CE3 4.28Å
126	G	93	Very high	92.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.7	173	0	0	0	0	0	110.9	L69 H71 F99 P128	L69-G126 PolarHBondContact O-N 2.89Å; H71-G126 PolarHBondContact N-O 2.91Å; F99-G126 VanDerWaalsContact CE2-CA 3.48Å; G126-P128 WeakPolarHBondContact O-CD 3.2Å
127	D	91	Very high	92.5	Very high	21 Å²	21	45.6 Å²	45.6	11%	0.112	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.2	171.4	173.2	19.5	0	0	0	110.2	F99 V129 T130 G131 R132 Y134	F99-D127 WeakPolarHBondContact CD2-O 2.93Å; F99-D127 WeakPolarHBondContact CE2-O 3.47Å; D127-V129 PolarHBondContact O-N 3.31Å; D127-V129 WeakPolarHBondContact OD1-CB 3.43Å; D127-V129 PolarHBondContact OD1-N 3.16Å; D127-T130 WeakPolarHBondContact CB-OG1 3.45Å; D127-T130 VanDerWaalsContact CG-OG1 3.29Å; D127-T130 PolarHBondContact O-N 3.15Å; D127-T130 WeakPolarHBondContact OD2-CB 3.5Å; D127-T130 WeakPolarHBondContact OD2-CG2 3.38Å; D127-T130 PolarHBondContact OD2-N 3.32Å; D127-T130 PolarHBondContact OD2-OG1 3.3Å; D127-G131 WeakPolarHBondContact O-CA 3.22Å; D127-G131 PolarHBondContact O-N 2.87Å; D127-R132 PolarHBondContact N-O 2.64Å; D127-Y134 HydrophobicContact CB-CD1 4.04Å; D127-Y134 HydrophobicContact CB-CE1 4.02Å
128	P	89.4	Confident	92.4	Very high	10 Å²	10	45 Å²	45	7%	0.065	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.4	179.8	31.3	-38.8	0	0	0	113.5	H71 C73 R97 G126	H71-P128 VanDerWaalsContact O-CD 3.31Å; H71-P128 WeakPolarHBondContact O-CD 3.4Å; H71-P128 VanDerWaalsContact O-CG 3.23Å; H71-P128 WeakPolarHBondContact O-CG 3.25Å; C73-P128 HydrophobicContact CB-CG 3.76Å; R97-P128 HydrophobicContact CB-CB 4.22Å; R97-P128 WeakPolarHBondContact CD-O 3.25Å; R97-P128 HydrophobicContact CG-CB 3.84Å; G126-P128 WeakPolarHBondContact O-CD 3.2Å
129	V	86.5	Confident	92.5	Very high	86 Å²	86	49.4 Å²	49.4	52%	0.521	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-43.7	179.4	-173	0	0	0	0	110.6	D127	D127-V129 PolarHBondContact O-N 3.31Å; D127-V129 WeakPolarHBondContact OD1-CB 3.43Å; D127-V129 PolarHBondContact OD1-N 3.16Å
130	T	89.2	Confident	92.5	Very high	68 Å²	68	50.8 Å²	50.8	42%	0.417	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-16.6	-177.4	57.9	0	0	0	0	113.8	D127 R132 W145	D127-T130 WeakPolarHBondContact CB-OG1 3.45Å; D127-T130 VanDerWaalsContact CG-OG1 3.29Å; D127-T130 PolarHBondContact O-N 3.15Å; D127-T130 WeakPolarHBondContact OD2-CB 3.5Å; D127-T130 WeakPolarHBondContact OD2-CG2 3.38Å; D127-T130 PolarHBondContact OD2-N 3.32Å; D127-T130 PolarHBondContact OD2-OG1 3.3Å; T130-R132 PolarHBondContact O-N 3.13Å; T130-R132 PolarHBondContact OG1-N 3.38Å; T130-W145 HydrophobicContact CG2-CH2 4.37Å
131	G	89.5	Confident	92.7	Very high	10 Å²	10	49.9 Å²	49.9	10%	0.103	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	16.8	-172.1	0	0	0	0	0	113.1	N100 T101 D127	N100-G131 WeakPolarHBondContact O-CA 3.19Å; T101-G131 WeakPolarHBondContact CA-O 3.38Å; T101-G131 VanDerWaalsContact CB-O 3.24Å; T101-G131 WeakPolarHBondContact CB-O 3.25Å; T101-G131 PolarHBondContact OG1-O 3.34Å; D127-G131 WeakPolarHBondContact O-CA 3.22Å; D127-G131 PolarHBondContact O-N 2.87Å
132	R	92	Very high	92.8	Very high	136 Å²	136	47.6 Å²	47.6	51%	0.513	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	165.4	-177.4	-68.2	-178.8	173	-179.1	-0.8	111	D127 T130 W145	D127-R132 PolarHBondContact N-O 2.64Å; T130-R132 PolarHBondContact O-N 3.13Å; T130-R132 PolarHBondContact OG1-N 3.38Å; R132-W145 HydrophobicContact CB-CZ3 4.12Å
133	F	92.9	Very high	92.8	Very high	23 Å²	23	47.5 Å²	47.5	10%	0.101	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140	173.4	-57.7	-86.5	0	0	0	109.9	V68 F99 T101 K109 V125	V68-F133 HydrophobicContact CG1-CD1 4.17Å; V68-F133 HydrophobicContact CG1-CE1 4.02Å; V68-F133 HydrophobicContact CG2-CE1 4.39Å; F99-F133 HydrophobicContact CE1-CD1 4.44Å; F99-F133 AromaticContact CE1-CE1 3.64Å; F99-F133 HydrophobicContact CE1-CE1 3.64Å; F99-F133 AromaticContact CE1-CZ 3.76Å; F99-F133 HydrophobicContact CE1-CZ 3.76Å; F99-F133 HydrophobicContact CZ-CD1 4.02Å; F99-F133 AromaticContact CZ-CE1 3.6Å; F99-F133 HydrophobicContact CZ-CE1 3.6Å; F99-F133 HydrophobicContact CZ-CE2 4.27Å; F99-F133 AromaticContact CZ-CZ 3.76Å; F99-F133 HydrophobicContact CZ-CZ 3.76Å; T101-F133 HydrophobicContact CG2-CE2 3.94Å; T101-F133 HydrophobicContact CG2-CZ 3.8Å; K109-F133 HydrophobicContact CB-CD2 4.34Å; K109-F133 HydrophobicContact CD-CB 4.11Å; K109-F133 HydrophobicContact CD-CD1 4.01Å; K109-F133 HydrophobicContact CD-CD2 3.42Å; K109-F133 VanDerWaalsContact CD-CD2 3.42Å; K109-F133 HydrophobicContact CD-CE1 4.26Å; K109-F133 HydrophobicContact CD-CE2 3.71Å; K109-F133 HydrophobicContact CD-CG 3.57Å; K109-F133 HydrophobicContact CD-CZ 4.1Å; K109-F133 HydrophobicContact CG-CD2 4.44Å; V125-F133 CarbonylContact O-C 3.55Å; V125-F133 WeakPolarHBondContact O-CA 3.32Å
134	Y	94	Very high	92.9	Very high	43 Å²	43	45 Å²	45	17%	0.169	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	168.3	162.5	69.7	-86.2	0	0	0	108.9	V125 D127 W136 V143 C144	V125-Y134 HydrophobicContact CB-CD1 4.07Å; V125-Y134 HydrophobicContact CB-CD2 4.05Å; V125-Y134 HydrophobicContact CB-CE1 3.69Å; V125-Y134 HydrophobicContact CB-CE2 3.67Å; V125-Y134 HydrophobicContact CB-CG 4.25Å; V125-Y134 VanDerWaalsContact CB-CZ 3.49Å; V125-Y134 HydrophobicContact CG1-CD1 4.35Å; V125-Y134 HydrophobicContact CG1-CE1 3.5Å; V125-Y134 HydrophobicContact CG1-CE2 3.94Å; V125-Y134 WeakPolarHBondContact CG1-OH 3.38Å; V125-Y134 HydrophobicContact CG2-CD2 4.46Å; V125-Y134 HydrophobicContact CG2-CE2 3.99Å; V125-Y134 PolarHBondContact N-O 2.81Å; V125-Y134 WeakPolarHBondContact O-CD1 3.47Å; V125-Y134 PolarHBondContact O-N 3.01Å; V125-Y134 VanDerWaalsContact O-O 3.12Å; D127-Y134 HydrophobicContact CB-CD1 4.04Å; D127-Y134 HydrophobicContact CB-CE1 4.02Å; Y134-W136 HydrophobicContact CE2-CB 4.25Å; Y134-V143 HydrophobicContact CD2-CB 4.48Å; Y134-V143 HydrophobicContact CD2-CG1 4.44Å; Y134-V143 HydrophobicContact CE2-CG1 4.25Å; Y134-C144 CarbonylContact C-O 3.58Å; Y134-C144 WeakPolarHBondContact CA-O 3.47Å; Y134-C144 WeakPolarHBondContact CB-O 3.48Å
135	Y	95.3	Very high	92.9	Very high	1 Å²	1	48.5 Å²	48.5	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.6	-178.1	-53.3	-81.9	0	0	0	108.5	M112 L113 L118 I123 E124 V143 C144 L146	M112-Y135 HydrophobicContact CE-CE2 3.81Å; M112-Y135 WeakPolarHBondContact CE-OH 3.38Å; M112-Y135 HydrophobicContact SD-CE2 4.2Å; L113-Y135 HydrophobicContact CD2-CE1 3.94Å; L118-Y135 HydrophobicContact CD1-CD1 3.74Å; L118-Y135 HydrophobicContact CD1-CE1 3.77Å; L118-Y135 HydrophobicContact CD2-CD1 3.27Å; L118-Y135 HydrophobicContact CD2-CE1 3.64Å; L118-Y135 HydrophobicContact CD2-CG 3.82Å; L118-Y135 HydrophobicContact CG-CD1 4.1Å; L118-Y135 HydrophobicContact CG-CE1 4.17Å; I123-Y135 WeakPolarHBondContact O-CA 3.21Å; E124-Y135 HydrophobicContact CG-CD1 4.14Å; E124-Y135 HydrophobicContact CG-CE1 3.95Å; Y135-V143 WeakPolarHBondContact O-CA 3.12Å; Y135-C144 PolarHBondContact N-O 3.34Å; Y135-C144 PolarHBondContact O-N 3.47Å; Y135-L146 VanDerWaalsContact CD2-O 3.25Å; Y135-L146 WeakPolarHBondContact CD2-O 3.25Å; Y135-L146 VanDerWaalsContact CE2-C 3.44Å
136	W	95	Very high	93	Very high	73 Å²	73	50.3 Å²	50.3	28%	0.277	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.4	-177.3	169.6	42.1	0	0	0	110	L69 W122 I123 V125 Y134 D141 D142 V143	L69-W136 HydrophobicContact CD2-CE3 3.72Å; L69-W136 HydrophobicContact CD2-CZ3 3.59Å; W122-W136 WeakPolarHBondContact CA-O 3.33Å; I123-W136 HydrophobicContact CD1-CE3 3.58Å; I123-W136 HydrophobicContact CD1-CZ3 3.82Å; I123-W136 HydrophobicContact CG1-CB 4.41Å; I123-W136 HydrophobicContact CG1-CE3 3.99Å; I123-W136 PolarHBondContact N-O 3.44Å; I123-W136 PolarHBondContact O-N 3.43Å; V125-W136 HydrophobicContact CG2-CB 3.82Å; V125-W136 HydrophobicContact CG2-CE3 4.28Å; Y134-W136 HydrophobicContact CE2-CB 4.25Å; W136-D141 WeakPolarHBondContact CZ2-OD1 3.42Å; W136-D141 PolarHBondContact NE1-OD1 3.31Å; W136-D141 VanDerWaalsContact NE1-OD1 3.08Å; W136-D142 WeakPolarHBondContact CA-O 3.41Å; W136-V143 HydrophobicContact CB-CG1 4.37Å; W136-V143 HydrophobicContact CG-CG1 4.44Å
137	N	95.2	Very high	93.1	Very high	17 Å²	17	50.3 Å²	50.3	9%	0.091	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	111.7	173	-169.8	-17.7	0	0	0	110.4	H121 W122 K139 T140 D141 D142	H121-N137 WeakPolarHBondContact O-CA 3.45Å; W122-N137 HydrophobicContact CD2-CB 3.87Å; W122-N137 HydrophobicContact CE3-CB 4.09Å; W122-N137 HydrophobicContact CH2-CB 4.04Å; W122-N137 HydrophobicContact CZ2-CB 3.8Å; W122-N137 HydrophobicContact CZ3-CB 4.17Å; N137-K139 PolarHBondContact O-N 2.83Å; N137-K139 VanDerWaalsContact O-N 3.11Å; N137-K139 PolarHBondContact OD1-N 2.83Å; N137-T140 WeakPolarHBondContact CB-OG1 3.4Å; N137-T140 VanDerWaalsContact CG-OG1 3.25Å; N137-T140 PolarHBondContact ND2-OG1 3.34Å; N137-D141 VanDerWaalsContact O-CA 3.26Å; N137-D141 WeakPolarHBondContact O-CA 3.13Å; N137-D141 PolarHBondContact O-N 3.15Å; N137-D142 HydrophobicContact CB-CB 4.3Å; N137-D142 PolarHBondContact N-O 2.82Å
138	T	92.8	Very high	93.2	Very high	65 Å²	65	50.3 Å²	50.3	40%	0.399	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-15.4	179.4	54	0	0	0	0	114.9	H121 I123	H121-T138 PolarHBondContact O-N 2.91Å; H121-T138 PolarHBondContact O-OG1 2.75Å; I123-T138 HydrophobicContact CD1-CG2 3.81Å; I123-T138 HydrophobicContact CG1-CG2 3.99Å; I123-T138 HydrophobicContact CG2-CG2 3.99Å
139	K	94.5	Very high	93.4	Very high	142 Å²	142	54.5 Å²	54.5	62%	0.617	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-41.8	-179.9	-73.6	-175.9	170.1	176	0	114	H121 N137	H121-K139 HydrophobicContact CB-CD 4.14Å; H121-K139 HydrophobicContact CB-CG 4.09Å; H121-K139 PolarHBondContact CD2-NZ 3.19Å; H121-K139 WeakPolarHBondContact CE1-CE 3.33Å; H121-K139 PolarHBondContact CE1-NZ 2.89Å; H121-K139 WeakPolarHBondContact ND1-CE 3.24Å; H121-K139 WeakPolarHBondContact NE2-CE 3.37Å; H121-K139 PolarHBondContact NE2-NZ 3.08Å; N137-K139 PolarHBondContact O-N 2.83Å; N137-K139 VanDerWaalsContact O-N 3.11Å; N137-K139 PolarHBondContact OD1-N 2.83Å
140	T	94.4	Very high	93.8	Very high	66 Å²	66	50.7 Å²	50.7	41%	0.405	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-4.7	-173.6	59.8	0	0	0	0	113.1	N137 D142	N137-T140 WeakPolarHBondContact CB-OG1 3.4Å; N137-T140 VanDerWaalsContact CG-OG1 3.25Å; N137-T140 PolarHBondContact ND2-OG1 3.34Å; T140-D142 WeakPolarHBondContact CB-OD2 3.44Å; T140-D142 PolarHBondContact O-N 3.21Å; T140-D142 VanDerWaalsContact O-N 3.15Å; T140-D142 VanDerWaalsContact OG1-CG 3.26Å; T140-D142 PolarHBondContact OG1-OD2 3.47Å
141	D	93.4	Very high	94	Very high	69 Å²	69	52 Å²	52	37%	0.369	26%	0.256	S	S	.	.			trans	59	13.1	-171.2	-68.8	-39.9	0	0	0	115.6	W136 N137 P158	W136-D141 WeakPolarHBondContact CZ2-OD1 3.42Å; W136-D141 PolarHBondContact NE1-OD1 3.31Å; W136-D141 VanDerWaalsContact NE1-OD1 3.08Å; N137-D141 VanDerWaalsContact O-CA 3.26Å; N137-D141 WeakPolarHBondContact O-CA 3.13Å; N137-D141 PolarHBondContact O-N 3.15Å; D141-P158 HydrophobicContact CB-CG 4.5Å; D141-P158 VanDerWaalsContact O-CD 3.22Å; D141-P158 WeakPolarHBondContact O-CD 3.4Å; D141-P158 WeakPolarHBondContact O-CG 3.16Å
142	D	95.5	Very high	94.2	Very high	31 Å²	31	57.7 Å²	57.7	17%	0.166	28%	0.275	C	S	.	.			trans	-68.4	144.5	177.2	-65.7	-49.4	0	0	0	112.1	W122 W136 N137 T140 I155 Q157	W122-D142 HydrophobicContact CH2-CB 4.08Å; W136-D142 WeakPolarHBondContact CA-O 3.41Å; N137-D142 HydrophobicContact CB-CB 4.3Å; N137-D142 PolarHBondContact N-O 2.82Å; T140-D142 WeakPolarHBondContact CB-OD2 3.44Å; T140-D142 PolarHBondContact O-N 3.21Å; T140-D142 VanDerWaalsContact O-N 3.15Å; T140-D142 VanDerWaalsContact OG1-CG 3.26Å; T140-D142 PolarHBondContact OG1-OD2 3.47Å; D142-I155 HydrophobicContact CB-CG2 3.63Å; D142-Q157 PolarHBondContact OD1-NE2 3.06Å
143	V	95	Very high	94.3	Very high	28 Å²	28	52.3 Å²	52.3	17%	0.17	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.5	179.1	-62.5	0	0	0	0	111.3	Y134 Y135 W136 S156 P158	Y134-V143 HydrophobicContact CD2-CB 4.48Å; Y134-V143 HydrophobicContact CD2-CG1 4.44Å; Y134-V143 HydrophobicContact CE2-CG1 4.25Å; Y135-V143 WeakPolarHBondContact O-CA 3.12Å; W136-V143 HydrophobicContact CB-CG1 4.37Å; W136-V143 HydrophobicContact CG-CG1 4.44Å; V143-S156 WeakPolarHBondContact CG2-O 3.38Å; V143-S156 PolarHBondContact N-O 3.11Å; V143-S156 PolarHBondContact O-N 3.03Å; V143-S156 VanDerWaalsContact O-N 3.08Å; V143-S156 PolarHBondContact O-OG 2.86Å; V143-P158 HydrophobicContact CG1-CB 4.13Å; V143-P158 HydrophobicContact CG2-CB 4.32Å
144	C	95.4	Very high	94.4	Very high	6 Å²	6	59.2 Å²	59.2	4%	0.041	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	148.1	174.4	-165.9	0	0	0	0	111.3	W122 Y134 Y135 L146 K154	W122-C144 HydrophobicContact CZ3-CB 4.25Å; Y134-C144 CarbonylContact C-O 3.58Å; Y134-C144 WeakPolarHBondContact CA-O 3.47Å; Y134-C144 WeakPolarHBondContact CB-O 3.48Å; Y135-C144 PolarHBondContact N-O 3.34Å; Y135-C144 PolarHBondContact O-N 3.47Å; C144-L146 WeakPolarHBondContact CB-O 3.38Å; C144-L146 PolarHBondContact SG-O 2.94Å; C144-L146 VanDerWaalsContact SG-O 3.36Å; C144-K154 PolarHBondContact SG-O 3.42Å
145	W	94.4	Very high	94.4	Very high	122 Å²	122	61.3 Å²	61.3	46%	0.462	30%	0.303	S	S	.	.	S	Bend	trans	-81.8	-14.9	175.2	-68.7	100.9	0	0	0	114	T130 R132	T130-W145 HydrophobicContact CG2-CH2 4.37Å; R132-W145 HydrophobicContact CB-CZ3 4.12Å
