A0A087YCJ1_POEFO Loading...

Leucine rich repeat containing 17

AlphaFold DB , UniProt , Accession A0A087YCJ1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 442 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	39.6	Very low	34.6	Very low	223 Å²	223	148.8 Å²	148.8	100%	1.099	81%	0.807	S	S	*	*				0	79.1	0	-58.2	-70.6	-154.5	0	0	106.5
2	H	33.1	Very low	34.4	Very low	169 Å²	169	150.3 Å²	150.3	78%	0.782	81%	0.812	S	S	*	*				55.6	117.8	97.1	-69.9	-49.9	0	0	0	110.6
3	L	35.6	Very low	34.1	Very low	133 Å²	133	153.5 Å²	153.5	70%	0.696	83%	0.827	S	S	*	*			cis	-162.3	136.8	10.2	-119.3	110.8	0	0	0	103.2
4	L	35.1	Very low	33.8	Very low	140 Å²	140	147.1 Å²	147.1	73%	0.733	82%	0.815	S	S	*	*				38.3	126.4	94.9	-73	126.8	0	0	0	111.7
5	T	39.5	Very low	33.5	Very low	118 Å²	118	145.5 Å²	145.5	72%	0.724	82%	0.818	S	S	*	*			cis	164.4	142.7	35.6	17.8	0	0	0	0	104.3
6	A	36.6	Very low	33.3	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	82%	0.82	S	S	*	*				165.1	104.9	119.9	0	0	0	0	0	112.2
7	V	37.6	Very low	33.1	Very low	120 Å²	120	145.8 Å²	145.8	73%	0.727	83%	0.825	S	S	*	*			trans	79.7	71	136.2	-162.8	0	0	0	0	116.9	L9	V7-L9 HydrophobicContact CG1-CB 4.04Å
8	L	30	Very low	33.1	Very low	181 Å²	181	144.9 Å²	144.9	95%	0.948	83%	0.826	S	S	*	*			trans	-81.4	98.9	138.7	-149.7	94.1	0	0	0	107.7
9	L	31.4	Very low	32.8	Very low	133 Å²	133	150.7 Å²	150.7	70%	0.696	83%	0.833	S	S	*	*			trans	-161	100.2	170.9	-102.5	138.8	0	0	0	103.3	V7	V7-L9 HydrophobicContact CG1-CB 4.04Å
10	L	31.8	Very low	32.6	Very low	162 Å²	162	155.1 Å²	155.1	85%	0.848	84%	0.836	S	S	*	*				-163.1	98.9	67.7	-81.5	128.9	0	0	0	108.5
11	L	30.6	Very low	32.4	Very low	169 Å²	169	153.7 Å²	153.7	89%	0.885	83%	0.833	S	S	*	*			trans	-127.4	145	153.7	-78.9	167.8	0	0	0	105.5
12	L	31.8	Very low	32.4	Very low	167 Å²	167	149 Å²	149	87%	0.874	82%	0.819	S	S	*	*			trans	99.9	79.2	-179.8	-51.8	172.7	0	0	0	115.6
13	L	30.4	Very low	32.2	Very low	191 Å²	191	144.7 Å²	144.7	100%	1	82%	0.821	S	S	*	*			trans	-130.9	96.5	136.9	-78.6	174.3	0	0	0	108.2
14	G	30	Very low	31.9	Very low	64 Å²	64	144.5 Å²	144.5	66%	0.66	83%	0.83	S	S	*	*			trans	-112.6	130.9	167.3	0	0	0	0	0	109.8
15	S	30.2	Very low	31.6	Very low	124 Å²	124	147.2 Å²	147.2	87%	0.867	84%	0.836	S	S	*	*			trans	43.5	112.7	147.4	56.6	0	0	0	0	119.6
16	A	28.9	Very low	31.2	Very low	103 Å²	103	145.7 Å²	145.7	85%	0.851	84%	0.835	S	S	*	*			trans	-122.3	113.8	154.4	0	0	0	0	0	109.7
17	E	30.4	Very low	30.8	Very low	193 Å²	193	147.7 Å²	147.7	90%	0.902	84%	0.839	S	S	*	*			trans	-77.6	155.2	159.9	-73.6	170.2	133.8	0	0	110.2
18	P	32.7	Very low	30.5	Very low	129 Å²	129	150.6 Å²	150.6	84%	0.838	84%	0.844	S	S	*	*			trans	-116.2	141.4	155.1	25.8	-9.4	0	0	0	113.4