146	L	94.7	Very high	94.4	Very high	39 Å²	39	64.2 Å²	64.2	20%	0.204	32%	0.323	C	S	.	.	S	Bend	trans	-119.8	161.2	177.7	-63	175.3	0	0	0	109.1	M112 Y135 C144 H150 R152 A153 I306	M112-L146 HydrophobicContact CE-CD2 4.07Å; Y135-L146 VanDerWaalsContact CD2-O 3.25Å; Y135-L146 WeakPolarHBondContact CD2-O 3.25Å; Y135-L146 VanDerWaalsContact CE2-C 3.44Å; C144-L146 WeakPolarHBondContact CB-O 3.38Å; C144-L146 PolarHBondContact SG-O 2.94Å; C144-L146 VanDerWaalsContact SG-O 3.36Å; L146-H150 HydrophobicContact CB-CB 4.14Å; L146-R152 HydrophobicContact CD1-CB 4.03Å; L146-A153 HydrophobicContact CB-CB 4.2Å; L146-I306 HydrophobicContact CD1-CD1 4.44Å
147	S	94.2	Very high	94.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.328	C	S	.	.			trans	-53.9	135.4	170.8	176.7	0	0	0	0	109.2	M112 Y116 L149 H150 A153	M112-S147 VanDerWaalsContact SD-CB 3.51Å; M112-S147 PolarHBondContact SD-N 3.37Å; Y116-S147 WeakPolarHBondContact O-CB 3.43Å; Y116-S147 PolarHBondContact O-OG 3.26Å; S147-L149 PolarHBondContact O-N 2.81Å; S147-H150 WeakPolarHBondContact O-CB 3.42Å; S147-H150 PolarHBondContact O-N 2.87Å; S147-A153 VanDerWaalsContact O-CB 3.32Å; S147-A153 WeakPolarHBondContact O-CB 3.5Å
148	P	94.3	Very high	94.2	Very high	22 Å²	22	64.7 Å²	64.7	14%	0.143	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-23.1	-177	-21.9	29.2	0	0	0	114.4	P119 W122 H150 I155	P119-P148 HydrophobicContact CG-CB 4.28Å; P119-P148 HydrophobicContact CG-CG 4.28Å; W122-P148 HydrophobicContact CB-CG 4.47Å; W122-P148 HydrophobicContact CD2-CB 4.29Å; W122-P148 HydrophobicContact CD2-CG 3.15Å; W122-P148 HydrophobicContact CE3-CG 3.42Å; W122-P148 VanDerWaalsContact CE3-CG 3.42Å; W122-P148 HydrophobicContact CG-CG 3.65Å; W122-P148 HydrophobicContact CH2-CB 4.32Å; W122-P148 HydrophobicContact CH2-CG 3.77Å; W122-P148 HydrophobicContact CZ2-CB 3.91Å; W122-P148 HydrophobicContact CZ2-CG 3.54Å; W122-P148 HydrophobicContact CZ3-CG 3.72Å; P148-H150 VanDerWaalsContact C-N 3.26Å; P148-I155 HydrophobicContact CB-CD1 4.19Å
149	L	93.7	Very high	94	Very high	97 Å²	97	63.4 Å²	63.4	51%	0.508	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-10.2	176.5	-59.4	-176.3	0	0	0	113	Y116 P117 P119 S147	Y116-L149 HydrophobicContact CD1-CB 4.11Å; Y116-L149 WeakPolarHBondContact CD1-O 3.48Å; P117-L149 WeakPolarHBondContact O-CD1 3.48Å; P119-L149 HydrophobicContact CG-CD1 4.37Å; P119-L149 HydrophobicContact CG-CD2 3.96Å; P119-L149 HydrophobicContact CG-CG 3.88Å; S147-L149 PolarHBondContact O-N 2.81Å
150	H	94.2	Very high	93.5	Very high	7 Å²	7	60.1 Å²	60.1	3%	0.032	32%	0.324	C	S	.	.	S	Bend	trans	-72.1	134.6	-179.1	-171.3	-79.2	0	0	0	110.1	Y116 L146 S147 P148 R152 A153 I306	Y116-H150 HydrophobicContact CD2-CB 4.37Å; Y116-H150 AromaticContact CD2-CD2 3.56Å; Y116-H150 AromaticContact CE2-CD2 3.42Å; Y116-H150 VanDerWaalsContact CE2-CD2 3.42Å; Y116-H150 WeakPolarHBondContact CE2-CD2 3.06Å; Y116-H150 HydrophobicContact CG-CB 4.39Å; L146-H150 HydrophobicContact CB-CB 4.14Å; S147-H150 WeakPolarHBondContact O-CB 3.42Å; S147-H150 PolarHBondContact O-N 2.87Å; P148-H150 VanDerWaalsContact C-N 3.26Å; H150-R152 WeakPolarHBondContact ND1-CB 3.48Å; H150-R152 PolarHBondContact ND1-N 2.85Å; H150-R152 PolarHBondContact O-N 2.87Å; H150-R152 VanDerWaalsContact O-N 3.1Å; H150-A153 HydrophobicContact CB-CB 4.19Å; H150-A153 WeakPolarHBondContact O-CB 3.32Å; H150-A153 PolarHBondContact O-N 2.99Å; H150-I306 VanDerWaalsContact CE1-CD1 3.43Å; H150-I306 WeakPolarHBondContact CE1-CD1 3.49Å; H150-I306 WeakPolarHBondContact NE2-CD1 3.46Å
151	P	94.3	Very high	93.3	Very high	94 Å²	94	59.7 Å²	59.7	61%	0.61	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-26.8	-175.7	23.5	-34.9	0	0	0	113.8
152	R	93.2	Very high	93.2	Very high	131 Å²	131	59.4 Å²	59.4	49%	0.494	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	1.9	176.3	-57	173.7	58.6	-178.2	-0	114.2	L146 H150 K154	L146-R152 HydrophobicContact CD1-CB 4.03Å; H150-R152 WeakPolarHBondContact ND1-CB 3.48Å; H150-R152 PolarHBondContact ND1-N 2.85Å; H150-R152 PolarHBondContact O-N 2.87Å; H150-R152 VanDerWaalsContact O-N 3.1Å; R152-K154 PolarHBondContact O-N 3Å
153	A	93.7	Very high	92.8	Very high	23 Å²	23	66 Å²	66	19%	0.19	34%	0.342	C	S	.	.			trans	-66.6	124.3	-179.3	0	0	0	0	0	110.6	L146 S147 H150	L146-A153 HydrophobicContact CB-CB 4.2Å; S147-A153 VanDerWaalsContact O-CB 3.32Å; S147-A153 WeakPolarHBondContact O-CB 3.5Å; H150-A153 HydrophobicContact CB-CB 4.19Å; H150-A153 WeakPolarHBondContact O-CB 3.32Å; H150-A153 PolarHBondContact O-N 2.99Å
154	K	94.3	Very high	92.5	Very high	167 Å²	167	66.5 Å²	66.5	73%	0.726	35%	0.349	S	S	*	.			trans	-104.4	101.5	171.7	-66.9	-175.7	-179.8	-178	0	108.2	C144 R152	C144-K154 PolarHBondContact SG-O 3.42Å; R152-K154 PolarHBondContact O-N 3Å
155	I	94.6	Very high	92.4	Very high	88 Å²	88	69.3 Å²	69.3	45%	0.451	36%	0.364	S	S	.	.			trans	-78.5	126.5	177.5	-58.9	171.7	0	0	0	107.7	W122 D142 P148	W122-I155 HydrophobicContact CH2-CD1 4.47Å; W122-I155 HydrophobicContact CH2-CG1 4.29Å; W122-I155 HydrophobicContact CH2-CG2 4.04Å; W122-I155 HydrophobicContact CZ2-CD1 4.32Å; W122-I155 HydrophobicContact CZ2-CG2 4.49Å; D142-I155 HydrophobicContact CB-CG2 3.63Å; P148-I155 HydrophobicContact CB-CD1 4.19Å
156	S	95.4	Very high	92.3	Very high	61 Å²	61	67 Å²	67	43%	0.427	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-139.9	157	-177.8	63.2	0	0	0	0	111.1	V143	V143-S156 WeakPolarHBondContact CG2-O 3.38Å; V143-S156 PolarHBondContact N-O 3.11Å; V143-S156 PolarHBondContact O-N 3.03Å; V143-S156 VanDerWaalsContact O-N 3.08Å; V143-S156 PolarHBondContact O-OG 2.86Å
157	Q	93.9	Very high	92.1	Very high	81 Å²	81	69.2 Å²	69.2	38%	0.379	38%	0.375	S	S	.	.			trans	-66.2	149.8	169.9	-71.9	-73.3	-46.7	0	0	110.4	D142 V162	D142-Q157 PolarHBondContact OD1-NE2 3.06Å; Q157-V162 HydrophobicContact CB-CG2 3.78Å
158	P	92.1	Very high	92	Very high	20 Å²	20	77.7 Å²	77.7	13%	0.13	41%	0.407	C	S	.	.			trans	-66.3	144.5	-175.1	27.5	-30.6	0	0	0	109.9	D141 V143 S160 I161 V162	D141-P158 HydrophobicContact CB-CG 4.5Å; D141-P158 VanDerWaalsContact O-CD 3.22Å; D141-P158 WeakPolarHBondContact O-CD 3.4Å; D141-P158 WeakPolarHBondContact O-CG 3.16Å; V143-P158 HydrophobicContact CG1-CB 4.13Å; V143-P158 HydrophobicContact CG2-CB 4.32Å; P158-S160 PolarHBondContact O-N 3.03Å; P158-I161 HydrophobicContact CG-CB 4.04Å; P158-I161 HydrophobicContact CG-CD1 3.48Å; P158-I161 VanDerWaalsContact CG-CD1 3.48Å; P158-I161 HydrophobicContact CG-CG1 3.73Å; P158-I161 PolarHBondContact O-N 3.06Å; P158-V162 PolarHBondContact O-N 3.31Å
159	G	88	Confident	92	Very high	38 Å²	38	82.7 Å²	82.7	39%	0.392	43%	0.428	S	S	.	.	H	α-helix	trans	-57.7	-27.8	-172.1	0	0	0	0	0	114.2	R163	G159-R163 VanDerWaalsContact O-CB 3.29Å; G159-R163 WeakPolarHBondContact O-CB 3.26Å; G159-R163 WeakPolarHBondContact O-CG 3.24Å; G159-R163 PolarHBondContact O-N 3.36Å; G159-R163 PolarHBondContact O-NE 3.15Å
160	S	85.2	Confident	92	Very high	73 Å²	73	85.2 Å²	85.2	51%	0.51	43%	0.431	S	S	.	.	H	α-helix	trans	-64.2	-45.2	173.4	50.3	0	0	0	0	112.6	P158 A164	P158-S160 PolarHBondContact O-N 3.03Å; S160-A164 WeakPolarHBondContact O-CB 3.36Å; S160-A164 PolarHBondContact O-N 2.58Å
161	I	89.8	Confident	92.1	Very high	56 Å²	56	88.2 Å²	88.2	29%	0.287	45%	0.447	S	S	.	.	H	α-helix	trans	-68.3	-44.7	177.9	-65.2	-179.2	0	0	0	109.9	P158 R163 A164 N165	P158-I161 HydrophobicContact CG-CB 4.04Å; P158-I161 HydrophobicContact CG-CD1 3.48Å; P158-I161 VanDerWaalsContact CG-CD1 3.48Å; P158-I161 HydrophobicContact CG-CG1 3.73Å; P158-I161 PolarHBondContact O-N 3.06Å; I161-R163 PolarHBondContact O-N 3.04Å; I161-A164 PolarHBondContact O-N 2.97Å; I161-A164 VanDerWaalsContact O-N 3.17Å; I161-N165 WeakPolarHBondContact O-CB 3.22Å; I161-N165 VanDerWaalsContact O-CG 3.31Å; I161-N165 PolarHBondContact O-N 3.04Å
162	V	90.9	Very high	92.1	Very high	64 Å²	64	86.6 Å²	86.6	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-60.5	-44.4	177.2	178.2	0	0	0	0	111.2	Q157 P158 A164 N165 T166	Q157-V162 HydrophobicContact CB-CG2 3.78Å; P158-V162 PolarHBondContact O-N 3.31Å; V162-A164 PolarHBondContact O-N 3.39Å; V162-N165 PolarHBondContact O-N 3.08Å; V162-T166 HydrophobicContact CG1-CG2 4.46Å; V162-T166 WeakPolarHBondContact O-CG2 3.39Å; V162-T166 PolarHBondContact O-N 3.21Å; V162-T166 PolarHBondContact O-OG1 3.09Å
163	R	87.7	Confident	92.2	Very high	169 Å²	169	83.4 Å²	83.4	64%	0.638	44%	0.443	S	S	*	.	H	α-helix	trans	-62.9	-39.9	174.8	-76.7	-173.9	-61.7	-104.8	5.5	112.5	G159 I161 T166 L167	G159-R163 VanDerWaalsContact O-CB 3.29Å; G159-R163 WeakPolarHBondContact O-CB 3.26Å; G159-R163 WeakPolarHBondContact O-CG 3.24Å; G159-R163 PolarHBondContact O-N 3.36Å; G159-R163 PolarHBondContact O-NE 3.15Å; I161-R163 PolarHBondContact O-N 3.04Å; R163-T166 WeakPolarHBondContact CA-OG1 3.46Å; R163-T166 PolarHBondContact O-OG1 2.85Å; R163-L167 WeakPolarHBondContact O-CB 3.2Å; R163-L167 PolarHBondContact O-N 2.83Å
164	A	89.4	Confident	92.2	Very high	39 Å²	39	89.8 Å²	89.8	32%	0.322	46%	0.463	S	S	.	.	H	α-helix	trans	-66.8	-41.3	177.7	0	0	0	0	0	112	S160 I161 V162 L167 R168	S160-A164 WeakPolarHBondContact O-CB 3.36Å; S160-A164 PolarHBondContact O-N 2.58Å; I161-A164 PolarHBondContact O-N 2.97Å; I161-A164 VanDerWaalsContact O-N 3.17Å; V162-A164 PolarHBondContact O-N 3.39Å; A164-L167 PolarHBondContact O-N 3.26Å; A164-R168 VanDerWaalsContact O-CG 3.31Å; A164-R168 WeakPolarHBondContact O-CG 3.46Å; A164-R168 PolarHBondContact O-N 2.9Å
165	N	93.2	Very high	92.2	Very high	65 Å²	65	84.5 Å²	84.5	35%	0.348	45%	0.45	S	S	.	.	H	α-helix	trans	-66.7	-46.9	178.3	-70.5	-12.2	0	0	0	111.5	I161 V162 L167 R168 E169	I161-N165 WeakPolarHBondContact O-CB 3.22Å; I161-N165 VanDerWaalsContact O-CG 3.31Å; I161-N165 PolarHBondContact O-N 3.04Å; V162-N165 PolarHBondContact O-N 3.08Å; N165-L167 VanDerWaalsContact C-N 3.29Å; N165-L167 PolarHBondContact O-N 3.41Å; N165-R168 WeakPolarHBondContact O-CB 3.48Å; N165-R168 PolarHBondContact O-N 3.33Å; N165-R168 VanDerWaalsContact O-N 3.14Å; N165-E169 WeakPolarHBondContact O-CG 3.21Å; N165-E169 PolarHBondContact O-N 3.27Å
166	T	92.5	Very high	92.2	Very high	72 Å²	72	83.2 Å²	83.2	44%	0.442	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-37.2	176.6	51	0	0	0	0	112.1	V162 R163 R170	V162-T166 HydrophobicContact CG1-CG2 4.46Å; V162-T166 WeakPolarHBondContact O-CG2 3.39Å; V162-T166 PolarHBondContact O-N 3.21Å; V162-T166 PolarHBondContact O-OG1 3.09Å; R163-T166 WeakPolarHBondContact CA-OG1 3.46Å; R163-T166 PolarHBondContact O-OG1 2.85Å; T166-R170 WeakPolarHBondContact O-CB 3.29Å; T166-R170 PolarHBondContact O-N 3.06Å
167	L	89.9	Confident	92.2	Very high	87 Å²	87	83 Å²	83	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-64.9	-45.1	173.9	-172.8	66.1	0	0	0	111.8	R163 A164 N165 E169 R170 D171	R163-L167 WeakPolarHBondContact O-CB 3.2Å; R163-L167 PolarHBondContact O-N 2.83Å; A164-L167 PolarHBondContact O-N 3.26Å; N165-L167 VanDerWaalsContact C-N 3.29Å; N165-L167 PolarHBondContact O-N 3.41Å; L167-E169 PolarHBondContact O-N 3.4Å; L167-R170 PolarHBondContact O-N 3.14Å; L167-D171 WeakPolarHBondContact O-CB 3.39Å; L167-D171 VanDerWaalsContact O-CG 3.22Å; L167-D171 PolarHBondContact O-N 3.44Å
168	R	92.7	Very high	92.2	Very high	177 Å²	177	84 Å²	84	67%	0.668	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-43.2	176.6	-75	171.1	179.8	174	-0.4	112.1	A164 N165 D171 A172	A164-R168 VanDerWaalsContact O-CG 3.31Å; A164-R168 WeakPolarHBondContact O-CG 3.46Å; A164-R168 PolarHBondContact O-N 2.9Å; N165-R168 WeakPolarHBondContact O-CB 3.48Å; N165-R168 PolarHBondContact O-N 3.33Å; N165-R168 VanDerWaalsContact O-N 3.14Å; R168-D171 PolarHBondContact O-N 3.43Å; R168-A172 VanDerWaalsContact O-CB 3.28Å; R168-A172 WeakPolarHBondContact O-CB 3.36Å; R168-A172 PolarHBondContact O-N 3.06Å
169	E	94	Very high	92.3	Very high	127 Å²	127	85.9 Å²	85.9	59%	0.593	48%	0.477	S	S	*	.	H	α-helix	trans	-63.1	-44.8	176.5	-73.6	168.7	-172.5	0	0	111.4	N165 L167 A172 A173	N165-E169 WeakPolarHBondContact O-CG 3.21Å; N165-E169 PolarHBondContact O-N 3.27Å; L167-E169 PolarHBondContact O-N 3.4Å; E169-A172 PolarHBondContact O-N 2.95Å; E169-A173 WeakPolarHBondContact O-CB 3.47Å; E169-A173 PolarHBondContact O-N 3.1Å
170	R	94.1	Very high	92.6	Very high	150 Å²	150	86.7 Å²	86.7	57%	0.566	48%	0.48	S	S	*	.	H	α-helix	trans	-63.3	-43.1	177.1	-169.9	-164.8	69.2	130.9	7.5	111.9	T166 L167 A173 R174	T166-R170 WeakPolarHBondContact O-CB 3.29Å; T166-R170 PolarHBondContact O-N 3.06Å; L167-R170 PolarHBondContact O-N 3.14Å; R170-A173 PolarHBondContact O-N 3.05Å; R170-R174 WeakPolarHBondContact O-CB 3.33Å; R170-R174 PolarHBondContact O-N 2.98Å
171	D	94.4	Very high	93	Very high	71 Å²	71	87.3 Å²	87.3	38%	0.38	48%	0.48	S	S	.	.	H	α-helix	trans	-69.1	-35.9	178.7	-67.2	-13	0	0	0	111.1	L167 R168 R174 A175	L167-D171 WeakPolarHBondContact O-CB 3.39Å; L167-D171 VanDerWaalsContact O-CG 3.22Å; L167-D171 PolarHBondContact O-N 3.44Å; R168-D171 PolarHBondContact O-N 3.43Å; D171-R174 PolarHBondContact O-N 2.93Å; D171-A175 WeakPolarHBondContact O-CB 3.33Å; D171-A175 PolarHBondContact O-N 3.43Å
172	A	95.4	Very high	93.2	Very high	60 Å²	60	87.2 Å²	87.2	50%	0.496	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-41.9	171.7	0	0	0	0	0	112.2	R168 E169 A175 A176	R168-A172 VanDerWaalsContact O-CB 3.28Å; R168-A172 WeakPolarHBondContact O-CB 3.36Å; R168-A172 PolarHBondContact O-N 3.06Å; E169-A172 PolarHBondContact O-N 2.95Å; A172-A175 PolarHBondContact O-N 3.36Å; A172-A176 WeakPolarHBondContact O-CB 3.31Å; A172-A176 PolarHBondContact O-N 3.17Å
173	A	95.4	Very high	93.3	Very high	63 Å²	63	87 Å²	87	52%	0.521	49%	0.493	S	S	.	.	H	α-helix	trans	-63.5	-41.8	175.1	0	0	0	0	0	111.6	E169 R170 A176 A177	E169-A173 WeakPolarHBondContact O-CB 3.47Å; E169-A173 PolarHBondContact O-N 3.1Å; R170-A173 PolarHBondContact O-N 3.05Å; A173-A176 PolarHBondContact O-N 2.98Å; A173-A177 WeakPolarHBondContact O-CB 3.49Å; A173-A177 PolarHBondContact O-N 2.86Å
174	R	94.6	Very high	93.6	Very high	158 Å²	158	83.1 Å²	83.1	60%	0.596	49%	0.488	S	S	*	.	H	α-helix	trans	-62.5	-46.2	173.8	-177.3	178.4	177.2	158.4	4.9	111.7	R170 D171 A176 A177 E178	R170-R174 WeakPolarHBondContact O-CB 3.33Å; R170-R174 PolarHBondContact O-N 2.98Å; D171-R174 PolarHBondContact O-N 2.93Å; R174-A176 VanDerWaalsContact C-N 3.31Å; R174-A176 PolarHBondContact O-N 2.73Å; R174-A177 PolarHBondContact O-N 3.06Å; R174-E178 HydrophobicContact CG-CG 4.5Å; R174-E178 IonicContact CZ-OE1 3.36Å; R174-E178 IonicContact NE-OE1 3.6Å; R174-E178 PolarHBondContact NE-OE1 3.33Å; R174-E178 IonicContact NH2-OE1 3.12Å; R174-E178 WeakPolarHBondContact O-CB 3.37Å; R174-E178 WeakPolarHBondContact O-CG 3.34Å; R174-E178 PolarHBondContact O-N 3.32Å
175	A	94.4	Very high	93.7	Very high	55 Å²	55	86.5 Å²	86.5	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-37.1	177	0	0	0	0	0	112.3	D171 A172 A179	D171-A175 WeakPolarHBondContact O-CB 3.33Å; D171-A175 PolarHBondContact O-N 3.43Å; A172-A175 PolarHBondContact O-N 3.36Å; A175-A179 VanDerWaalsContact O-CB 3.27Å; A175-A179 WeakPolarHBondContact O-CB 3.43Å; A175-A179 PolarHBondContact O-N 3.35Å
176	A	94.6	Very high	93.7	Very high	61 Å²	61	86.4 Å²	86.4	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-41.1	174.3	0	0	0	0	0	112.1	A172 A173 R174 A179 A180	A172-A176 WeakPolarHBondContact O-CB 3.31Å; A172-A176 PolarHBondContact O-N 3.17Å; A173-A176 PolarHBondContact O-N 2.98Å; R174-A176 VanDerWaalsContact C-N 3.31Å; R174-A176 PolarHBondContact O-N 2.73Å; A176-A179 PolarHBondContact O-N 3.38Å; A176-A180 WeakPolarHBondContact O-CB 3.42Å; A176-A180 PolarHBondContact O-N 3.14Å
177	A	94.8	Very high	93.6	Very high	57 Å²	57	85.9 Å²	85.9	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-45.7	174.3	0	0	0	0	0	111.6	A173 R174 A179 A180 T181	A173-A177 WeakPolarHBondContact O-CB 3.49Å; A173-A177 PolarHBondContact O-N 2.86Å; R174-A177 PolarHBondContact O-N 3.06Å; A177-A179 VanDerWaalsContact C-N 3.34Å; A177-A179 PolarHBondContact O-N 3.46Å; A177-A180 PolarHBondContact O-N 2.98Å; A177-T181 WeakPolarHBondContact O-CG2 3.32Å; A177-T181 PolarHBondContact O-N 3Å; A177-T181 PolarHBondContact O-OG1 2.85Å
178	E	93.9	Very high	93.6	Very high	101 Å²	101	87.2 Å²	87.2	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-42.7	174.9	-72.9	175	-171	0	0	111.1	R174 A180 T181 A182	R174-E178 HydrophobicContact CG-CG 4.5Å; R174-E178 IonicContact CZ-OE1 3.36Å; R174-E178 IonicContact NE-OE1 3.6Å; R174-E178 PolarHBondContact NE-OE1 3.33Å; R174-E178 IonicContact NH2-OE1 3.12Å; R174-E178 WeakPolarHBondContact O-CB 3.37Å; R174-E178 WeakPolarHBondContact O-CG 3.34Å; R174-E178 PolarHBondContact O-N 3.32Å; E178-A180 PolarHBondContact O-N 2.92Å; E178-T181 WeakPolarHBondContact CA-OG1 3.22Å; E178-T181 PolarHBondContact O-N 3.31Å; E178-T181 PolarHBondContact O-OG1 2.85Å; E178-A182 WeakPolarHBondContact O-CB 2.75Å; E178-A182 PolarHBondContact O-N 2.96Å
179	A	93.8	Very high	93.5	Very high	61 Å²	61	86.6 Å²	86.6	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-39.6	174.5	0	0	0	0	0	112.8	A175 A176 A177 A182 A183	A175-A179 VanDerWaalsContact O-CB 3.27Å; A175-A179 WeakPolarHBondContact O-CB 3.43Å; A175-A179 PolarHBondContact O-N 3.35Å; A176-A179 PolarHBondContact O-N 3.38Å; A177-A179 VanDerWaalsContact C-N 3.34Å; A177-A179 PolarHBondContact O-N 3.46Å; A179-A182 PolarHBondContact O-N 3.03Å; A179-A183 WeakPolarHBondContact O-CB 3.48Å; A179-A183 PolarHBondContact O-N 3.47Å
180	A	94	Very high	93.2	Very high	55 Å²	55	86.6 Å²	86.6	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-46	174.8	0	0	0	0	0	111.3	A176 A177 E178 A182 A183 V184	A176-A180 WeakPolarHBondContact O-CB 3.42Å; A176-A180 PolarHBondContact O-N 3.14Å; A177-A180 PolarHBondContact O-N 2.98Å; E178-A180 PolarHBondContact O-N 2.92Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 2.99Å; A180-A183 WeakPolarHBondContact O-CB 3.16Å; A180-A183 PolarHBondContact O-N 2.78Å; A180-V184 WeakPolarHBondContact O-CG2 3.4Å; A180-V184 PolarHBondContact O-N 2.91Å
181	T	94	Very high	92.7	Very high	85 Å²	85	82.8 Å²	82.8	52%	0.521	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-40.3	175.7	61.7	0	0	0	0	112	A177 E178 A183 V184 L185	A177-T181 WeakPolarHBondContact O-CG2 3.32Å; A177-T181 PolarHBondContact O-N 3Å; A177-T181 PolarHBondContact O-OG1 2.85Å; E178-T181 WeakPolarHBondContact CA-OG1 3.22Å; E178-T181 PolarHBondContact O-N 3.31Å; E178-T181 PolarHBondContact O-OG1 2.85Å; T181-A183 VanDerWaalsContact C-N 3.34Å; T181-A183 PolarHBondContact O-N 3.49Å; T181-V184 PolarHBondContact O-N 2.89Å; T181-L185 WeakPolarHBondContact O-CG 3.4Å; T181-L185 PolarHBondContact O-N 2.88Å
182	A	93.7	Very high	92.1	Very high	54 Å²	54	83 Å²	83	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-36.7	174.9	0	0	0	0	0	112.3	E178 A179 A180 A186	E178-A182 WeakPolarHBondContact O-CB 2.75Å; E178-A182 PolarHBondContact O-N 2.96Å; A179-A182 PolarHBondContact O-N 3.03Å; A180-A182 VanDerWaalsContact C-N 3.34Å; A180-A182 PolarHBondContact O-N 2.99Å; A182-A186 VanDerWaalsContact O-CB 3.27Å; A182-A186 WeakPolarHBondContact O-CB 3.36Å; A182-A186 PolarHBondContact O-N 2.93Å
183	A	93.6	Very high	91.5	Very high	61 Å²	61	87.3 Å²	87.3	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-40.6	175	0	0	0	0	0	112	A179 A180 T181 A186 A187	A179-A183 WeakPolarHBondContact O-CB 3.48Å; A179-A183 PolarHBondContact O-N 3.47Å; A180-A183 WeakPolarHBondContact O-CB 3.16Å; A180-A183 PolarHBondContact O-N 2.78Å; T181-A183 VanDerWaalsContact C-N 3.34Å; T181-A183 PolarHBondContact O-N 3.49Å; A183-A186 PolarHBondContact O-N 2.84Å; A183-A187 WeakPolarHBondContact O-CB 3.18Å; A183-A187 PolarHBondContact O-N 3.09Å
184	V	93.2	Very high	90.6	Very high	86 Å²	86	92.1 Å²	92.1	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-61.6	-50.8	173.9	174	0	0	0	0	110.7	A180 T181 A186 A187 E188	A180-V184 WeakPolarHBondContact O-CG2 3.4Å; A180-V184 PolarHBondContact O-N 2.91Å; T181-V184 PolarHBondContact O-N 2.89Å; V184-A186 VanDerWaalsContact C-N 3.28Å; V184-A186 PolarHBondContact O-N 3.09Å; V184-A187 WeakPolarHBondContact O-CB 3.28Å; V184-A187 PolarHBondContact O-N 2.59Å; V184-E188 PolarHBondContact O-N 3.32Å
185	L	92.2	Very high	89.6	Confident	111 Å²	111	93.1 Å²	93.1	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-61.2	-35.7	177.5	-68.4	173.5	0	0	0	112.5	T181 R189	T181-L185 WeakPolarHBondContact O-CG 3.4Å; T181-L185 PolarHBondContact O-N 2.88Å; L185-R189 WeakPolarHBondContact O-CB 3.48Å; L185-R189 PolarHBondContact O-N 2.8Å
186	A	92.4	Very high	88.5	Confident	62 Å²	62	94 Å²	94	51%	0.512	52%	0.524	S	S	.	.	H	α-helix	trans	-67.5	-36.5	174.8	0	0	0	0	0	112.3	A182 A183 V184 K190	A182-A186 VanDerWaalsContact O-CB 3.27Å; A182-A186 WeakPolarHBondContact O-CB 3.36Å; A182-A186 PolarHBondContact O-N 2.93Å; A183-A186 PolarHBondContact O-N 2.84Å; V184-A186 VanDerWaalsContact C-N 3.28Å; V184-A186 PolarHBondContact O-N 3.09Å; A186-K190 PolarHBondContact O-N 3.42Å; A186-K190 VanDerWaalsContact O-N 3.1Å
187	A	91.3	Very high	87	Confident	62 Å²	62	95.6 Å²	95.6	51%	0.512	53%	0.531	S	S	.	.	H	α-helix	trans	-67.2	-44.5	174.4	0	0	0	0	0	111.5	A183 V184 R189 K190 D191	A183-A187 WeakPolarHBondContact O-CB 3.18Å; A183-A187 PolarHBondContact O-N 3.09Å; V184-A187 WeakPolarHBondContact O-CB 3.28Å; V184-A187 PolarHBondContact O-N 2.59Å; A187-R189 VanDerWaalsContact C-N 3.32Å; A187-R189 PolarHBondContact O-N 2.89Å; A187-K190 WeakPolarHBondContact O-CB 3.33Å; A187-K190 PolarHBondContact O-N 2.89Å; A187-D191 PolarHBondContact O-N 3.29Å
188	E	89.3	Confident	85.3	Confident	114 Å²	114	99.6 Å²	99.6	53%	0.533	55%	0.545	S	S	.	.	H	α-helix	trans	-60.2	-41.1	175	-70.2	-175.9	153.9	0	0	112.1	V184 K190 D191 S192	V184-E188 PolarHBondContact O-N 3.32Å; E188-K190 VanDerWaalsContact C-N 3.28Å; E188-K190 PolarHBondContact O-N 2.65Å; E188-D191 PolarHBondContact O-N 2.99Å; E188-S192 WeakPolarHBondContact O-CB 3.13Å; E188-S192 PolarHBondContact O-N 2.91Å; E188-S192 PolarHBondContact O-OG 3.34Å
189	R	90	Very high	83.5	Confident	165 Å²	165	99.8 Å²	99.8	62%	0.623	56%	0.557	S	S	*	*	H	α-helix	trans	-64.4	-33.6	175	-168.1	176.1	-174.4	-168.6	1.7	112.1	L185 A187 R193	L185-R189 WeakPolarHBondContact O-CB 3.48Å; L185-R189 PolarHBondContact O-N 2.8Å; A187-R189 VanDerWaalsContact C-N 3.32Å; A187-R189 PolarHBondContact O-N 2.89Å; R189-R193 WeakPolarHBondContact O-CG 3.36Å; R189-R193 PolarHBondContact O-N 2.89Å
190	K	87.6	Confident	81.6	Confident	126 Å²	126	99.9 Å²	99.9	55%	0.548	56%	0.563	S	S	.	*	H	α-helix	trans	-72.8	-39.9	176	-172	178.5	178.7	-179.5	0	111.6	A186 A187 E188 R193 R194	A186-K190 PolarHBondContact O-N 3.42Å; A186-K190 VanDerWaalsContact O-N 3.1Å; A187-K190 WeakPolarHBondContact O-CB 3.33Å; A187-K190 PolarHBondContact O-N 2.89Å; E188-K190 VanDerWaalsContact C-N 3.28Å; E188-K190 PolarHBondContact O-N 2.65Å; K190-R193 PolarHBondContact O-N 3.19Å; K190-R194 WeakPolarHBondContact O-CG 3.35Å; K190-R194 PolarHBondContact O-N 3.19Å; K190-R194 VanDerWaalsContact O-N 3.08Å
191	D	84.5	Confident	79.7	Confident	71 Å²	71	102 Å²	102	38%	0.38	58%	0.575	S	S	.	*	H	α-helix	trans	-64.3	-43.8	174.8	-168.4	34.6	0	0	0	111.1	A187 E188 R193 R194 R195	A187-D191 PolarHBondContact O-N 3.29Å; E188-D191 PolarHBondContact O-N 2.99Å; D191-R193 VanDerWaalsContact C-N 3.29Å; D191-R193 PolarHBondContact O-N 3.45Å; D191-R194 WeakPolarHBondContact O-CB 3.18Å; D191-R194 PolarHBondContact O-N 2.91Å; D191-R195 PolarHBondContact O-N 3.36Å; D191-R195 IonicContact OD2-CZ 3.53Å; D191-R195 IonicContact OD2-NE 3.29Å; D191-R195 PolarHBondContact OD2-NE 2.85Å; D191-R195 IonicContact OD2-NH2 3.01Å; D191-R195 PolarHBondContact OD2-NH2 3.41Å
192	S	82.2	Confident	77.5	Confident	76 Å²	76	105.5 Å²	105.5	53%	0.531	59%	0.59	S	S	.	*	H	α-helix	trans	-57.1	-41	175.1	-57.3	0	0	0	0	112.4	E188 S196	E188-S192 WeakPolarHBondContact O-CB 3.13Å; E188-S192 PolarHBondContact O-N 2.91Å; E188-S192 PolarHBondContact O-OG 3.34Å; S192-S196 PolarHBondContact O-N 3.23Å; S192-S196 PolarHBondContact O-OG 3.21Å
193	R	81.5	Confident	75.4	Confident	149 Å²	149	114.1 Å²	114.1	56%	0.562	61%	0.612	S	S	*	*	H	α-helix	trans	-67.2	-34.7	174.9	-74.6	175.4	-177.1	-176	1	113	R189 K190 D191 S196 S197	R189-R193 WeakPolarHBondContact O-CG 3.36Å; R189-R193 PolarHBondContact O-N 2.89Å; K190-R193 PolarHBondContact O-N 3.19Å; D191-R193 VanDerWaalsContact C-N 3.29Å; D191-R193 PolarHBondContact O-N 3.45Å; R193-S196 WeakPolarHBondContact CA-OG 3.26Å; R193-S196 PolarHBondContact O-OG 3.47Å; R193-S197 PolarHBondContact O-N 3.47Å; R193-S197 PolarHBondContact O-OG 2.98Å
194	R	76.8	Confident	73.2	Confident	164 Å²	164	116.1 Å²	116.1	62%	0.619	62%	0.622	S	S	*	*	H	α-helix	trans	-67.8	-45.1	176.4	-74.8	177.9	170.8	-171.3	-5	111	K190 D191 S196 S197 D198	K190-R194 WeakPolarHBondContact O-CG 3.35Å; K190-R194 PolarHBondContact O-N 3.19Å; K190-R194 VanDerWaalsContact O-N 3.08Å; D191-R194 WeakPolarHBondContact O-CB 3.18Å; D191-R194 PolarHBondContact O-N 2.91Å; R194-S196 VanDerWaalsContact C-N 3.33Å; R194-S196 PolarHBondContact O-N 3.07Å; R194-S197 PolarHBondContact O-N 3.25Å; R194-D198 PolarHBondContact O-N 2.9Å
195	R	74.3	Confident	70.9	Confident	179 Å²	179	116.1 Å²	116.1	68%	0.675	64%	0.639	S	S	*	*	H	α-helix	trans	-61.2	-38	176.8	-68	-175	-166	-166.4	5.1	112.9	D191 S197	D191-R195 PolarHBondContact O-N 3.36Å; D191-R195 IonicContact OD2-CZ 3.53Å; D191-R195 IonicContact OD2-NE 3.29Å; D191-R195 PolarHBondContact OD2-NE 2.85Å; D191-R195 IonicContact OD2-NH2 3.01Å; D191-R195 PolarHBondContact OD2-NH2 3.41Å; R195-S197 VanDerWaalsContact C-N 3.35Å; R195-S197 PolarHBondContact O-N 3.38Å
196	S	70.5	Confident	69	Low	75 Å²	75	116 Å²	116	52%	0.524	65%	0.647	S	S	.	*	H	α-helix	trans	-68.8	-29.4	177.6	56.5	0	0	0	0	114	S192 R193 R194 S199	S192-S196 PolarHBondContact O-N 3.23Å; S192-S196 PolarHBondContact O-OG 3.21Å; R193-S196 WeakPolarHBondContact CA-OG 3.26Å; R193-S196 PolarHBondContact O-OG 3.47Å; R194-S196 VanDerWaalsContact C-N 3.33Å; R194-S196 PolarHBondContact O-N 3.07Å; S196-S199 PolarHBondContact O-OG 3.43Å; S196-S199 VanDerWaalsContact O-OG 3.06Å
197	S	63.1	Low	66.6	Low	93 Å²	93	122 Å²	122	65%	0.65	67%	0.665	S	S	*	*	H	α-helix	trans	-77.3	-31.4	-179.1	-63.2	0	0	0	0	113.1	R193 R194 R195 G200	R193-S197 PolarHBondContact O-N 3.47Å; R193-S197 PolarHBondContact O-OG 2.98Å; R194-S197 PolarHBondContact O-N 3.25Å; R195-S197 VanDerWaalsContact C-N 3.35Å; R195-S197 PolarHBondContact O-N 3.38Å; S197-G200 PolarHBondContact O-N 2.88Å
198	D	59	Low	64.7	Low	142 Å²	142	124.6 Å²	124.6	76%	0.759	68%	0.679	S	S	*	*	H	α-helix	trans	-77.4	-22.4	-177.1	-154.2	22.6	0	0	0	112.6	R194 G200	R194-D198 PolarHBondContact O-N 2.9Å; D198-G200 PolarHBondContact O-N 3.29Å
199	S	56.4	Low	62.6	Low	105 Å²	105	127.9 Å²	127.9	73%	0.734	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	0.8	173.9	54.7	0	0	0	0	114.9	S196	S196-S199 PolarHBondContact O-OG 3.43Å; S196-S199 VanDerWaalsContact O-OG 3.06Å
200	G	54.3	Low	60.9	Low	62 Å²	62	127.9 Å²	127.9	64%	0.639	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-3.3	-173.4	0	0	0	0	0	116.6	S197 D198 N202	S197-G200 PolarHBondContact O-N 2.88Å; D198-G200 PolarHBondContact O-N 3.29Å; G200-N202 PolarHBondContact O-N 3.05Å
201	S	52.7	Low	59	Low	100 Å²	100	129.2 Å²	129.2	70%	0.699	72%	0.72	S	S	*	*	S	Bend	trans	-91.2	6.8	-166.2	-170.7	0	0	0	0	116.2
202	N	48.4	Very low	57.5	Low	158 Å²	158	133.6 Å²	133.6	85%	0.845	74%	0.744	S	S	*	*			trans	-125.4	73.6	-178.9	-75.7	-25.8	0	0	0	111.6	G200	G200-N202 PolarHBondContact O-N 3.05Å
203	R	49.1	Very low	55.8	Low	236 Å²	236	134.7 Å²	134.7	89%	0.891	75%	0.751	S	S	*	*	S	Bend	trans	-156.6	100	159.5	-109.3	163	-169.3	-171.6	2.3	111.6