19	R	28.6	Very low	30.5	Very low	255 Å²	255	154 Å²	154	96%	0.962	85%	0.845	S	S	*	*			trans	-67.5	168.9	176.7	-75.3	173.9	170.2	168.8	-3.8	113.6
20	R	28.5	Very low	30.4	Very low	238 Å²	238	151.5 Å²	151.5	90%	0.898	85%	0.851	S	S	*	*			trans	-110.3	152.3	-167.9	-141.4	-176.3	-155.5	179.7	5.8	111.1
21	V	28.1	Very low	30.3	Very low	126 Å²	126	150.6 Å²	150.6	76%	0.764	85%	0.853	S	S	*	*			trans	87.6	152.8	154.2	-169.6	0	0	0	0	117.7
22	P	39.7	Very low	30.5	Very low	124 Å²	124	146.7 Å²	146.7	81%	0.805	85%	0.853	S	S	*	*			cis	-124	172	-7.8	18.5	5.3	0	0	0	116
23	G	28.6	Very low	30.4	Very low	80 Å²	80	142.4 Å²	142.4	83%	0.825	85%	0.85	S	S	*	*			trans	-91.7	-171.4	-172.3	0	0	0	0	0	118.6
24	S	29.4	Very low	30.8	Very low	128 Å²	128	145.4 Å²	145.4	90%	0.895	85%	0.847	S	S	*	*			trans	-156.7	151.2	160.6	-167.7	0	0	0	0	110.9
25	K	29	Very low	31	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	86%	0.857	S	S	*	*			trans	-84.4	149.9	-174.5	-62.6	169.2	174.4	175.8	0	111.7
26	A	30.9	Very low	31.4	Very low	85 Å²	85	155 Å²	155	70%	0.702	86%	0.86	S	S	*	*			trans	171.9	108.3	141.3	0	0	0	0	0	108.3
27	T	28.8	Very low	31.6	Very low	132 Å²	132	153.6 Å²	153.6	81%	0.81	86%	0.856	S	S	*	*				64.3	134.6	83.6	52.3	0	0	0	0	116.8
28	E	30.3	Very low	32.3	Very low	180 Å²	180	155 Å²	155	84%	0.841	86%	0.859	S	S	*	*			trans	95.8	105.2	164.8	-58	-167.4	143.7	0	0	117.2
29	R	29.8	Very low	32.3	Very low	252 Å²	252	152.3 Å²	152.3	95%	0.951	85%	0.854	S	S	*	*				62.6	111.5	79.8	-89.7	-173.2	173.1	174.2	-1.6	113
30	G	29.9	Very low	32.7	Very low	81 Å²	81	152.5 Å²	152.5	84%	0.835	86%	0.855	S	S	*	*			trans	179.4	114.6	168	0	0	0	0	0	112.2
31	T	30.2	Very low	33	Very low	144 Å²	144	145.7 Å²	145.7	88%	0.883	85%	0.849	S	S	*	*			trans	-75.8	147.4	-172.9	44.6	0	0	0	0	115.1
32	G	33.6	Very low	33.7	Very low	86 Å²	86	143.3 Å²	143.3	89%	0.887	85%	0.85	S	S	*	*			trans	84.9	121.1	138.5	0	0	0	0	0	118.5
33	G	30.6	Very low	33.6	Very low	78 Å²	78	143.4 Å²	143.4	80%	0.804	85%	0.848	S	S	*	*			trans	159.3	96.3	162	0	0	0	0	0	114.7	V35	G33-V35 PolarHBondContact O-N 3.46Å
34	R	38.1	Very low	34.3	Very low	253 Å²	253	148.5 Å²	148.5	96%	0.955	85%	0.853	S	S	*	*			trans	-60.2	125	166.1	-97.3	173.8	162.5	158.2	-4.9	110.4
35	V	35.1	Very low	34.7	Very low	142 Å²	142	152.1 Å²	152.1	86%	0.861	85%	0.847	S	S	*	*			trans	-146.3	130.6	144.9	-175.2	0	0	0	0	109.6	G33	G33-V35 PolarHBondContact O-N 3.46Å
36	R	39.5	Very low	35.3	Very low	248 Å²	248	154.3 Å²	154.3	94%	0.936	85%	0.85	S	S	*	*			trans	-54.5	129.2	170.1	-89	170	155.7	168.4	-6.7	111
37	G	33.1	Very low	35.8	Very low	73 Å²	73	158 Å²	158	75%	0.753	85%	0.853	S	S	*	*			trans	-149.1	108.5	166.5	0	0	0	0	0	110.6	G39	G37-G39 PolarHBondContact O-N 3.44Å