204	S	48.7	Very low	54.5	Low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.766	S	S	*	*			trans	54.8	98.3	140.7	48	0	0	0	0	118
205	G	45	Very low	52.8	Low	86 Å²	86	134.5 Å²	134.5	89%	0.887	77%	0.769	S	S	*	*			trans	-62.9	125.3	145.6	0	0	0	0	0	109.5
206	S	51	Low	51.7	Low	107 Å²	107	134.9 Å²	134.9	75%	0.748	78%	0.781	S	S	*	*			trans	-160.6	117.6	169	173.5	0	0	0	0	106.3
207	E	42.8	Very low	50.6	Low	189 Å²	189	138.3 Å²	138.3	88%	0.883	79%	0.786	S	S	*	*			trans	-60.2	137.9	-179.9	-60.2	156.5	132.5	0	0	110.9
208	S	50.6	Low	49.6	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	79%	0.794	S	S	*	*			trans	-169.9	128.8	143.1	14.1	0	0	0	0	108.9
209	E	45.6	Very low	48.8	Very low	183 Å²	183	144.6 Å²	144.6	86%	0.855	80%	0.798	S	S	*	*			trans	-66.1	137.1	172.2	-55	173	148.8	0	0	108.9
210	D	55.3	Low	48.3	Very low	165 Å²	165	149.6 Å²	149.6	88%	0.882	81%	0.806	S	S	*	*			trans	-154.9	103.7	149.6	-85.1	-39.3	0	0	0	107.6
211	N	46.7	Very low	47.7	Very low	155 Å²	155	158.8 Å²	158.8	83%	0.829	82%	0.822	S	S	*	*			trans	-63.9	126.2	159.8	-87	-56.7	0	0	0	107.4
212	D	52.6	Low	46.9	Very low	163 Å²	163	159.3 Å²	159.3	87%	0.872	83%	0.826	S	S	*	*			trans	-151.1	127.4	135.7	-105	-38.8	0	0	0	111.6
213	S	47.2	Very low	46.5	Very low	98 Å²	98	163.3 Å²	163.3	69%	0.685	83%	0.829	S	S	*	*			trans	-57.4	137.8	174.9	-47.1	0	0	0	0	109.4
214	D	53.4	Low	46	Very low	165 Å²	165	164 Å²	164	88%	0.882	83%	0.831	S	S	*	*			trans	-161.5	129.6	131.4	-98.3	-27.7	0	0	0	113.6	M216	D214-M216 PolarHBondContact O-N 3.04Å
215	E	43.1	Very low	45.5	Very low	144 Å²	144	167.7 Å²	167.7	67%	0.673	84%	0.838	S	S	*	*			trans	-68.7	111.4	-178	-171.3	-177.1	166.7	0	0	110.3	K217	E215-K217 WeakPolarHBondContact OE1-CE 3.42Å; E215-K217 IonicContact OE1-NZ 3.66Å; E215-K217 PolarHBondContact OE1-NZ 3.06Å
216	M	51.3	Low	45.1	Very low	187 Å²	187	170.4 Å²	170.4	92%	0.921	84%	0.837	S	S	*	*			trans	-130.5	83.7	158.4	-141.5	-169	-74.3	0	0	110.5	D214 E218	D214-M216 PolarHBondContact O-N 3.04Å; M216-E218 PolarHBondContact O-N 3.47Å
217	K	47.2	Very low	44.4	Very low	147 Å²	147	170.6 Å²	170.6	64%	0.639	84%	0.839	S	S	*	*			trans	-50.6	126.7	163.6	-78.6	166.9	175.1	145.7	0	110.7	E215 F219	E215-K217 WeakPolarHBondContact OE1-CE 3.42Å; E215-K217 IonicContact OE1-NZ 3.66Å; E215-K217 PolarHBondContact OE1-NZ 3.06Å; K217-F219 PolarHBondContact O-N 3.26Å
218	E	42.2	Very low	44.2	Very low	176 Å²	176	173 Å²	173	82%	0.822	84%	0.839	S	S	*	*				56.7	62.4	124.4	-159.5	162.8	-158.7	0	0	117.4	M216	M216-E218 PolarHBondContact O-N 3.47Å
219	F	40.7	Very low	43.5	Very low	191 Å²	191	173 Å²	173	84%	0.838	84%	0.84	S	S	*	*			trans	-150.1	90	161.5	-93.2	-83.9	0	0	0	110.4	K217	K217-F219 PolarHBondContact O-N 3.26Å
220	K	46.6	Very low	43.5	Very low	210 Å²	210	170.1 Å²	170.1	91%	0.913	84%	0.837	S	S	*	*			trans	178.2	26.4	153.5	-97	152.9	-168.1	174.8	0	115.6
221	R	41.9	Very low	42.6	Very low	255 Å²	255	170.7 Å²	170.7	96%	0.962	83%	0.834	S	S	*	*	S	Bend	trans	-108.2	60.8	163.6	-75.8	-177.7	167.9	-176.2	-2.6	110.7
222	S	35.1	Very low	42.3	Very low	112 Å²	112	171.6 Å²	171.6	78%	0.783	83%	0.833	S	S	*	*			trans	-160.1	22.7	169.5	72.7	0	0	0	0	115.6
223	R	39.9	Very low	41.8	Very low	242 Å²	242	169.3 Å²	169.3	91%	0.913	82%	0.821	S	S	*	*			trans	-123	66.7	-176.8	-158	178.2	-159.3	-157.4	5.3	113
224	R	40.2	Very low	41.7	Very low	249 Å²	249	170.4 Å²	170.4	94%	0.94	82%	0.824	S	S	*	*	S	Bend	trans	-177.1	50.7	150.4	-106.7	171.6	-177.8	-177.4	1	112.1
225	E	37.6	Very low	41.3	Very low	182 Å²	182	169.8 Å²	169.8	85%	0.85	82%	0.82	S	S	*	*			trans	-109.9	148.2	147.5	-69.6	-172.9	151	0	0	105.9
226	T	36.4	Very low	41.3	Very low	143 Å²	143	172.8 Å²	172.8	88%	0.877	83%	0.825	S	S	*	*	S	Bend	trans	83.8	77.4	-175.9	-40.8	0	0	0	0	115.5
227	S	36	Very low	40.9	Very low	111 Å²	111	168.3 Å²	168.3	78%	0.776	82%	0.818	S	S	*	*	S	Bend		161.9	89.4	127.8	60.9	0	0	0	0	111.1
228	R	39.2	Very low	40.9	Very low	239 Å²	239	168.8 Å²	168.8	90%	0.902	83%	0.826	S	S	*	*			trans	162.8	103.2	145.7	-94	167.5	178.2	-150.7	-2.5	109.4	P230	R228-P230 WeakPolarHBondContact O-CD 3.37Å
229	S	35.8	Very low	41	Very low	117 Å²	117	170.1 Å²	170.1	82%	0.818	83%	0.83	S	S	*	*			trans	-60.7	136.7	169	-49.6	0	0	0	0	111
230	P	44.5	Very low	41	Very low	122 Å²	122	172.5 Å²	172.5	79%	0.792	83%	0.833	S	S	*	*			trans	-124.4	107.6	142.3	11.3	10.8	0	0	0	108.4	R228	R228-P230 WeakPolarHBondContact O-CD 3.37Å
231	E	38	Very low	40.7	Very low	176 Å²	176	173.4 Å²	173.4	82%	0.822	83%	0.831	S	S	*	*			trans	-63.7	148.3	162.4	-60	-175.9	153.5	0	0	108.9
232	H	39.6	Very low	40.8	Very low	174 Å²	174	169 Å²	169	81%	0.806	83%	0.826	S	S	*	*			trans	72.4	86.5	170.5	-97.4	-88.5	0	0	0	118.4
233	D	42.5	Very low	41	Very low	116 Å²	116	171.6 Å²	171.6	62%	0.62	83%	0.832	S	S	*	*			trans	-154.4	54.6	145	-136.9	-5.9	0	0	0	113.3	N235	D233-N235 PolarHBondContact O-N 3.46Å
234	T	44.5	Very low	40.9	Very low	121 Å²	121	165.9 Å²	165.9	74%	0.742	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	67	167.4	54.5	0	0	0	0	110.1
235	N	45	Very low	40.8	Very low	152 Å²	152	159.3 Å²	159.3	81%	0.813	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.7	5.8	167.6	-91.6	-39.2	0	0	0	115.1	D233	D233-N235 PolarHBondContact O-N 3.46Å
236	R	43.3	Very low	40.8	Very low	207 Å²	207	162 Å²	162	78%	0.781	82%	0.823	S	S	*	*			trans	-98.1	8.3	-169.2	-156.1	166.1	-175	150.4	1.8	116
237	A	43.7	Very low	40.6	Very low	92 Å²	92	167.1 Å²	167.1	76%	0.76	83%	0.827	S	S	*	*	S	Bend	trans	-97.8	4.3	-169	0	0	0	0	0	116.3
238	L	45.8	Very low	40.7	Very low	157 Å²	157	170 Å²	170	82%	0.822	83%	0.828	S	S	*	*	S	Bend	trans	-113.4	5.4	-172.4	-66.5	179.3	0	0	0	117
239	F	43.8	Very low	40.5	Very low	204 Å²	204	165.8 Å²	165.8	90%	0.895	82%	0.824	S	S	*	*	S	Bend	trans	-115	17.3	-178.4	-77.6	-78.5	0	0	0	115.7
240	R	42.6	Very low	40.7	Very low	242 Å²	242	165 Å²	165	91%	0.913	82%	0.824	S	S	*	*			trans	-98	19.4	-179	-87.3	-164.3	-166.4	-125.7	5.8	115.9
241	R	39.5	Very low	40.2	Very low	228 Å²	228	168.5 Å²	168.5	86%	0.86	83%	0.83	S	S	*	*	S	Bend	trans	-136.6	93.1	175.3	-81.9	178.8	175.4	150.8	-2.4	109.5
242	N	44.2	Very low	40.5	Very low	162 Å²	162	165.1 Å²	165.1	87%	0.866	83%	0.826	S	S	*	*	S	Bend	trans	156.8	72.1	148.9	-81.3	-7.1	0	0	0	110
243	N	40	Very low	40.3	Very low	167 Å²	167	165.4 Å²	165.4	89%	0.893	83%	0.827	S	S	*	*			trans	-159.5	68.5	151.5	-125.9	-4.2	0	0	0	109.3
244	S	36.8	Very low	40.3	Very low	123 Å²	123	167.1 Å²	167.1	86%	0.86	84%	0.836	S	S	*	*			trans	-123	70.7	172.1	173.5	0	0	0	0	107.7
245	S	38.2	Very low	39.8	Very low	110 Å²	110	167.8 Å²	167.8	77%	0.769	84%	0.835	S	S	*	*			trans	-171.2	151.7	157.3	-151.1	0	0	0	0	107.6
246	R	36.8	Very low	39.6	Very low	239 Å²	239	167.6 Å²	167.6	90%	0.902	83%	0.83	S	S	*	*			trans	93.8	55.9	174.5	-143.9	169	-162.5	158.9	3	116.4
247	W	32.8	Very low	39.2	Very low	250 Å²	250	165.9 Å²	165.9	95%	0.947	83%	0.83	S	S	*	*			trans	-105.9	107.2	145.7	-73.1	86.5	0	0	0	107
248	Q	37.8	Very low	38.9	Very low	172 Å²	172	171.8 Å²	171.8	80%	0.804	83%	0.832	S	S	*	*			trans	-168.9	116.5	159.2	-105.1	157.4	39.7	0	0	108.5
249	D	35.7	Very low	38.5	Very low	151 Å²	151	170 Å²	170	81%	0.807	83%	0.833	S	S	*	*			trans	65.3	105.7	144.2	-43.6	-27.7	0	0	0	119.7
250	A	39.7	Very low	38.1	Very low	101 Å²	101	166.2 Å²	166.2	84%	0.835	83%	0.827	S	S	*	*			trans	-167.4	80	146.9	0	0	0	0	0	110.9
251	E	35	Very low	37.9	Very low	195 Å²	195	159.8 Å²	159.8	91%	0.911	82%	0.819	S	S	*	*			trans	-81.5	118.4	151.3	-67.4	179.3	149.9	0	0	107.5
252	S	43.1	Very low	37.6	Very low	105 Å²	105	155.6 Å²	155.6	73%	0.734	81%	0.814	S	S	*	*			trans	174	118.4	145.8	36.7	0	0	0	0	111.2
253	E	35.8	Very low	37.2	Very low	180 Å²	180	157.9 Å²	157.9	84%	0.841	81%	0.811	S	S	*	*			trans	42	101.9	135.9	-56.7	-179.3	169.5	0	0	117.3
254	N	41.8	Very low	37.2	Very low	151 Å²	151	157.5 Å²	157.5	81%	0.807	81%	0.809	S	S	*	*			trans	-150.6	107.2	141.2	-98.3	-42.1	0	0	0	112.7
255	N	34.6	Very low	37.3	Very low	135 Å²	135	156.3 Å²	156.3	72%	0.722	79%	0.794	S	S	*	*			trans	-58	123.1	169.6	-164	-0.8	0	0	0	109.7
256	H	40	Very low	37.2	Very low	149 Å²	149	158 Å²	158	69%	0.69	79%	0.787	S	S	*	*			trans	-128.9	93.3	174.4	-90.5	38.4	0	0	0	109.8	R258	H256-R258 PolarHBondContact O-N 2.85Å
257	H	35.9	Very low	37.3	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.787	79%	0.788	S	S	*	*			trans	-70.7	99.5	155.6	-81.3	-88.4	0	0	0	108.4
258	R	37.8	Very low	37.4	Very low	216 Å²	216	148.9 Å²	148.9	82%	0.815	77%	0.771	S	S	*	*			trans	-99.4	103.3	164.8	-91.5	-170.7	176.2	-158.3	-0.2	109.4	H256 V260	H256-R258 PolarHBondContact O-N 2.85Å; R258-V260 PolarHBondContact O-N 3.2Å
259	S	36.5	Very low	37.5	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	77%	0.771	S	S	*	*			trans	-68.9	121	163.8	-60.9	0	0	0	0	109.3
260	V	35.7	Very low	37.6	Very low	126 Å²	126	145.3 Å²	145.3	76%	0.764	77%	0.771	S	S	*	*			trans	-81.8	111.9	176.5	178	0	0	0	0	108.2	R258	R258-V260 PolarHBondContact O-N 3.2Å
261	S	38.2	Very low	37.5	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	77%	0.773	S	S	*	*			trans	-89.4	109.2	164.3	51.7	0	0	0	0	109.3
262	N	33.7	Very low	37.8	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	76%	0.763	S	S	*	*			trans	-75	118.4	170.4	-110.8	-9.3	0	0	0	109.3
263	Y	35.6	Very low	37.9	Very low	209 Å²	209	149.8 Å²	149.8	82%	0.82	77%	0.768	S	S	*	*			trans	-131.4	99.9	161.9	-95.6	-85.8	0	0	0	108.8
264	N	39.4	Very low	38.1	Very low	159 Å²	159	149.8 Å²	149.8	85%	0.85	77%	0.768	S	S	*	*			trans	-96.3	116.1	161.9	-85	-20.1	0	0	0	107.3
265	D	38.7	Very low	38	Very low	99 Å²	99	146.9 Å²	146.9	53%	0.529	77%	0.765	S	S	.	*			trans	-124.6	112.4	174.8	-137.6	2	0	0	0	110.4
266	F	36.5	Very low	38.1	Very low	145 Å²	145	146.3 Å²	146.3	64%	0.636	77%	0.766	S	S	*	*			trans	33.1	116.2	141	-102.3	-115.2	0	0	0	120.3	Q268	F266-Q268 HydrophobicContact CD1-CG 4.04Å; F266-Q268 HydrophobicContact CE1-CG 3.89Å
267	N	38.2	Very low	38.1	Very low	170 Å²	170	144.2 Å²	144.2	91%	0.909	76%	0.764	S	S	*	*			trans	-134.4	101	147.3	-123.6	-6.8	0	0	0	109.7
268	Q	36.5	Very low	38.4	Very low	127 Å²	127	144.3 Å²	144.3	59%	0.593	77%	0.765	S	S	*	*			trans	-91.7	123	169.5	-80.8	176.4	-9	0	0	108.4	F266	F266-Q268 HydrophobicContact CD1-CG 4.04Å; F266-Q268 HydrophobicContact CE1-CG 3.89Å
269	S	39.1	Very low	38.5	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	77%	0.767	S	S	*	*			trans	-110.9	111.3	164.9	65.3	0	0	0	0	109.6
270	T	38	Very low	38.7	Very low	133 Å²	133	146.1 Å²	146.1	82%	0.816	77%	0.771	S	S	*	*			trans	-71.2	130.5	164.8	48.3	0	0	0	0	109.3
271	N	36.7	Very low	38.7	Very low	162 Å²	162	144.8 Å²	144.8	87%	0.866	77%	0.767	S	S	*	*			trans	-139.7	96.3	169.1	-136.9	1.5	0	0	0	108.1
272	E	41.8	Very low	38.8	Very low	151 Å²	151	146.9 Å²	146.9	71%	0.706	77%	0.77	S	S	*	*			trans	-134.7	111.8	170.3	-62.6	-176.2	-163.8	0	0	106.3
273	H	44.6	Very low	39.1	Very low	181 Å²	181	146.9 Å²	146.9	84%	0.838	78%	0.775	S	S	*	*				173.6	118.4	120.3	-97	-77.6	0	0	0	110.6
274	E	39.9	Very low	39.4	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	77%	0.772	S	S	*	*			trans	-72.9	151.1	167.3	-74	179.1	129	0	0	112.1
275	A	40.9	Very low	39.3	Very low	90 Å²	90	142.2 Å²	142.2	74%	0.744	77%	0.769	S	S	*	*			trans	64	126.4	145.4	0	0	0	0	0	119.2
276	V	37.3	Very low	39.1	Very low	123 Å²	123	144.6 Å²	144.6	75%	0.745	78%	0.775	S	S	*	*				170.4	105.8	109.1	158.3	0	0	0	0	110.1
277	T	39.2	Very low	39.1	Very low	104 Å²	104	145 Å²	145	64%	0.638	78%	0.784	S	S	*	*			trans	59.5	133.4	136.6	70.4	0	0	0	0	124.6
278	Q	41.6	Very low	39.1	Very low	173 Å²	173	144.2 Å²	144.2	81%	0.808	77%	0.774	S	S	*	*				92.2	99.1	129.7	-77.8	165.9	45.5	0	0	119.9
279	K	40.6	Very low	39.2	Very low	199 Å²	199	144.6 Å²	144.6	87%	0.865	77%	0.771	S	S	*	*			trans	17	121.7	132.8	-66.7	179.3	176.3	-179.8	0	116.9
280	L	40	Very low	39.2	Very low	173 Å²	173	146.4 Å²	146.4	91%	0.906	77%	0.772	S	S	*	*				-151.8	120.3	129.2	-95.3	165.1	0	0	0	108.1
281	S	36.8	Very low	39.6	Very low	98 Å²	98	148.3 Å²	148.3	69%	0.685	77%	0.772	S	S	*	*			trans	-70.5	138.5	163	46.2	0	0	0	0	108.8
282	D	40.7	Very low	39.8	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	78%	0.775	S	S	*	*			trans	-160.3	131	137.5	-88.3	-27.9	0	0	0	110.5
283	T	39.2	Very low	39.8	Very low	140 Å²	140	145.1 Å²	145.1	86%	0.859	77%	0.774	S	S	*	*			trans	-76	125.8	178.5	45.8	0	0	0	0	109.9
284	V	42.1	Very low	39.6	Very low	125 Å²	125	144 Å²	144	76%	0.758	77%	0.774	S	S	*	*			trans	-122.9	116	164.8	-151.5	0	0	0	0	108.9
285	N	36	Very low	40	Very low	144 Å²	144	143.8 Å²	143.8	77%	0.77	77%	0.773	S	S	*	*			trans	-75.8	118.5	175.6	-175.1	12.4	0	0	0	108.2
286	F	35.5	Very low	40.3	Very low	149 Å²	149	145.7 Å²	145.7	65%	0.654	78%	0.775	S	S	*	*			trans	-119.5	77	-179.5	-124.1	-84.7	0	0	0	110.1	Y289	F286-Y289 HydrophobicContact CD1-CE2 4.48Å
287	N	36.6	Very low	40.6	Very low	154 Å²	154	146 Å²	146	82%	0.824	77%	0.773	S	S	*	*			trans	-105.6	73	163.8	-101.7	1.1	0	0	0	108.2
288	E	38.8	Very low	41	Very low	154 Å²	154	149.7 Å²	149.7	72%	0.72	78%	0.783	S	S	*	*			trans	-152.8	73.7	170	-160.5	166.7	-171.8	0	0	109.7
289	Y	38.4	Very low	41.2	Very low	134 Å²	134	147.8 Å²	147.8	53%	0.525	78%	0.778	S	S	.	*			trans	-133.4	72.6	174	-103.3	-85	0	0	0	108.3	L103 F286	L103-Y289 WeakPolarHBondContact CD2-OH 3.47Å; F286-Y289 HydrophobicContact CD1-CE2 4.48Å
290	N	39.4	Very low	41.5	Very low	155 Å²	155	147.9 Å²	147.9	83%	0.829	78%	0.782	S	S	*	*	S	Bend	trans	-169.1	50.9	166.3	-92.3	-28.6	0	0	0	111.3
291	Q	45.4	Very low	41.8	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	78%	0.779	S	S	*	*			trans	-160.3	31	175.5	-144.9	118.1	99.4	0	0	117.8
292	L	41.6	Very low	42.6	Very low	181 Å²	181	146.9 Å²	146.9	95%	0.948	77%	0.769	S	S	*	*			trans	-121.8	93.1	171.3	-70.9	173.2	0	0	0	110.5
293	G	40.9	Very low	43.2	Very low	66 Å²	66	144.2 Å²	144.2	68%	0.68	76%	0.76	S	S	*	*			trans	-93.4	136.4	165.4	0	0	0	0	0	110.3
294	D	40.3	Very low	43.9	Very low	156 Å²	156	140.5 Å²	140.5	83%	0.834	74%	0.735	S	S	*	*			trans	47.2	79.1	152	-55.5	-23.3	0	0	0	118.3
295	E	47.9	Very low	44.3	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	71%	0.706	S	S	*	*			trans	-108.5	134	148.7	-75.3	-171	154	0	0	109.4	D297	E295-D297 PolarHBondContact O-N 2.93Å
296	V	47.9	Very low	45.2	Very low	130 Å²	130	130.3 Å²	130.3	79%	0.788	68%	0.679	S	S	*	*			trans	-92.2	88.9	-170.7	-165.1	0	0	0	0	107.6	E298	V296-E298 PolarHBondContact O-N 3.34Å
297	D	43.7	Very low	45.6	Very low	130 Å²	130	126.9 Å²	126.9	70%	0.695	67%	0.672	S	S	*	*			trans	-89.2	101.8	174.7	-70.4	-40.2	0	0	0	109.9	E295 D299	E295-D297 PolarHBondContact O-N 2.93Å; D297-D299 VanDerWaalsContact C-N 3.29Å; D297-D299 PolarHBondContact O-N 3.35Å; D297-D299 VanDerWaalsContact O-N 3.16Å
298	E	47.6	Very low	45.7	Very low	181 Å²	181	126.8 Å²	126.8	85%	0.846	67%	0.67	S	S	*	*			trans	-78.2	72.5	168.4	-65.8	-161.3	152.8	0	0	110.4	V296	V296-E298 PolarHBondContact O-N 3.34Å
299	D	46.6	Very low	46	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	67%	0.665	S	S	*	*			trans	-118.4	112	171.7	-59	-37	0	0	0	110.6	D297 E301	D297-D299 VanDerWaalsContact C-N 3.29Å; D297-D299 PolarHBondContact O-N 3.35Å; D297-D299 VanDerWaalsContact O-N 3.16Å; D299-E301 PolarHBondContact O-N 2.92Å
300	E	45.9	Very low	46	Very low	202 Å²	202	125.6 Å²	125.6	94%	0.944	68%	0.676	S	S	*	*			trans	-48.9	82.2	172.8	-74.2	-86.4	159	0	0	113.5
301	E	47.1	Very low	45.8	Very low	182 Å²	182	123.1 Å²	123.1	85%	0.85	66%	0.663	S	S	*	*			trans	-149.6	114.1	172	-160.2	141.4	-162.2	0	0	113.1	D299	D299-E301 PolarHBondContact O-N 2.92Å
302	S	52.2	Low	45.5	Very low	68 Å²	68	125.7 Å²	125.7	48%	0.476	67%	0.667	S	S	.	*			trans	22	119.5	176.9	-163	0	0	0	0	118.1	D304 G305	S302-D304 PolarHBondContact O-N 3.49Å; S302-G305 PolarHBondContact O-N 3.15Å
303	P	53.6	Low	45.4	Very low	95 Å²	95	126.2 Å²	126.2	62%	0.617	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-16.8	-176.2	23.8	-34.1	0	0	0	114.9	R115	R115-P303 VanDerWaalsContact CZ-O 3.24Å; R115-P303 PolarHBondContact NE-O 3.24Å; R115-P303 PolarHBondContact NH2-O 2.78Å
304	D	53.8	Low	44.9	Very low	63 Å²	63	130.2 Å²	130.2	34%	0.337	66%	0.664	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	-10.3	179.2	-64.6	-19.1	0	0	0	113.6	S302 I306	S302-D304 PolarHBondContact O-N 3.49Å; D304-I306 WeakPolarHBondContact O-CG1 3.4Å; D304-I306 PolarHBondContact O-N 3.37Å
305	G	50.8	Low	44.6	Very low	14 Å²	14	130.3 Å²	130.3	14%	0.144	66%	0.664	C	S	.	*			trans	60.2	16.7	177.3	0	0	0	0	0	115	L108 S302	L108-G305 WeakPolarHBondContact CD2-O 3.31Å; S302-G305 PolarHBondContact O-N 3.15Å
306	I	55.7	Low	44.1	Very low	41 Å²	41	127.6 Å²	127.6	21%	0.21	67%	0.665	C	S	.	*			trans	-100	119.6	-179.6	-61	168.2	0	0	0	108.8	L146 H150 D304 L308	L146-I306 HydrophobicContact CD1-CD1 4.44Å; H150-I306 VanDerWaalsContact CE1-CD1 3.43Å; H150-I306 WeakPolarHBondContact CE1-CD1 3.49Å; H150-I306 WeakPolarHBondContact NE2-CD1 3.46Å; D304-I306 WeakPolarHBondContact O-CG1 3.4Å; D304-I306 PolarHBondContact O-N 3.37Å; I306-L308 PolarHBondContact O-N 3.37Å
307	P	44.2	Very low	43.5	Very low	77 Å²	77	130.2 Å²	130.2	50%	0.5	67%	0.668	S	S	.	*			trans	-60.6	127.8	173	24.9	-32.3	0	0	0	109.9	T309	P307-T309 HydrophobicContact CB-CG2 4.39Å; P307-T309 PolarHBondContact O-N 3.41Å
308	L	39.1	Very low	43.1	Very low	151 Å²	151	131.5 Å²	131.5	79%	0.791	68%	0.675	S	S	*	*			trans	-64.8	81.5	170.6	-72	168.6	0	0	0	109.2	I306	I306-L308 PolarHBondContact O-N 3.37Å
309	T	45	Very low	42.7	Very low	100 Å²	100	131.9 Å²	131.9	61%	0.613	68%	0.677	S	S	*	*			trans	-108.1	92.2	168.3	60.6	0	0	0	0	108.9	P307 N311	P307-T309 HydrophobicContact CB-CG2 4.39Å; P307-T309 PolarHBondContact O-N 3.41Å; T309-N311 PolarHBondContact O-N 3.39Å
310	E	38.1	Very low	42.1	Very low	163 Å²	163	133 Å²	133	76%	0.762	68%	0.683	S	S	*	*			trans	-73.1	6	172	-73.8	-174.4	152.3	0	0	113.3
311	N	35	Very low	41.8	Very low	104 Å²	104	130.6 Å²	130.6	56%	0.556	68%	0.675	S	S	*	*	S	Bend	trans	-127	45.1	-163.8	-63.3	-30	0	0	0	114.2	T309	T309-N311 PolarHBondContact O-N 3.39Å
312	Y	38.2	Very low	41.2	Very low	225 Å²	225	131 Å²	131	88%	0.882	68%	0.677	S	S	*	*			trans	-148.6	17.8	166.2	-98.4	-76.8	0	0	0	115.4	N314	Y312-N314 PolarHBondContact O-N 3.41Å
313	Y	39	Very low	40.9	Very low	192 Å²	192	133.4 Å²	133.4	75%	0.753	69%	0.688	S	S	*	*			trans	-95.5	64	167	-95.8	-85.8	0	0	0	110
314	N	31.4	Very low	40.2	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	70%	0.7	S	S	*	*			trans	-138.8	67	173.8	-82.2	-35.7	0	0	0	110.2	Y312	Y312-N314 PolarHBondContact O-N 3.41Å
315	N	34.5	Very low	39.2	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	72%	0.719	S	S	*	*	S	Bend	trans	-165.8	117.8	151.2	-106.1	-30.9	0	0	0	106.7
316	S	37.8	Very low	38.4	Very low	121 Å²	121	146 Å²	146	85%	0.846	75%	0.749	S	S	*	*	S	Bend	trans	98.4	19.9	176.9	-54.9	0	0	0	0	120.7
317	H	35.2	Very low	37.6	Very low	186 Å²	186	150.6 Å²	150.6	86%	0.861	77%	0.774	S	S	*	*			trans	-140.6	87.3	166.5	-128.7	58.6	0	0	0	112.3
318	N	33.6	Very low	37.4	Very low	156 Å²	156	154.2 Å²	154.2	83%	0.834	78%	0.784	S	S	*	*			trans	-150.9	80.1	164.4	-96.3	-12.5	0	0	0	107.7
319	Q	40.1	Very low	37.1	Very low	190 Å²	190	155.3 Å²	155.3	89%	0.888	79%	0.791	S	S	*	*			trans	-142	102.5	153.2	-69.1	-166.1	3.5	0	0	107.8	I321	Q319-I321 PolarHBondContact O-N 3.47Å
320	N	34.1	Very low	36.9	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	80%	0.795	S	S	*	*			trans	-59.2	125.2	171.1	-62.4	-31.4	0	0	0	109.8
321	I	39.9	Very low	36.8	Very low	151 Å²	151	158.9 Å²	158.9	77%	0.774	80%	0.801	S	S	*	*			trans	-139.5	90.4	151.5	-57.8	-178.5	0	0	0	107	Q319 V323	Q319-I321 PolarHBondContact O-N 3.47Å; I321-V323 HydrophobicContact CG2-CG2 3.81Å
322	E	34.5	Very low	37.4	Very low	192 Å²	192	160.8 Å²	160.8	90%	0.897	81%	0.812	S	S	*	*			trans	-77.9	114.8	154.8	-68.1	178.9	160.5	0	0	106.9
323	V	46.1	Very low	37.5	Very low	118 Å²	118	159 Å²	159	72%	0.715	81%	0.812	S	S	*	*			trans	-137.9	97.6	157.9	-175.8	0	0	0	0	108.5	I321	I321-V323 HydrophobicContact CG2-CG2 3.81Å
324	E	38	Very low	38.2	Very low	182 Å²	182	158.4 Å²	158.4	85%	0.85	82%	0.815	S	S	*	*			trans	22.6	116.5	140.7	-62.7	-179	137.8	0	0	119	N326	E324-N326 PolarHBondContact O-N 3.2Å
325	S	33.5	Very low	39.3	Very low	107 Å²	107	156.4 Å²	156.4	75%	0.748	81%	0.811	S	S	*	*			trans	-53.6	122.1	152.1	51.5	0	0	0	0	111.7
326	N	34.8	Very low	40.5	Very low	146 Å²	146	154.5 Å²	154.5	78%	0.781	81%	0.807	S	S	*	*			trans	-177.7	137.6	135.4	-102.9	-35.6	0	0	0	113.9	E324	E324-N326 PolarHBondContact O-N 3.2Å
327	L	37.7	Very low	41.7	Very low	138 Å²	138	154 Å²	154	72%	0.723	80%	0.801	S	S	*	*			trans	95.8	122.4	147.4	-62.7	151.3	0	0	0	120.2
328	Q	40	Very low	42.8	Very low	153 Å²	153	150 Å²	150	72%	0.715	79%	0.791	S	S	*	*			trans	89.7	80.7	146.2	-96.7	64.4	-25.5	0	0	119.1	S330	Q328-S330 PolarHBondContact O-N 3.42Å; Q328-S330 VanDerWaalsContact O-N 3.13Å
329	N	33.5	Very low	44.1	Very low	174 Å²	174	149.4 Å²	149.4	93%	0.93	79%	0.793	S	S	*	*			trans	-54.3	102.7	147.6	-78.9	-24.5	0	0	0	110.6
330	S	39.5	Very low	45.5	Very low	101 Å²	101	148.9 Å²	148.9	71%	0.706	79%	0.788	S	S	*	*			trans	-109.3	109.4	154.1	54.8	0	0	0	0	108.4	Q328 D332	Q328-S330 PolarHBondContact O-N 3.42Å; Q328-S330 VanDerWaalsContact O-N 3.13Å; S330-D332 PolarHBondContact O-N 3.36Å
331	R	36.5	Very low	47.4	Very low	237 Å²	237	146.8 Å²	146.8	89%	0.894	78%	0.783	S	S	*	*			trans	-57.3	115.6	168.9	-81.5	165.1	129.1	127.4	-7	109
332	D	46.9	Very low	49	Very low	144 Å²	144	145.1 Å²	145.1	77%	0.77	78%	0.783	S	S	*	*			trans	-124.4	118.9	153.3	-84.8	-49.1	0	0	0	107.9	S330 H334	S330-D332 PolarHBondContact O-N 3.36Å; D332-H334 PolarHBondContact O-N 2.88Å
333	E	41	Very low	51	Low	189 Å²	189	141.5 Å²	141.5	88%	0.883	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71.3	116.4	-173.7	-65	-174	126.6	0	0	110.6
334	H	53.6	Low	52.5	Low	178 Å²	178	141.5 Å²	141.5	82%	0.824	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-88.7	135.4	163.2	-82.8	-71.4	0	0	0	110	D332	D332-H334 PolarHBondContact O-N 2.88Å
335	P	54.6	Low	54.4	Low	109 Å²	109	138.4 Å²	138.4	71%	0.708	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.8	148.8	-178.6	29.9	-33.9	0	0	0	110.9
336	P	60.6	Low	56.5	Low	117 Å²	117	138.9 Å²	138.9	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-69.4	147.8	-178.9	29.3	-34	0	0	0	111.3
337	P	62.7	Low	58.6	Low	111 Å²	111	137.5 Å²	137.5	72%	0.721	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.1	154.7	175.7	30.1	-34.4	0	0	0	111.1	T339	P337-T339 PolarHBondContact O-N 3.3Å
338	P	58.1	Low	60.4	Low	103 Å²	103	136.4 Å²	136.4	67%	0.669	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.8	126.5	-179	26.4	-33.1	0	0	0	111.2	F340	P338-F340 HydrophobicContact CG-CE2 4.21Å; P338-F340 PolarHBondContact O-N 3.17Å
339	T	61.1	Low	62.1	Low	143 Å²	143	134.7 Å²	134.7	88%	0.877	78%	0.776	S	S	*	*			trans	-71.5	107.2	174	-4.7	0	0	0	0	109.6	P337	P337-T339 PolarHBondContact O-N 3.3Å
340	F	68.5	Low	63.6	Low	178 Å²	178	131.3 Å²	131.3	78%	0.781	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-82.1	136.2	167.8	-73.6	-82.3	0	0	0	110	P338	P338-F340 HydrophobicContact CG-CE2 4.21Å; P338-F340 PolarHBondContact O-N 3.17Å
341	P	74.7	Confident	64.2	Low	111 Å²	111	131.3 Å²	131.3	72%	0.721	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66.4	147.3	173.4	28.2	-33.2	0	0	0	110.5
342	P	74.2	Confident	64.8	Low	117 Å²	117	126.7 Å²	126.7	76%	0.76	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-64.1	147.1	178.4	27.6	-34.2	0	0	0	111
343	P	74.8	Confident	64.9	Low	116 Å²	116	126.2 Å²	126.2	75%	0.753	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-65.8	148.8	175.7	28.1	-33.7	0	0	0	111.1
344	P	78.1	Confident	65.2	Low	118 Å²	118	124 Å²	124	77%	0.766	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-65.9	150.7	177.9	28.1	-34.3	0	0	0	111.6
345	P	78.9	Confident	65.4	Low	117 Å²	117	124.4 Å²	124.4	76%	0.76	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-65.8	149.1	178.9	27.7	-34.3	0	0	0	111.7
346	P	77.1	Confident	65.8	Low	117 Å²	117	124 Å²	124	76%	0.76	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-65.9	148.9	176.8	27.9	-33.9	0	0	0	111.5
347	P	78	Confident	65.6	Low	116 Å²	116	124.2 Å²	124.2	75%	0.753	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.6	149.4	178.6	27.6	-34.1	0	0	0	111.5
348	P	76.1	Confident	65.1	Low	116 Å²	116	124.4 Å²	124.4	75%	0.753	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-63.2	146.3	178.4	26.8	-33.9	0	0	0	111.1
349	P	75.9	Confident	64.6	Low	116 Å²	116	127.7 Å²	127.7	75%	0.753	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-62.2	147.5	176.8	26.4	-33.5	0	0	0	110.9	A351	P349-A351 PolarHBondContact O-N 3.11Å
350	P	65.1	Low	63.9	Low	103 Å²	103	132 Å²	132	67%	0.669	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-60.2	128	-177.9	22.1	-31.1	0	0	0	111.7	H352	P350-H352 PolarHBondContact O-N 3.05Å
351	A	52.5	Low	63	Low	102 Å²	102	131 Å²	131	84%	0.843	76%	0.757	S	S	*	*	S	Bend	trans	-73	83.9	177.1	0	0	0	0	0	110.6	P349	P349-A351 PolarHBondContact O-N 3.11Å
352	H	49	Very low	61.5	Low	140 Å²	140	136.6 Å²	136.6	65%	0.648	76%	0.764	S	S	*	*			trans	-177.7	96.1	161.7	40.3	-83.3	0	0	0	109	P350	P350-H352 PolarHBondContact O-N 3.05Å
353	L	48.1	Very low	60.9	Low	133 Å²	133	136.3 Å²	136.3	70%	0.696	76%	0.762	S	S	*	*			trans	-175.7	76.7	138	-84.5	-162.3	0	0	0	106.2	Y355	L353-Y355 HydrophobicContact CB-CD2 4.27Å; L353-Y355 HydrophobicContact CB-CE2 3.91Å; L353-Y355 HydrophobicContact CD1-CE2 3.82Å; L353-Y355 HydrophobicContact CG-CE2 4.39Å; L353-Y355 PolarHBondContact O-N 3.5Å; L353-Y355 VanDerWaalsContact O-N 3.11Å
354	V	48.1	Very low	59.7	Low	143 Å²	143	137 Å²	137	87%	0.867	77%	0.766	S	S	*	*			trans	-66.1	100.5	167.3	174.9	0	0	0	0	106.8
355	Y	57	Low	57.9	Low	187 Å²	187	139.9 Å²	139.9	73%	0.733	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-89.8	125.3	163	-74.7	-81.3	0	0	0	108.3	L353	L353-Y355 HydrophobicContact CB-CD2 4.27Å; L353-Y355 HydrophobicContact CB-CE2 3.91Å; L353-Y355 HydrophobicContact CD1-CE2 3.82Å; L353-Y355 HydrophobicContact CG-CE2 4.39Å; L353-Y355 PolarHBondContact O-N 3.5Å; L353-Y355 VanDerWaalsContact O-N 3.11Å
356	P	63.7	Low	56.3	Low	99 Å²	99	140.1 Å²	140.1	64%	0.643	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-68.6	150.8	178	28.9	-33.6	0	0	0	110.7	T358	P356-T358 PolarHBondContact O-N 2.86Å
357	P	57.1	Low	54.5	Low	123 Å²	123	139.9 Å²	139.9	80%	0.799	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67.9	125.4	178.2	27.5	-31.8	0	0	0	110.2	Q359	P357-Q359 PolarHBondContact O-N 3.24Å
358	T	51.2	Low	52.9	Low	114 Å²	114	139.4 Å²	139.4	70%	0.699	78%	0.775	S	S	*	*			trans	-66.8	96	172.6	-34.5	0	0	0	0	109.3	P356 W360	P356-T358 PolarHBondContact O-N 2.86Å; T358-W360 PolarHBondContact O-N 3.43Å
359	Q	46.9	Very low	51.2	Low	173 Å²	173	141.3 Å²	141.3	81%	0.808	78%	0.778	S	S	*	*			trans	-63.4	102.9	167.4	51.1	-171.9	1.3	0	0	110	P357	P357-Q359 PolarHBondContact O-N 3.24Å
360	W	46.5	Very low	49.7	Very low	234 Å²	234	145.8 Å²	145.8	89%	0.886	79%	0.786	S	S	*	*			trans	-84.4	114.9	166.5	-76.5	87.1	0	0	0	108.9	T358 R362	T358-W360 PolarHBondContact O-N 3.43Å; W360-R362 PolarHBondContact O-N 3.35Å
361	N	50.4	Low	48.6	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-56.8	122.6	179.1	-74.6	-44.6	0	0	0	111.7
362	R	43.5	Very low	47.9	Very low	230 Å²	230	146.2 Å²	146.2	87%	0.868	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-84.8	125.9	163.1	-179.8	-178	-103.9	-126.8	-0.8	108.3	W360	W360-R362 PolarHBondContact O-N 3.35Å