38	K	44.5	Very low	36.5	Very low	224 Å²	224	157.1 Å²	157.1	97%	0.974	85%	0.847	S	S	*	*			trans	-56.5	128.4	165.8	-84.1	175	170.1	176.4	0	108.7
39	G	31.6	Very low	37.9	Very low	71 Å²	71	156 Å²	156	73%	0.732	84%	0.842	S	S	*	*			trans	-174.1	87.3	171.7	0	0	0	0	0	110.5	G37 A41	G37-G39 PolarHBondContact O-N 3.44Å; G39-A41 PolarHBondContact O-N 3.45Å; G39-A41 VanDerWaalsContact O-N 3.11Å
40	R	38.3	Very low	40.4	Very low	260 Å²	260	151.9 Å²	151.9	98%	0.981	83%	0.833	S	S	*	*			trans	-65.4	103.5	166.3	-81	177.8	168.7	175.4	-4.3	107.6
41	A	33.7	Very low	43.3	Very low	95 Å²	95	149.8 Å²	149.8	79%	0.785	81%	0.806	S	S	*	*			trans	-90.3	123.5	163.4	0	0	0	0	0	108.2	G39 V43	G39-A41 PolarHBondContact O-N 3.45Å; G39-A41 VanDerWaalsContact O-N 3.11Å; A41-V43 PolarHBondContact O-N 3.17Å
42	G	43.6	Very low	46.4	Very low	76 Å²	76	149.5 Å²	149.5	78%	0.784	79%	0.792	S	S	*	*			trans	-59.8	122	-168	0	0	0	0	0	113.9	M44	G42-M44 PolarHBondContact O-N 2.78Å
43	V	37.1	Very low	49.3	Very low	125 Å²	125	150.4 Å²	150.4	76%	0.758	77%	0.773	S	S	*	*			trans	-80.5	101	141.4	-176.4	0	0	0	0	104.8	A41 R45	A41-V43 PolarHBondContact O-N 3.17Å; V43-R45 HydrophobicContact CG1-CG 3.97Å; V43-R45 PolarHBondContact O-N 3.11Å
44	M	43.5	Very low	52.4	Low	188 Å²	188	149.6 Å²	149.6	93%	0.926	75%	0.746	S	S	*	*			trans	-70.7	73.2	168.4	-153.7	132.1	110.7	0	0	107.3	G42 R46	G42-M44 PolarHBondContact O-N 2.78Å; M44-R46 PolarHBondContact O-N 3.36Å; M44-R46 VanDerWaalsContact O-N 3.17Å
45	R	37	Very low	55.2	Low	204 Å²	204	144.9 Å²	144.9	77%	0.77	74%	0.737	S	S	*	*			trans	-63.3	113	158.5	-87.4	-178.1	171.9	178.1	-3.5	104.3	V43 Q47	V43-R45 HydrophobicContact CG1-CG 3.97Å; V43-R45 PolarHBondContact O-N 3.11Å; R45-Q47 PolarHBondContact O-N 3.02Å
46	R	42	Very low	58	Low	243 Å²	243	143.2 Å²	143.2	92%	0.917	72%	0.72	S	S	*	*			trans	-57.5	88	152.6	-79.6	177.8	172.1	174.3	-2.9	105.4	M44 T48	M44-R46 PolarHBondContact O-N 3.36Å; M44-R46 VanDerWaalsContact O-N 3.17Å; R46-T48 VanDerWaalsContact C-N 3.31Å; R46-T48 PolarHBondContact O-N 2.76Å
47	Q	40.8	Very low	60.6	Low	164 Å²	164	136.2 Å²	136.2	77%	0.766	72%	0.715	S	S	*	*			trans	-64.8	103	165.7	-103.6	167.6	-32.3	0	0	104.4	R45 Q49	R45-Q47 PolarHBondContact O-N 3.02Å; Q47-Q49 VanDerWaalsContact C-N 3.34Å; Q47-Q49 PolarHBondContact O-N 3.02Å
48	T	43.8	Very low	63.5	Low	113 Å²	113	136 Å²	136	69%	0.693	71%	0.713	S	S	*	*			trans	-50.9	111.2	152.9	39.2	0	0	0	0	105.2	R46 E50	R46-T48 VanDerWaalsContact C-N 3.31Å; R46-T48 PolarHBondContact O-N 2.76Å; T48-E50 VanDerWaalsContact C-N 3.3Å; T48-E50 PolarHBondContact O-N 2.88Å
49	Q	61.2	Low	65.9	Low	155 Å²	155	127.8 Å²	127.8	72%	0.724	68%	0.678	S	S	*	*			trans	-64.9	98.8	177.7	-161	106.8	11.7	0	0	105.8	Q47 T67	Q47-Q49 VanDerWaalsContact C-N 3.34Å; Q47-Q49 PolarHBondContact O-N 3.02Å; Q49-T67 HydrophobicContact CB-CG2 4.32Å; Q49-T67 VanDerWaalsContact O-CG2 3.26Å; Q49-T67 WeakPolarHBondContact O-CG2 3.44Å