363	P	61.5	Low	47.6	Very low	110 Å²	110	148.1 Å²	148.1	71%	0.714	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-74.9	150.5	174.3	29	-30.7	0	0	0	111.4
364	P	48.9	Very low	47.4	Very low	130 Å²	130	146.9 Å²	146.9	84%	0.844	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-81.4	159	-174.3	33.6	-34	0	0	0	113.3
365	E	39.8	Very low	47.2	Very low	180 Å²	180	149.4 Å²	149.4	84%	0.841	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.3	-171.8	-55.5	170.8	177.9	0	0	114.1
366	S	45.8	Very low	46.2	Very low	121 Å²	121	147.1 Å²	147.1	85%	0.846	79%	0.789	S	S	*	*			trans	-109.5	114.6	160.7	60.3	0	0	0	0	109.7
367	S	39.6	Very low	45.1	Very low	112 Å²	112	151.3 Å²	151.3	78%	0.783	80%	0.8	S	S	*	*			trans	-74	133.4	177.3	-42.8	0	0	0	0	112.4
368	S	43.2	Very low	44.4	Very low	106 Å²	106	149.3 Å²	149.3	74%	0.741	79%	0.793	S	S	*	*			trans	-161.5	91.4	154.6	54.6	0	0	0	0	108.2
369	L	41.8	Very low	43.9	Very low	156 Å²	156	151.2 Å²	151.2	82%	0.817	80%	0.799	S	S	*	*				51.3	95.4	95.4	-78.3	162.1	0	0	0	113.7
370	F	43.6	Very low	43.6	Very low	210 Å²	210	150.1 Å²	150.1	92%	0.921	80%	0.799	S	S	*	*			trans	-153.8	134.7	135.1	-85.3	-67.6	0	0	0	110.3
371	P	41.4	Very low	43.2	Very low	114 Å²	114	147.5 Å²	147.5	74%	0.74	80%	0.796	S	S	*	*			trans	-102.8	142.4	-172.3	34.5	-25.1	0	0	0	114.6
372	S	38	Very low	43	Very low	100 Å²	100	146.4 Å²	146.4	70%	0.699	80%	0.796	S	S	*	*				38.4	126.6	129.1	-155.2	0	0	0	0	119.8
373	Q	43.2	Very low	42.7	Very low	181 Å²	181	141.2 Å²	141.2	85%	0.846	79%	0.794	S	S	*	*				-174.3	109.2	113	-71.5	-141.6	-17.8	0	0	110.8
374	V	44.9	Very low	41.7	Very low	107 Å²	107	139.8 Å²	139.8	65%	0.648	80%	0.8	S	S	*	*				48.3	115.3	102.1	-148.2	0	0	0	0	117.1
375	K	42.4	Very low	41.1	Very low	196 Å²	196	139.5 Å²	139.5	85%	0.852	80%	0.796	S	S	*	*				174.7	139.1	111.4	-94.1	170.7	-177.8	172.6	0	114.4
376	N	37.3	Very low	41.3	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	80%	0.795	S	S	*	*			trans	-71.8	170.8	-178.1	-53.4	-53.1	0	0	0	113.8
377	H	40.9	Very low	40.8	Very low	188 Å²	188	137.4 Å²	137.4	87%	0.87	79%	0.79	S	S	*	*			trans	145.5	143.5	140.5	-79.1	-66.7	0	0	0	108.9
378	A	41.3	Very low	40.9	Very low	80 Å²	80	143.3 Å²	143.3	66%	0.661	80%	0.796	S	S	*	*			cis	-172.1	146.7	-23.9	0	0	0	0	0	104.7
379	D	40.2	Very low	40.4	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	80%	0.795	S	S	*	*			trans	-7.7	136.9	160.5	-49.1	-53.2	0	0	0	119.5
380	D	40.7	Very low	40.3	Very low	150 Å²	150	145.6 Å²	145.6	80%	0.802	80%	0.799	S	S	*	*			trans	-149.5	125.8	132.3	-157.4	9.2	0	0	0	112
381	Q	39.8	Very low	40.1	Very low	178 Å²	178	143.8 Å²	143.8	83%	0.832	80%	0.799	S	S	*	*			trans	-102.2	125	172.6	-66.7	178.3	24.2	0	0	107.5
382	T	44.8	Very low	40.2	Very low	133 Å²	133	149.5 Å²	149.5	82%	0.816	81%	0.806	S	S	*	*			trans	-139.7	124.9	154.3	44.8	0	0	0	0	111.8
383	S	36.8	Very low	40.4	Very low	120 Å²	120	149.2 Å²	149.2	84%	0.839	80%	0.801	S	S	*	*			trans	-81	144.1	-178.9	40.8	0	0	0	0	111.6
384	G	41.6	Very low	40.2	Very low	80 Å²	80	147.3 Å²	147.3	83%	0.825	80%	0.803	S	S	*	*			trans	-148.4	80.4	177.2	0	0	0	0	0	111.4
385	T	36	Very low	40	Very low	125 Å²	125	149 Å²	149	77%	0.767	80%	0.803	S	S	*	*			trans	-59.6	126.5	173.4	-55	0	0	0	0	111.8
386	T	43.8	Very low	40.1	Very low	133 Å²	133	146.2 Å²	146.2	82%	0.816	80%	0.803	S	S	*	*			trans	-148.9	116.8	147.2	-75.7	0	0	0	0	111.2
387	T	35.2	Very low	40.9	Very low	123 Å²	123	144.5 Å²	144.5	76%	0.755	80%	0.802	S	S	*	*			trans	-64.6	133.6	175.2	6.8	0	0	0	0	113
388	R	42.2	Very low	41.4	Very low	237 Å²	237	140.6 Å²	140.6	89%	0.894	79%	0.787	S	S	*	*			trans	-177.6	104.3	150.5	-95.6	170.8	-153	-148.8	7.1	105.1
389	G	32	Very low	41.7	Very low	70 Å²	70	143 Å²	143	72%	0.722	79%	0.789	S	S	*	*			cis	101.7	63.8	46.8	0	0	0	0	0	109.6
390	W	39.3	Very low	42.4	Very low	239 Å²	239	141.2 Å²	141.2	91%	0.905	78%	0.779	S	S	*	*			trans	-143.7	86.7	167.9	-66.7	101.8	0	0	0	109.7	R392	W390-R392 PolarHBondContact O-N 2.92Å
391	N	39.6	Very low	42.8	Very low	172 Å²	172	137.8 Å²	137.8	92%	0.92	77%	0.767	S	S	*	*			trans	-66.1	117.5	158.5	-71.1	-34.6	0	0	0	107
392	R	44.9	Very low	43.2	Very low	234 Å²	234	136.5 Å²	136.5	88%	0.883	76%	0.758	S	S	*	*			trans	-119.9	117.5	169.8	-160.2	172.1	-136.9	-122.5	0.7	108.9	W390	W390-R392 PolarHBondContact O-N 2.92Å
393	P	41	Very low	43.6	Very low	94 Å²	94	137.8 Å²	137.8	61%	0.61	75%	0.748	S	S	*	*			trans	-71	139.1	-180	20.1	-15.6	0	0	0	110.2	E395	P393-E395 HydrophobicContact CB-CG 4.34Å; P393-E395 PolarHBondContact O-N 3.36Å; P393-E395 VanDerWaalsContact O-N 3.11Å
394	T	39.3	Very low	44.5	Very low	142 Å²	142	139.6 Å²	139.6	87%	0.871	74%	0.738	S	S	*	*			trans	-71.5	90.9	171.8	40.8	0	0	0	0	109.5
395	E	41.2	Very low	45.5	Very low	142 Å²	142	144.3 Å²	144.3	66%	0.664	73%	0.731	S	S	*	*			trans	-126.3	86.1	174.3	-61.5	-169.8	-142.1	0	0	109.3	P393 S397	P393-E395 HydrophobicContact CB-CG 4.34Å; P393-E395 PolarHBondContact O-N 3.36Å; P393-E395 VanDerWaalsContact O-N 3.11Å; E395-S397 VanDerWaalsContact C-N 3.28Å; E395-S397 PolarHBondContact O-N 2.88Å
396	T	44.3	Very low	47	Very low	137 Å²	137	143 Å²	143	84%	0.84	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	76.1	173.5	50.3	0	0	0	0	109.5
397	S	53.6	Low	48.2	Very low	103 Å²	103	145 Å²	145	72%	0.72	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.5	-18.1	172.4	-171.7	0	0	0	0	114.4	E395	E395-S397 VanDerWaalsContact C-N 3.28Å; E395-S397 PolarHBondContact O-N 2.88Å
398	D	50.8	Low	49.9	Very low	105 Å²	105	142.7 Å²	142.7	56%	0.561	70%	0.695	S	S	*	*			trans	-101.7	3.2	-167.7	-71.5	-23.2	0	0	0	116.3	N400 C401	D398-N400 PolarHBondContact O-N 2.87Å; D398-C401 PolarHBondContact O-N 3.42Å
399	N	47.6	Very low	51.4	Low	132 Å²	132	139.7 Å²	139.7	71%	0.706	68%	0.684	S	S	*	*	H	α-helix	trans	-68.1	-18.7	-174.5	-68.1	-31.5	0	0	0	114
400	N	56.2	Low	53.3	Low	116 Å²	116	144.4 Å²	144.4	62%	0.62	68%	0.684	S	S	*	*	H	α-helix	trans	-82.5	-23.4	-179.4	-142.3	11	0	0	0	112.9	D398	D398-N400 PolarHBondContact O-N 2.87Å
401	C	48.8	Very low	54.7	Low	79 Å²	79	139.8 Å²	139.8	53%	0.534	67%	0.667	S	S	.	*	H	α-helix	trans	-73.1	-32.2	179.6	-173.6	0	0	0	0	112.5	D398	D398-C401 PolarHBondContact O-N 3.42Å
402	F	47.5	Very low	56.1	Low	150 Å²	150	139.8 Å²	139.8	66%	0.658	65%	0.654	S	S	*	*	H	α-helix	trans	-69.1	-37.5	179.5	-85.8	-85.3	0	0	0	113.3	R405 D406	F402-R405 PolarHBondContact O-N 3.43Å; F402-D406 PolarHBondContact O-N 3.01Å
403	R	54.1	Low	57.4	Low	160 Å²	160	131.5 Å²	131.5	60%	0.604	64%	0.636	S	S	*	*	H	α-helix	trans	-71.3	-32.8	-176.1	-66.9	-154.9	-176.9	174.1	7.2	113.9	R407	R403-R407 PolarHBondContact O-N 3.15Å
404	Y	55.5	Low	58.8	Low	158 Å²	158	131 Å²	131	62%	0.62	64%	0.639	S	S	*	*	H	α-helix	trans	-66.5	-41.7	175.1	-86.9	-87.5	0	0	0	111.8	D406 R407 D408	Y404-D406 VanDerWaalsContact C-N 3.35Å; Y404-D406 PolarHBondContact O-N 3.44Å; Y404-R407 PolarHBondContact O-N 3.29Å; Y404-D408 PolarHBondContact O-N 3.21Å; Y404-D408 VanDerWaalsContact O-N 3.15Å
405	R	61.7	Low	60.2	Low	180 Å²	180	128.3 Å²	128.3	68%	0.679	62%	0.622	S	S	*	*	H	α-helix	trans	-62.5	-37.2	178.8	-85.6	-174.7	162	174.2	-2.4	113.5	F402 R409	F402-R405 PolarHBondContact O-N 3.43Å; R405-R409 WeakPolarHBondContact O-CB 3.38Å; R405-R409 PolarHBondContact O-N 3.47Å
406	D	67.9	Low	61.6	Low	97 Å²	97	128.3 Å²	128.3	52%	0.519	63%	0.626	S	S	.	*	H	α-helix	trans	-70.2	-35.6	177.3	-91.6	-25.1	0	0	0	112.5	F402 Y404 R409 K410	F402-D406 PolarHBondContact O-N 3.01Å; Y404-D406 VanDerWaalsContact C-N 3.35Å; Y404-D406 PolarHBondContact O-N 3.44Å; D406-R409 PolarHBondContact O-N 2.81Å; D406-K410 WeakPolarHBondContact O-CB 3.27Å; D406-K410 PolarHBondContact O-N 3.28Å
407	R	70.2	Confident	63	Low	174 Å²	174	122.5 Å²	122.5	66%	0.657	59%	0.594	S	S	*	*	H	α-helix	trans	-66	-42.9	177.6	-151.4	179.3	-148.5	-170.8	5.4	111.6	R403 Y404 K410 R411	R403-R407 PolarHBondContact O-N 3.15Å; Y404-R407 PolarHBondContact O-N 3.29Å; R407-K410 PolarHBondContact O-N 3.04Å; R407-R411 PolarHBondContact O-N 3.31Å
408	D	70.5	Confident	64.1	Low	76 Å²	76	124.2 Å²	124.2	41%	0.406	60%	0.603	S	S	.	*	H	α-helix	trans	-67.1	-39.3	175.7	-76.2	-22.2	0	0	0	112.4	Y404 K410 R411 R412	Y404-D408 PolarHBondContact O-N 3.21Å; Y404-D408 VanDerWaalsContact O-N 3.15Å; D408-K410 VanDerWaalsContact C-N 3.33Å; D408-K410 PolarHBondContact O-N 3.17Å; D408-R411 PolarHBondContact O-N 3.05Å; D408-R412 WeakPolarHBondContact O-CG 3.48Å; D408-R412 PolarHBondContact O-N 3.05Å
409	R	72.8	Confident	65	Low	174 Å²	174	121.5 Å²	121.5	66%	0.657	59%	0.588	S	S	*	*	H	α-helix	trans	-60.8	-44.2	173.9	-173.1	-177.9	-68.5	178.5	-2.7	111	R405 D406 R412 A413	R405-R409 WeakPolarHBondContact O-CB 3.38Å; R405-R409 PolarHBondContact O-N 3.47Å; D406-R409 PolarHBondContact O-N 2.81Å; R409-R412 PolarHBondContact O-N 2.91Å; R409-A413 WeakPolarHBondContact O-CB 3.33Å; R409-A413 PolarHBondContact O-N 2.89Å
410	K	72.7	Confident	66.5	Low	168 Å²	168	119.8 Å²	119.8	73%	0.73	58%	0.579	S	S	*	*	H	α-helix	trans	-65.3	-40.1	177.1	-165.9	171.1	-175.6	177.5	0	112	D406 R407 D408 A413 A414	D406-K410 WeakPolarHBondContact O-CB 3.27Å; D406-K410 PolarHBondContact O-N 3.28Å; R407-K410 PolarHBondContact O-N 3.04Å; D408-K410 VanDerWaalsContact C-N 3.33Å; D408-K410 PolarHBondContact O-N 3.17Å; K410-A413 PolarHBondContact O-N 2.78Å; K410-A414 PolarHBondContact O-N 3.46Å; K410-A414 VanDerWaalsContact O-N 3.07Å
411	R	69.1	Low	67.7	Low	143 Å²	143	118.1 Å²	118.1	54%	0.54	57%	0.574	S	S	.	*	H	α-helix	trans	-62.2	-47.6	174.9	-165.9	-174.8	-67.9	-150.1	-0.9	111.3	R407 D408 A413 A414 T415	R407-R411 PolarHBondContact O-N 3.31Å; D408-R411 PolarHBondContact O-N 3.05Å; R411-A413 PolarHBondContact O-N 3.07Å; R411-A414 PolarHBondContact O-N 3.37Å; R411-T415 PolarHBondContact O-N 3.33Å; R411-T415 PolarHBondContact O-OG1 3.04Å
412	R	67.8	Low	69.2	Low	171 Å²	171	122 Å²	122	65%	0.645	59%	0.586	S	S	*	*	H	α-helix	trans	-64.7	-36.9	175.9	-71.4	-175	-156.4	158.1	6.8	112.9	D408 R409 A414 T415 L416	D408-R412 WeakPolarHBondContact O-CG 3.48Å; D408-R412 PolarHBondContact O-N 3.05Å; R409-R412 PolarHBondContact O-N 2.91Å; R412-A414 VanDerWaalsContact C-N 3.3Å; R412-A414 PolarHBondContact O-N 3.28Å; R412-T415 PolarHBondContact O-N 2.88Å; R412-L416 PolarHBondContact O-N 2.75Å
413	A	72.1	Confident	70.6	Confident	61 Å²	61	118 Å²	118	50%	0.504	57%	0.572	S	S	.	*	H	α-helix	trans	-63.3	-36.7	175.7	0	0	0	0	0	111.8	R409 K410 R411 G417	R409-A413 WeakPolarHBondContact O-CB 3.33Å; R409-A413 PolarHBondContact O-N 2.89Å; K410-A413 PolarHBondContact O-N 2.78Å; R411-A413 PolarHBondContact O-N 3.07Å; A413-G417 WeakPolarHBondContact O-CA 3.49Å; A413-G417 PolarHBondContact O-N 3.39Å
414	A	70.1	Confident	71.7	Confident	83 Å²	83	114.8 Å²	114.8	69%	0.686	57%	0.572	S	S	*	*	H	α-helix	trans	-69.4	-33.7	175.4	0	0	0	0	0	113.1	K410 R411 R412	K410-A414 PolarHBondContact O-N 3.46Å; K410-A414 VanDerWaalsContact O-N 3.07Å; R411-A414 PolarHBondContact O-N 3.37Å; R412-A414 VanDerWaalsContact C-N 3.3Å; R412-A414 PolarHBondContact O-N 3.28Å
415	T	69.2	Low	72.8	Confident	85 Å²	85	108 Å²	108	52%	0.521	55%	0.548	S	S	.	.	H	α-helix	trans	-88.7	-40.8	-177.7	-43.1	0	0	0	0	113.5	R411 R412	R411-T415 PolarHBondContact O-N 3.33Å; R411-T415 PolarHBondContact O-OG1 3.04Å; R412-T415 PolarHBondContact O-N 2.88Å
416	L	70.9	Confident	73.6	Confident	142 Å²	142	101.7 Å²	101.7	74%	0.743	53%	0.532	S	S	*	.	H	α-helix	trans	-119.5	-2.7	-170.7	-61.1	176.5	0	0	0	113.8	R412	R412-L416 PolarHBondContact O-N 2.75Å
417	G	73.5	Confident	74.1	Confident	16 Å²	16	105.7 Å²	105.7	17%	0.165	54%	0.541	C	S	.	.	S	Bend	trans	-67.5	164.8	178.8	0	0	0	0	0	113	A413 L419 R432	A413-G417 WeakPolarHBondContact O-CA 3.49Å; A413-G417 PolarHBondContact O-N 3.39Å; G417-L419 PolarHBondContact O-N 2.81Å; G417-R432 PolarHBondContact O-NH1 2.88Å
418	P	76.8	Confident	74.4	Confident	139 Å²	139	99.1 Å²	99.1	90%	0.903	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-55.1	122.6	167.9	22.7	-29.9	0	0	0	108.6
419	L	70.1	Confident	74.8	Confident	47 Å²	47	103.9 Å²	103.9	25%	0.246	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-64.1	141.1	178.2	-76.1	169.4	0	0	0	109.5	G417 P421 R432	G417-L419 PolarHBondContact O-N 2.81Å; L419-P421 WeakPolarHBondContact O-CD 3.45Å; L419-R432 HydrophobicContact CD2-CG 4.35Å; L419-R432 VanDerWaalsContact CG-NH2 3.32Å
420	D	79.9	Confident	74.9	Confident	97 Å²	97	100.5 Å²	100.5	52%	0.519	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-58.1	122.6	165.7	-177.7	-7.5	0	0	0	107.6	M422 D423 S426	D420-M422 PolarHBondContact O-N 2.78Å; D420-M422 PolarHBondContact OD1-N 2.77Å; D420-D423 HydrophobicContact CB-CB 4.21Å; D420-D423 WeakPolarHBondContact O-CB 3.37Å; D420-D423 PolarHBondContact O-N 3.42Å; D420-S426 WeakPolarHBondContact O-CB 3.38Å
421	P	80.8	Confident	74.8	Confident	81 Å²	81	97.5 Å²	97.5	53%	0.526	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-24.6	173.4	-25.7	34.6	0	0	0	112.4	L419 Y427	L419-P421 WeakPolarHBondContact O-CD 3.45Å; P421-Y427 WeakPolarHBondContact O-CE2 3.41Å; P421-Y427 PolarHBondContact O-OH 3.46Å
422	M	80	Confident	75.1	Confident	160 Å²	160	96.8 Å²	96.8	79%	0.788	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-5.3	176.7	-64.8	-168	63.1	0	0	115	D420	D420-M422 PolarHBondContact O-N 2.78Å; D420-M422 PolarHBondContact OD1-N 2.77Å
423	D	76.3	Confident	75.3	Confident	66 Å²	66	91.3 Å²	91.3	35%	0.353	54%	0.539	S	S	.	.	S	Bend	trans	-73.3	129.9	175.5	-169.3	-23.9	0	0	0	109.6	D420 A425 S426	D420-D423 HydrophobicContact CB-CB 4.21Å; D420-D423 WeakPolarHBondContact O-CB 3.37Å; D420-D423 PolarHBondContact O-N 3.42Å; D423-A425 PolarHBondContact O-N 3.33Å; D423-A425 VanDerWaalsContact O-N 3.09Å; D423-A425 WeakPolarHBondContact OD1-CB 3.45Å; D423-A425 PolarHBondContact OD1-N 3.47Å; D423-S426 WeakPolarHBondContact O-CA 3.36Å; D423-S426 WeakPolarHBondContact O-CB 3.37Å; D423-S426 PolarHBondContact O-N 2.9Å
424	P	77.4	Confident	75.4	Confident	93 Å²	93	92.4 Å²	92.4	60%	0.604	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-51	-31.4	172.1	-27.4	33.8	0	0	0	113.9	S426 Y427	P424-S426 PolarHBondContact O-N 2.88Å; P424-Y427 PolarHBondContact O-N 3.21Å
425	A	78.8	Confident	75.3	Confident	15 Å²	15	100.2 Å²	100.2	12%	0.124	55%	0.551	C	S	.	*	G	3₁₀ helix	trans	-67.4	-10.6	174.3	0	0	0	0	0	113.6	D423 R432	D423-A425 PolarHBondContact O-N 3.33Å; D423-A425 VanDerWaalsContact O-N 3.09Å; D423-A425 WeakPolarHBondContact OD1-CB 3.45Å; D423-A425 PolarHBondContact OD1-N 3.47Å; A425-R432 HydrophobicContact CB-CG 4.36Å
426	S	79.2	Confident	75.3	Confident	48 Å²	48	98 Å²	98	34%	0.336	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-84.9	-18.3	174.4	-169.1	0	0	0	0	113.9	D420 D423 P424	D420-S426 WeakPolarHBondContact O-CB 3.38Å; D423-S426 WeakPolarHBondContact O-CA 3.36Å; D423-S426 WeakPolarHBondContact O-CB 3.37Å; D423-S426 PolarHBondContact O-N 2.9Å; P424-S426 PolarHBondContact O-N 2.88Å
427	Y	77.6	Confident	75.2	Confident	180 Å²	180	93.7 Å²	93.7	71%	0.706	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.7	2.3	-173.9	-63.1	-60	0	0	0	114.9	P421 P424	P421-Y427 WeakPolarHBondContact O-CE2 3.41Å; P421-Y427 PolarHBondContact O-OH 3.46Å; P424-Y427 PolarHBondContact O-N 3.21Å
428	G	77.9	Confident	74.9	Confident	36 Å²	36	96.4 Å²	96.4	37%	0.371	55%	0.548	S	S	.	.	S	Bend	trans	-159.9	-178.7	178.1	0	0	0	0	0	114.2	I430	G428-I430 PolarHBondContact O-N 3.48Å
429	D	77.9	Confident	74.4	Confident	177 Å²	177	95 Å²	95	95%	0.947	53%	0.533	S	S	*	.	S	Bend	trans	-77.2	20.7	-176.2	-57.8	-35.2	0	0	0	113.8
430	I	75.7	Confident	74.2	Confident	102 Å²	102	98.3 Å²	98.3	52%	0.523	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-72.8	129.3	179.5	-57.3	97.5	0	0	0	108.5	G428 R432	G428-I430 PolarHBondContact O-N 3.48Å; I430-R432 PolarHBondContact O-N 3.44Å
431	P	69.5	Low	73.3	Confident	105 Å²	105	96 Å²	96	68%	0.682	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-61.2	135.4	179.4	23.3	-32.7	0	0	0	111.3	G433	P431-G433 PolarHBondContact O-N 3.43Å
432	R	75.3	Confident	72.4	Confident	129 Å²	129	96.3 Å²	96.3	49%	0.487	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-66.1	129.7	174.3	-61.4	-179.8	-177.5	-146.8	2.9	109.7	G417 L419 A425 I430	G417-R432 PolarHBondContact O-NH1 2.88Å; L419-R432 HydrophobicContact CD2-CG 4.35Å; L419-R432 VanDerWaalsContact CG-NH2 3.32Å; A425-R432 HydrophobicContact CB-CG 4.36Å; I430-R432 PolarHBondContact O-N 3.44Å
433	G	73.5	Confident	71.3	Confident	56 Å²	56	92.4 Å²	92.4	58%	0.577	53%	0.532	S	S	*	.			trans	178.4	172.4	176.7	0	0	0	0	0	113.5	P431	P431-G433 PolarHBondContact O-N 3.43Å
434	T	72.9	Confident	70.5	Confident	84 Å²	84	92.6 Å²	92.6	52%	0.515	55%	0.549	S	S	.	.			trans	-70.6	162.8	166.1	54.7	0	0	0	0	109.4	S436 S437	T434-S436 PolarHBondContact O-N 2.9Å; T434-S436 PolarHBondContact OG1-OG 3.13Å; T434-S437 VanDerWaalsContact O-CB 3.22Å; T434-S437 WeakPolarHBondContact O-CB 3.38Å; T434-S437 PolarHBondContact O-N 3.4Å
435	W	68.1	Low	69.6	Low	247 Å²	247	90.7 Å²	90.7	94%	0.936	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-51.3	-26.2	178.4	-67.5	-23.5	0	0	0	114.7	S437	W435-S437 VanDerWaalsContact C-N 3.34Å
436	S	70.5	Confident	68.6	Low	38 Å²	38	93.4 Å²	93.4	27%	0.266	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-73.6	-18.8	175.5	53.4	0	0	0	0	114.5	T434 G438 L439 V442	T434-S436 PolarHBondContact O-N 2.9Å; T434-S436 PolarHBondContact OG1-OG 3.13Å; S436-G438 PolarHBondContact O-N 3.3Å; S436-L439 PolarHBondContact O-N 3.45Å; S436-V442 VanDerWaalsContact O-CB 3.26Å; S436-V442 WeakPolarHBondContact O-CB 3.47Å; S436-V442 WeakPolarHBondContact O-CG2 3.49Å
437	S	68.2	Low	67.6	Low	51 Å²	51	93.1 Å²	93.1	36%	0.357	55%	0.55	S	S	.	*	G	3₁₀ helix	trans	-67.2	-16.9	-174.3	-166.2	0	0	0	0	114.1	T434 W435	T434-S437 VanDerWaalsContact O-CB 3.22Å; T434-S437 WeakPolarHBondContact O-CB 3.38Å; T434-S437 PolarHBondContact O-N 3.4Å; W435-S437 VanDerWaalsContact C-N 3.34Å
438	G	66.4	Low	66.7	Low	73 Å²	73	87.4 Å²	87.4	75%	0.753	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-99.1	-0.4	177	0	0	0	0	0	114.9	S436	S436-G438 PolarHBondContact O-N 3.3Å
439	L	66.5	Low	65.9	Low	109 Å²	109	94.8 Å²	94.8	57%	0.571	56%	0.562	S	S	*	*	S	Bend	trans	-81.5	126.6	174.6	-94.6	117.1	0	0	0	109.7	S436 G441 V442 T443	S436-L439 PolarHBondContact O-N 3.45Å; L439-G441 PolarHBondContact O-N 3.02Å; L439-V442 HydrophobicContact CB-CB 4.49Å; L439-V442 HydrophobicContact CB-CG2 3.96Å; L439-V442 PolarHBondContact O-N 2.7Å; L439-T443 PolarHBondContact O-N 2.89Å
440	E	65.4	Low	65.2	Low	117 Å²	117	90.1 Å²	90.1	55%	0.547	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-38.3	176.4	-64.2	169.9	179	0	0	111.6	V442 T443 T445 S447	E440-V442 VanDerWaalsContact C-N 3.3Å; E440-V442 PolarHBondContact O-N 3.48Å; E440-T443 PolarHBondContact O-N 3.48Å; E440-T443 PolarHBondContact O-OG1 2.88Å; E440-T443 VanDerWaalsContact O-OG1 3.06Å; E440-T445 CarbonylContact C-O 3.4Å; E440-T445 PolarHBondContact O-OG1 3.42Å; E440-T445 VanDerWaalsContact O-OG1 3.04Å; E440-S447 PolarHBondContact OE2-OG 3.47Å
441	G	62.1	Low	64.8	Low	49 Å²	49	87.1 Å²	87.1	51%	0.505	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.6	178.5	0	0	0	0	0	116.3	L439	L439-G441 PolarHBondContact O-N 3.02Å
442	V	61	Low	64.8	Low	88 Å²	88	83.7 Å²	83.7	53%	0.533	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-25.6	-178.8	-179.2	0	0	0	0	111.3	S436 L439 E440 G444	S436-V442 VanDerWaalsContact O-CB 3.26Å; S436-V442 WeakPolarHBondContact O-CB 3.47Å; S436-V442 WeakPolarHBondContact O-CG2 3.49Å; L439-V442 HydrophobicContact CB-CB 4.49Å; L439-V442 HydrophobicContact CB-CG2 3.96Å; L439-V442 PolarHBondContact O-N 2.7Å; E440-V442 VanDerWaalsContact C-N 3.3Å; E440-V442 PolarHBondContact O-N 3.48Å; V442-G444 PolarHBondContact O-N 3.32Å
443	T	58	Low	64.4	Low	78 Å²	78	80.8 Å²	80.8	48%	0.479	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	7.6	179.9	47.4	0	0	0	0	114	L439 E440 T445	L439-T443 PolarHBondContact O-N 2.89Å; E440-T443 PolarHBondContact O-N 3.48Å; E440-T443 PolarHBondContact O-OG1 2.88Å; E440-T443 VanDerWaalsContact O-OG1 3.06Å; T443-T445 PolarHBondContact O-N 2.91Å; T443-T445 PolarHBondContact OG1-OG1 2.93Å
444	G	59.6	Low	64.2	Low	69 Å²	69	82.6 Å²	82.6	71%	0.711	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	7.3	-177.7	0	0	0	0	0	113.8	V442 P446	V442-G444 PolarHBondContact O-N 3.32Å; G444-P446 WeakPolarHBondContact O-CD 3.41Å
445	T	58.3	Low	64.2	Low	53 Å²	53	84 Å²	84	33%	0.325	52%	0.518	S	S	.	.			trans	-89.6	109.7	171.4	39.2	0	0	0	0	108.1	E440 T443 S447	E440-T445 CarbonylContact C-O 3.4Å; E440-T445 PolarHBondContact O-OG1 3.42Å; E440-T445 VanDerWaalsContact O-OG1 3.04Å; T443-T445 PolarHBondContact O-N 2.91Å; T443-T445 PolarHBondContact OG1-OG1 2.93Å; T445-S447 PolarHBondContact O-N 3.01Å
446	P	56.3	Low	64.3	Low	72 Å²	72	72.8 Å²	72.8	47%	0.468	48%	0.478	S	S	.	.			trans	-58.1	129.7	177.5	24.7	-32.2	0	0	0	108.3	G444 A448 A479	G444-P446 WeakPolarHBondContact O-CD 3.41Å; P446-A448 PolarHBondContact O-N 3.31Å; P446-A479 HydrophobicContact CG-CB 4.02Å
447	S	59	Low	64.7	Low	43 Å²	43	76.4 Å²	76.4	30%	0.301	50%	0.503	S	S	.	.			trans	-56.6	103.5	-178.6	-175.1	0	0	0	0	109.2	E440 T445 K449 T450 G451	E440-S447 PolarHBondContact OE2-OG 3.47Å; T445-S447 PolarHBondContact O-N 3.01Å; S447-K449 PolarHBondContact O-N 3.02Å; S447-T450 PolarHBondContact O-N 3.37Å; S447-G451 PolarHBondContact O-N 2.91Å
448	A	59.6	Low	65.2	Low	59 Å²	59	76.1 Å²	76.1	49%	0.488	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-7.3	-166.5	0	0	0	0	0	113.3	P446 N476	P446-A448 PolarHBondContact O-N 3.31Å; A448-N476 WeakPolarHBondContact CA-OD1 3.42Å; A448-N476 PolarHBondContact O-ND2 3.1Å
449	K	60.3	Low	65.8	Low	191 Å²	191	77.2 Å²	77.2	83%	0.83	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-21.6	-167.9	-147.9	156.4	-170.6	165.5	0	114.7	S447	S447-K449 PolarHBondContact O-N 3.02Å
450	T	63.7	Low	66.3	Low	80 Å²	80	76.5 Å²	76.5	49%	0.491	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	-19.5	-176.1	59.5	0	0	0	0	113.7	S447 V452	S447-T450 PolarHBondContact O-N 3.37Å; T450-V452 WeakPolarHBondContact O-CG2 3.32Å; T450-V452 PolarHBondContact O-N 3.3Å
451	G	66.5	Low	66.9	Low	39 Å²	39	74.8 Å²	74.8	40%	0.402	49%	0.489	S	S	.	.			trans	56.6	10	-177.8	0	0	0	0	0	113.6	S447 P467	S447-G451 PolarHBondContact O-N 2.91Å; G451-P467 WeakPolarHBondContact O-CG 3.46Å
452	V	70.3	Confident	67.8	Low	32 Å²	32	80 Å²	80	19%	0.194	50%	0.5	C	S	.	.			trans	-84.7	126.5	-177.1	-176.3	0	0	0	0	107.7	T450 S454 F461 Y466	T450-V452 WeakPolarHBondContact O-CG2 3.32Å; T450-V452 PolarHBondContact O-N 3.3Å; V452-S454 PolarHBondContact O-N 3.46Å; V452-S454 VanDerWaalsContact O-N 3.09Å; V452-F461 HydrophobicContact CB-CE2 4.31Å; V452-F461 HydrophobicContact CB-CZ 4.31Å; V452-F461 HydrophobicContact CG1-CD2 4.01Å; V452-F461 HydrophobicContact CG1-CE1 4.37Å; V452-F461 HydrophobicContact CG1-CE2 3.23Å; V452-F461 HydrophobicContact CG1-CZ 3.46Å; V452-F461 VanDerWaalsContact CG1-CZ 3.46Å; V452-Y466 HydrophobicContact CG2-CD1 3.7Å; V452-Y466 HydrophobicContact CG2-CE1 3.64Å
453	D	65.7	Low	68.8	Low	69 Å²	69	83 Å²	83	37%	0.369	51%	0.508	S	S	.	.			trans	-68.4	104.5	174.3	177.7	7.4	0	0	0	110.3	T455 R464	D453-T455 PolarHBondContact O-N 2.96Å; D453-T455 WeakPolarHBondContact OD1-CB 3.42Å; D453-T455 WeakPolarHBondContact OD1-CG2 3.47Å; D453-T455 PolarHBondContact OD1-N 3.18Å; D453-T455 PolarHBondContact OD1-OG1 2.99Å; D453-T455 PolarHBondContact OD2-OG1 3.45Å; D453-R464 VanDerWaalsContact CB-NH1 3.33Å; D453-R464 VanDerWaalsContact CG-NH1 3.26Å; D453-R464 IonicContact OD2-CZ 3.38Å; D453-R464 IonicContact OD2-NH1 2.75Å; D453-R464 PolarHBondContact OD2-NH1 2.97Å; D453-R464 IonicContact OD2-NH2 2.71Å
454	S	70.4	Confident	69.6	Low	93 Å²	93	84.2 Å²	84.2	65%	0.65	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	0.5	177.1	49.2	0	0	0	0	114	V452 A456	V452-S454 PolarHBondContact O-N 3.46Å; V452-S454 VanDerWaalsContact O-N 3.09Å; S454-A456 VanDerWaalsContact C-N 3.31Å
455	T	72.9	Confident	70.6	Confident	114 Å²	114	86.9 Å²	86.9	70%	0.699	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-20.3	178	67.8	0	0	0	0	113.1	D453	D453-T455 PolarHBondContact O-N 2.96Å; D453-T455 WeakPolarHBondContact OD1-CB 3.42Å; D453-T455 WeakPolarHBondContact OD1-CG2 3.47Å; D453-T455 PolarHBondContact OD1-N 3.18Å; D453-T455 PolarHBondContact OD1-OG1 2.99Å; D453-T455 PolarHBondContact OD2-OG1 3.45Å
456	A	69.9	Low	71.5	Confident	12 Å²	12	92.6 Å²	92.6	10%	0.099	53%	0.526	C	S	.	.	S	Bend	trans	-87.2	112.7	174.9	0	0	0	0	0	110.5	S454 L460 F461	S454-A456 VanDerWaalsContact C-N 3.31Å; A456-L460 HydrophobicContact CB-CD2 4.45Å; A456-F461 WeakPolarHBondContact O-CB 3.43Å
457	S	77.7	Confident	72.7	Confident	114 Å²	114	91.5 Å²	91.5	80%	0.797	52%	0.519	S	S	*	.			trans	-84.8	152.2	173.9	-177.2	0	0	0	0	112
458	G	78.8	Confident	74	Confident	44 Å²	44	93.5 Å²	93.5	45%	0.454	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	-154.1	169.7	0	0	0	0	0	115.5	L460 F461	G458-L460 PolarHBondContact O-N 3.49Å; G458-L460 VanDerWaalsContact O-N 3.09Å; G458-F461 VanDerWaalsContact O-CB 3.24Å; G458-F461 WeakPolarHBondContact O-CB 3.41Å; G458-F461 PolarHBondContact O-N 3Å
459	P	80.5	Confident	75.2	Confident	96 Å²	96	95.7 Å²	95.7	62%	0.623	54%	0.535	S	S	*	.	H	α-helix	trans	-59.8	-23.1	-176.6	-20.5	30.6	0	0	0	113.8	F461 Q462 Q463	P459-F461 VanDerWaalsContact C-N 3.26Å; P459-F461 PolarHBondContact O-N 3.23Å; P459-Q462 PolarHBondContact O-N 3.27Å; P459-Q462 VanDerWaalsContact O-N 3.14Å; P459-Q463 PolarHBondContact O-N 3.09Å
460	L	77.3	Confident	76.5	Confident	94 Å²	94	88.3 Å²	88.3	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-66.5	-28.8	178.4	-167.8	65.2	0	0	0	112.1	A456 G458 Q462 Q463 R464	A456-L460 HydrophobicContact CB-CD2 4.45Å; G458-L460 PolarHBondContact O-N 3.49Å; G458-L460 VanDerWaalsContact O-N 3.09Å; L460-Q462 PolarHBondContact O-N 3.46Å; L460-Q463 PolarHBondContact O-N 3.41Å; L460-R464 WeakPolarHBondContact O-CG 3.42Å
461	F	77.7	Confident	77.5	Confident	82 Å²	82	87.4 Å²	87.4	36%	0.36	51%	0.505	S	S	.	.	H	α-helix	trans	-58	-37.9	171.9	-176.7	-102.2	0	0	0	111.6	V452 A456 G458 P459	V452-F461 HydrophobicContact CB-CE2 4.31Å; V452-F461 HydrophobicContact CB-CZ 4.31Å; V452-F461 HydrophobicContact CG1-CD2 4.01Å; V452-F461 HydrophobicContact CG1-CE1 4.37Å; V452-F461 HydrophobicContact CG1-CE2 3.23Å; V452-F461 HydrophobicContact CG1-CZ 3.46Å; V452-F461 VanDerWaalsContact CG1-CZ 3.46Å; A456-F461 WeakPolarHBondContact O-CB 3.43Å; G458-F461 VanDerWaalsContact O-CB 3.24Å; G458-F461 WeakPolarHBondContact O-CB 3.41Å; G458-F461 PolarHBondContact O-N 3Å; P459-F461 VanDerWaalsContact C-N 3.26Å; P459-F461 PolarHBondContact O-N 3.23Å
462	Q	80.4	Confident	78.2	Confident	159 Å²	159	87.1 Å²	87.1	74%	0.743	50%	0.495	S	S	*	.	H	α-helix	trans	-81.9	-20.3	-176.8	-63.1	175.5	-11.1	0	0	113.6	P459 L460	P459-Q462 PolarHBondContact O-N 3.27Å; P459-Q462 VanDerWaalsContact O-N 3.14Å; L460-Q462 PolarHBondContact O-N 3.46Å
463	Q	81.2	Confident	78.9	Confident	150 Å²	150	91.4 Å²	91.4	70%	0.701	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-5.4	-177.5	-69.9	-178.2	-5.2	0	0	113.6	P459 L460	P459-Q463 PolarHBondContact O-N 3.09Å; L460-Q463 PolarHBondContact O-N 3.41Å
464	R	75.7	Confident	79.9	Confident	104 Å²	104	96.1 Å²	96.1	39%	0.392	53%	0.529	S	S	.	.	S	Bend	trans	-83.8	130.5	-177.9	-76.7	168.9	150.8	-135.4	0.2	110.7	D453 L460 Y466	D453-R464 VanDerWaalsContact CB-NH1 3.33Å; D453-R464 VanDerWaalsContact CG-NH1 3.26Å; D453-R464 IonicContact OD2-CZ 3.38Å; D453-R464 IonicContact OD2-NH1 2.75Å; D453-R464 PolarHBondContact OD2-NH1 2.97Å; D453-R464 IonicContact OD2-NH2 2.71Å; L460-R464 WeakPolarHBondContact O-CG 3.42Å; R464-Y466 PolarHBondContact O-N 3.16Å
465	P	79.7	Confident	80.4	Confident	125 Å²	125	94 Å²	94	81%	0.812	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-57.6	129.7	172.6	-20.9	31.4	0	0	0	110.1
466	Y	78.8	Confident	80.9	Confident	173 Å²	173	90.9 Å²	90.9	68%	0.678	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-61	140.2	171.4	-69.4	-87.9	0	0	0	109.6	V452 R464	V452-Y466 HydrophobicContact CG2-CD1 3.7Å; V452-Y466 HydrophobicContact CG2-CE1 3.64Å; R464-Y466 PolarHBondContact O-N 3.16Å
467	P	81	Confident	81.6	Confident	49 Å²	49	93 Å²	93	32%	0.318	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-58.4	144.3	173.3	25.7	-34	0	0	0	109.8	G451 D471 V472	G451-P467 WeakPolarHBondContact O-CG 3.46Å; P467-D471 HydrophobicContact CB-CB 4.42Å; P467-V472 HydrophobicContact CB-CG2 4.11Å; P467-V472 HydrophobicContact CG-CG2 3.75Å
468	N	85.1	Confident	82	Confident	85 Å²	85	90 Å²	90	46%	0.455	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-63.6	151.9	175.1	68.2	59	0	0	0	109.3	G470 D471 V472	N468-G470 PolarHBondContact O-N 3.33Å; N468-G470 WeakPolarHBondContact OD1-CA 3.5Å; N468-G470 PolarHBondContact OD1-N 3.3Å; N468-D471 PolarHBondContact ND2-OD2 3.12Å; N468-D471 PolarHBondContact O-N 3.09Å; N468-D471 PolarHBondContact OD1-N 3.49Å; N468-V472 PolarHBondContact O-N 3.48Å
469	P	85.5	Confident	81.9	Confident	105 Å²	105	89 Å²	89	68%	0.682	48%	0.483	S	S	*	.	H	α-helix	trans	-54.9	-29.2	-179.1	-27.2	34.3	0	0	0	114	L473	P469-L473 WeakPolarHBondContact O-CG 3.22Å; P469-L473 PolarHBondContact O-N 3.5Å; P469-L473 VanDerWaalsContact O-N 3.07Å
470	G	87.7	Confident	82.1	Confident	35 Å²	35	90.2 Å²	90.2	36%	0.361	48%	0.479	S	S	.	.	H	α-helix	trans	-69.1	-37.7	177.6	0	0	0	0	0	113.6	N468 L473 R474	N468-G470 PolarHBondContact O-N 3.33Å; N468-G470 WeakPolarHBondContact OD1-CA 3.5Å; N468-G470 PolarHBondContact OD1-N 3.3Å; G470-L473 PolarHBondContact O-N 2.91Å; G470-R474 WeakPolarHBondContact O-CB 3.41Å; G470-R474 PolarHBondContact O-N 2.94Å
471	D	84.9	Confident	82.4	Confident	62 Å²	62	89.2 Å²	89.2	33%	0.332	48%	0.476	S	S	.	.	H	α-helix	trans	-70.2	-36	176.4	-71.2	-25.4	0	0	0	111	P467 N468 R474 A475	P467-D471 HydrophobicContact CB-CB 4.42Å; N468-D471 PolarHBondContact ND2-OD2 3.12Å; N468-D471 PolarHBondContact O-N 3.09Å; N468-D471 PolarHBondContact OD1-N 3.49Å; D471-R474 PolarHBondContact O-N 2.91Å; D471-R474 IonicContact OD1-CZ 2.7Å; D471-R474 IonicContact OD1-NH1 3.12Å; D471-R474 PolarHBondContact OD1-NH1 3.09Å; D471-R474 IonicContact OD1-NH2 3.45Å; D471-A475 WeakPolarHBondContact O-CB 3.27Å; D471-A475 PolarHBondContact O-N 3.24Å
472	V	81.5	Confident	82.4	Confident	32 Å²	32	90.8 Å²	90.8	19%	0.194	48%	0.484	C	S	.	.	H	α-helix	trans	-62.6	-45.4	172	-179.1	0	0	0	0	110.8	P467 N468 R474 A475 N476	P467-V472 HydrophobicContact CB-CG2 4.11Å; P467-V472 HydrophobicContact CG-CG2 3.75Å; N468-V472 PolarHBondContact O-N 3.48Å; V472-R474 VanDerWaalsContact C-N 3.34Å; V472-R474 PolarHBondContact O-N 3.41Å; V472-A475 PolarHBondContact O-N 2.82Å; V472-N476 WeakPolarHBondContact O-CB 3.39Å; V472-N476 VanDerWaalsContact O-CG 3.26Å; V472-N476 PolarHBondContact O-N 3.06Å
473	L	84.6	Confident	82.3	Confident	122 Å²	122	88.1 Å²	88.1	64%	0.639	47%	0.472	S	S	*	.	H	α-helix	trans	-63.1	-39.5	176.1	-70.7	173.7	0	0	0	112.2	P469 G470 N476 A477	P469-L473 WeakPolarHBondContact O-CG 3.22Å; P469-L473 PolarHBondContact O-N 3.5Å; P469-L473 VanDerWaalsContact O-N 3.07Å; G470-L473 PolarHBondContact O-N 2.91Å; L473-N476 PolarHBondContact O-N 3.33Å; L473-A477 VanDerWaalsContact O-CB 3.32Å; L473-A477 WeakPolarHBondContact O-CB 3.47Å; L473-A477 PolarHBondContact O-N 3.4Å
474	R	86.4	Confident	82.2	Confident	169 Å²	169	85.3 Å²	85.3	64%	0.638	46%	0.459	S	S	*	.	H	α-helix	trans	-67.3	-40.7	177.4	-163.4	-175.9	-59.4	125	7	111.8	G470 D471 V472 A477 A478	G470-R474 WeakPolarHBondContact O-CB 3.41Å; G470-R474 PolarHBondContact O-N 2.94Å; D471-R474 PolarHBondContact O-N 2.91Å; D471-R474 IonicContact OD1-CZ 2.7Å; D471-R474 IonicContact OD1-NH1 3.12Å; D471-R474 PolarHBondContact OD1-NH1 3.09Å; D471-R474 IonicContact OD1-NH2 3.45Å; V472-R474 VanDerWaalsContact C-N 3.34Å; V472-R474 PolarHBondContact O-N 3.41Å; R474-A477 PolarHBondContact O-N 3.2Å; R474-A478 WeakPolarHBondContact O-CB 3.42Å; R474-A478 PolarHBondContact O-N 2.85Å
475	A	81.8	Confident	82.3	Confident	47 Å²	47	84.8 Å²	84.8	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-42.8	175.3	0	0	0	0	0	111.8	D471 V472 A478 A479	D471-A475 WeakPolarHBondContact O-CB 3.27Å; D471-A475 PolarHBondContact O-N 3.24Å; V472-A475 PolarHBondContact O-N 2.82Å; A475-A478 PolarHBondContact O-N 2.9Å; A475-A479 WeakPolarHBondContact O-CB 3.49Å; A475-A479 PolarHBondContact O-N 3.37Å
476	N	82.3	Confident	82	Confident	50 Å²	50	85.7 Å²	85.7	27%	0.267	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-38.7	175.3	-71.4	-6.6	0	0	0	111.8	A448 V472 L473 A479 K480	A448-N476 WeakPolarHBondContact CA-OD1 3.42Å; A448-N476 PolarHBondContact O-ND2 3.1Å; V472-N476 WeakPolarHBondContact O-CB 3.39Å; V472-N476 VanDerWaalsContact O-CG 3.26Å; V472-N476 PolarHBondContact O-N 3.06Å; L473-N476 PolarHBondContact O-N 3.33Å; N476-A479 PolarHBondContact O-N 3.25Å; N476-K480 WeakPolarHBondContact O-CB 3.43Å; N476-K480 PolarHBondContact O-N 3.06Å
477	A	85.8	Confident	81.8	Confident	55 Å²	55	83.3 Å²	83.3	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-64.5	-43.6	174	0	0	0	0	0	111.7	L473 R474 K480 V481	L473-A477 VanDerWaalsContact O-CB 3.32Å; L473-A477 WeakPolarHBondContact O-CB 3.47Å; L473-A477 PolarHBondContact O-N 3.4Å; R474-A477 PolarHBondContact O-N 3.2Å; A477-K480 PolarHBondContact O-N 3.46Å; A477-V481 WeakPolarHBondContact O-CG2 3.43Å; A477-V481 PolarHBondContact O-N 3.12Å; A477-V481 VanDerWaalsContact O-N 3.09Å
478	A	84.6	Confident	81.4	Confident	51 Å²	51	86.3 Å²	86.3	42%	0.421	46%	0.461	S	S	.	.	H	α-helix	trans	-65	-39.6	176.4	0	0	0	0	0	112.4	R474 A475 K480 V481 H482	R474-A478 WeakPolarHBondContact O-CB 3.42Å; R474-A478 PolarHBondContact O-N 2.85Å; A475-A478 PolarHBondContact O-N 2.9Å; A478-K480 VanDerWaalsContact C-N 3.32Å; A478-K480 PolarHBondContact O-N 3.15Å; A478-V481 PolarHBondContact O-N 3.38Å; A478-H482 PolarHBondContact O-N 3.32Å; A478-H482 VanDerWaalsContact O-N 3.09Å
479	A	78.5	Confident	80.8	Confident	23 Å²	23	89.5 Å²	89.5	19%	0.19	47%	0.472	C	S	.	.	H	α-helix	trans	-62.6	-40.2	174.6	0	0	0	0	0	111.6	P446 A475 N476 V481 H482 E483	P446-A479 HydrophobicContact CG-CB 4.02Å; A475-A479 WeakPolarHBondContact O-CB 3.49Å; A475-A479 PolarHBondContact O-N 3.37Å; N476-A479 PolarHBondContact O-N 3.25Å; A479-V481 PolarHBondContact O-N 2.96Å; A479-H482 PolarHBondContact O-N 3.48Å; A479-E483 WeakPolarHBondContact O-CG 3.44Å; A479-E483 PolarHBondContact O-N 3.38Å
480	K	82.8	Confident	80.1	Confident	123 Å²	123	88.7 Å²	88.7	54%	0.535	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-40.3	176.2	-164.9	-174.4	177.6	-150.5	0	112.4	N476 A477 A478 H482 E483 E484	N476-K480 WeakPolarHBondContact O-CB 3.43Å; N476-K480 PolarHBondContact O-N 3.06Å; A477-K480 PolarHBondContact O-N 3.46Å; A478-K480 VanDerWaalsContact C-N 3.32Å; A478-K480 PolarHBondContact O-N 3.15Å; K480-H482 VanDerWaalsContact C-N 3.33Å; K480-H482 PolarHBondContact O-N 3.23Å; K480-E483 PolarHBondContact O-N 3.14Å; K480-E484 WeakPolarHBondContact CE-OE1 3.34Å; K480-E484 IonicContact NZ-OE1 2.65Å; K480-E484 PolarHBondContact NZ-OE1 3.02Å; K480-E484 WeakPolarHBondContact O-CG 3.41Å; K480-E484 PolarHBondContact O-N 2.9Å
481	V	85	Confident	79.1	Confident	72 Å²	72	93.6 Å²	93.6	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-61.6	-43.1	174.4	174.6	0	0	0	0	110.7	A477 A478 A479 E483 E484 E485	A477-V481 WeakPolarHBondContact O-CG2 3.43Å; A477-V481 PolarHBondContact O-N 3.12Å; A477-V481 VanDerWaalsContact O-N 3.09Å; A478-V481 PolarHBondContact O-N 3.38Å; A479-V481 PolarHBondContact O-N 2.96Å; V481-E483 VanDerWaalsContact C-N 3.32Å; V481-E483 PolarHBondContact O-N 3.01Å; V481-E484 PolarHBondContact O-N 2.97Å; V481-E485 HydrophobicContact CG1-CG 4.42Å; V481-E485 WeakPolarHBondContact O-CG 3.37Å; V481-E485 PolarHBondContact O-N 3.18Å
482	H	77.8	Confident	77.7	Confident	115 Å²	115	100.3 Å²	100.3	53%	0.532	52%	0.524	S	S	.	.	H	α-helix	trans	-66.8	-29.1	176	-90.5	-49.3	0	0	0	114.2	A478 A479 K480 E485 K486	A478-H482 PolarHBondContact O-N 3.32Å; A478-H482 VanDerWaalsContact O-N 3.09Å; A479-H482 PolarHBondContact O-N 3.48Å; K480-H482 VanDerWaalsContact C-N 3.33Å; K480-H482 PolarHBondContact O-N 3.23Å; H482-E485 IonicContact CE1-OE2 3.71Å; H482-E485 IonicContact ND1-OE2 3.74Å; H482-E485 PolarHBondContact ND1-OE2 3.18Å; H482-E485 VanDerWaalsContact ND1-OE2 3.12Å; H482-K486 WeakPolarHBondContact O-CG 3.46Å; H482-K486 PolarHBondContact O-N 3.24Å; H482-K486 VanDerWaalsContact O-N 3.16Å
483	E	77	Confident	77.6	Confident	104 Å²	104	103.8 Å²	103.8	49%	0.486	54%	0.54	S	S	.	.	H	α-helix	trans	-71.1	-40.6	172.4	-74.2	177.9	178.8	0	0	111.7	A479 K480 V481 K486 Q487	A479-E483 WeakPolarHBondContact O-CG 3.44Å; A479-E483 PolarHBondContact O-N 3.38Å; K480-E483 PolarHBondContact O-N 3.14Å; V481-E483 VanDerWaalsContact C-N 3.32Å; V481-E483 PolarHBondContact O-N 3.01Å; E483-K486 PolarHBondContact O-N 3.29Å; E483-Q487 WeakPolarHBondContact O-CG 3.46Å; E483-Q487 PolarHBondContact O-N 3.01Å; E483-Q487 VanDerWaalsContact O-N 3.09Å
484	E	79	Confident	77.2	Confident	90 Å²	90	102.8 Å²	102.8	42%	0.421	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-45.5	175.3	-70.6	172	-173	0	0	110.7	K480 V481 K486 Q487 D488	K480-E484 WeakPolarHBondContact CE-OE1 3.34Å; K480-E484 IonicContact NZ-OE1 2.65Å; K480-E484 PolarHBondContact NZ-OE1 3.02Å; K480-E484 WeakPolarHBondContact O-CG 3.41Å; K480-E484 PolarHBondContact O-N 2.9Å; V481-E484 PolarHBondContact O-N 2.97Å; E484-K486 PolarHBondContact O-N 3.29Å; E484-Q487 PolarHBondContact O-N 2.88Å; E484-Q487 VanDerWaalsContact O-N 3.12Å; E484-D488 PolarHBondContact O-N 3.37Å
485	E	77.9	Confident	76.7	Confident	94 Å²	94	99.1 Å²	99.1	44%	0.439	53%	0.529	S	S	.	.	H	α-helix	trans	-59.6	-41.3	175.4	-73.7	173.6	171.1	0	0	112.6	V481 H482 Q487 D488 E489	V481-E485 HydrophobicContact CG1-CG 4.42Å; V481-E485 WeakPolarHBondContact O-CG 3.37Å; V481-E485 PolarHBondContact O-N 3.18Å; H482-E485 IonicContact CE1-OE2 3.71Å; H482-E485 IonicContact ND1-OE2 3.74Å; H482-E485 PolarHBondContact ND1-OE2 3.18Å; H482-E485 VanDerWaalsContact ND1-OE2 3.12Å; E485-Q487 VanDerWaalsContact C-N 3.33Å; E485-Q487 PolarHBondContact O-N 3.35Å; E485-D488 PolarHBondContact O-N 3.26Å; E485-E489 WeakPolarHBondContact O-CG 3.47Å; E485-E489 PolarHBondContact O-N 3.44Å
486	K	75	Confident	76.4	Confident	144 Å²	144	102.2 Å²	102.2	63%	0.626	54%	0.537	S	S	*	.	H	α-helix	trans	-67.8	-32.2	176.2	-80	-179.9	-178.9	176.6	0	113	H482 E483 E484 S490	H482-K486 WeakPolarHBondContact O-CG 3.46Å; H482-K486 PolarHBondContact O-N 3.24Å; H482-K486 VanDerWaalsContact O-N 3.16Å; E483-K486 PolarHBondContact O-N 3.29Å; E484-K486 PolarHBondContact O-N 3.29Å; K486-S490 WeakPolarHBondContact O-CB 3.49Å; K486-S490 PolarHBondContact O-N 3.06Å; K486-S490 VanDerWaalsContact O-N 3.15Å; K486-S490 PolarHBondContact O-OG 3.23Å
487	Q	73.1	Confident	76	Confident	122 Å²	122	105.4 Å²	105.4	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-68.6	-40.4	174.6	-76	179.8	12.3	0	0	110.9	E483 E484 E485 S490 N491	E483-Q487 WeakPolarHBondContact O-CG 3.46Å; E483-Q487 PolarHBondContact O-N 3.01Å; E483-Q487 VanDerWaalsContact O-N 3.09Å; E484-Q487 PolarHBondContact O-N 2.88Å; E484-Q487 VanDerWaalsContact O-N 3.12Å; E485-Q487 VanDerWaalsContact C-N 3.33Å; E485-Q487 PolarHBondContact O-N 3.35Å; Q487-S490 PolarHBondContact O-N 3.4Å; Q487-S490 PolarHBondContact O-OG 3.41Å; Q487-N491 PolarHBondContact O-N 3.08Å; Q487-N491 VanDerWaalsContact O-N 3.14Å; Q487-N491 PolarHBondContact O-ND2 3.43Å
488	D	73.5	Confident	75.3	Confident	113 Å²	113	108.8 Å²	108.8	60%	0.604	56%	0.561	S	S	*	*	H	α-helix	trans	-67.7	-37.5	177.3	-69.2	-21.9	0	0	0	112.3	E484 E485 S490 N491	E484-D488 PolarHBondContact O-N 3.37Å; E485-D488 PolarHBondContact O-N 3.26Å; D488-S490 VanDerWaalsContact C-N 3.31Å; D488-S490 PolarHBondContact O-N 3.49Å; D488-N491 PolarHBondContact O-N 3.49Å
489	E	72.5	Confident	74.7	Confident	151 Å²	151	112.9 Å²	112.9	71%	0.706	57%	0.571	S	S	*	*	H	α-helix	trans	-68.4	-26.5	173.1	-74.1	-177.7	167.9	0	0	113.4	E485	E485-E489 WeakPolarHBondContact O-CG 3.47Å; E485-E489 PolarHBondContact O-N 3.44Å
490	S	70.7	Confident	74.4	Confident	89 Å²	89	119.8 Å²	119.8	62%	0.622	60%	0.6	S	S	*	*	H	α-helix	trans	-85.4	-18	177.7	71.8	0	0	0	0	114.1	K486 Q487 D488	K486-S490 WeakPolarHBondContact O-CB 3.49Å; K486-S490 PolarHBondContact O-N 3.06Å; K486-S490 VanDerWaalsContact O-N 3.15Å; K486-S490 PolarHBondContact O-OG 3.23Å; Q487-S490 PolarHBondContact O-N 3.4Å; Q487-S490 PolarHBondContact O-OG 3.41Å; D488-S490 VanDerWaalsContact C-N 3.31Å; D488-S490 PolarHBondContact O-N 3.49Å
491	N	67.2	Low	73.7	Confident	138 Å²	138	119.6 Å²	119.6	74%	0.738	61%	0.606	S	S	*	*			trans	-96.9	2.7	180	-77.2	-35.1	0	0	0	113.5	Q487 D488	Q487-N491 PolarHBondContact O-N 3.08Å; Q487-N491 VanDerWaalsContact O-N 3.14Å; Q487-N491 PolarHBondContact O-ND2 3.43Å; D488-N491 PolarHBondContact O-N 3.49Å
492	N	55.8	Low	72.7	Confident	203 Å²	203	123.9 Å²	123.9	100%	1.086	62%	0.621	S	S	*	*			trans	-121.4	0	178.1	-154	33.9	0	0	0	110

Retrieved 492 of 492 residues in 425.2 ms (Link to these results)

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