50	E	81	Confident	69.1	Low	166 Å²	166	125.8 Å²	125.8	78%	0.776	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-69.1	149.4	175.1	-72.4	179	167.5	0	0	109	T48	T48-E50 VanDerWaalsContact C-N 3.3Å; T48-E50 PolarHBondContact O-N 2.88Å
51	C	91.6	Very high	71.9	Confident	38 Å²	38	115.2 Å²	115.2	26%	0.257	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-58.6	139.7	176.4	-61.8	0	0	0	0	110.7	L62 D63 C64	C51-L62 HydrophobicContact CB-CD1 3.69Å; C51-L62 HydrophobicContact CB-CG 4.27Å; C51-D63 CarbonylContact C-O 3.22Å; C51-D63 VanDerWaalsContact CA-O 3.28Å; C51-D63 WeakPolarHBondContact CA-O 3.04Å; C51-C64 HydrophobicContact CB-CB 4.07Å; C51-C64 WeakPolarHBondContact CB-SG 3.27Å; C51-C64 WeakPolarHBondContact SG-CB 3.11Å; C51-C64 CovalentContact SG-SG 2.03Å; C51-C64 PolarHBondContact SG-SG 2.72Å
52	K	94.2	Very high	74.9	Confident	137 Å²	137	111 Å²	111	60%	0.596	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.1	121.3	-178.3	-174	-175.6	175.8	-167.9	0	110.7	D63	K52-D63 PolarHBondContact N-O 3.08Å; K52-D63 PolarHBondContact O-N 3.03Å
53	E	95.4	Very high	77.5	Confident	105 Å²	105	109.5 Å²	109.5	49%	0.491	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	135.4	170.4	-171.6	-179.7	138.7	0	0	110.5	K60 Y61	E53-K60 WeakPolarHBondContact OE1-CE 3.04Å; E53-K60 IonicContact OE1-NZ 2.87Å; E53-K60 PolarHBondContact OE1-NZ 3.12Å; E53-K60 IonicContact OE2-NZ 3.74Å; E53-Y61 WeakPolarHBondContact CA-O 3.26Å
54	Y	96	Very high	80.3	Confident	62 Å²	62	103.5 Å²	103.5	24%	0.243	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	169.6	172.6	65.5	-88.9	0	0	0	112.2	E56 Y61 D63	Y54-E56 HydrophobicContact CD2-CB 4.31Å; Y54-E56 HydrophobicContact CE2-CB 4.06Å; Y54-Y61 HydrophobicContact CD2-CD2 4.4Å; Y54-Y61 HydrophobicContact CD2-CG 4.35Å; Y54-Y61 HydrophobicContact CE2-CD1 4.22Å; Y54-Y61 AromaticContact CE2-CD2 3.95Å; Y54-Y61 HydrophobicContact CE2-CD2 3.95Å; Y54-Y61 AromaticContact CE2-CG 3.67Å; Y54-Y61 HydrophobicContact CE2-CG 3.67Å; Y54-Y61 VanDerWaalsContact CZ-CB 3.48Å; Y54-Y61 AromaticContact CZ-CG 3.76Å; Y54-Y61 PolarHBondContact N-O 2.03Å; Y54-Y61 PolarHBondContact O-N 3.16Å; Y54-D63 HydrophobicContact CE1-CB 3.83Å
55	M	96.7	Very high	82.7	Confident	154 Å²	154	96.6 Å²	96.6	76%	0.759	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.7	173.8	-67.1	-171.2	-68.3	0	0	110.7	E59	M55-E59 VanDerWaalsContact CA-O 3.3Å; M55-E59 WeakPolarHBondContact CA-O 3.16Å
56	E	93.8	Very high	85.4	Confident	106 Å²	106	91 Å²	91	50%	0.495	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	128.6	175	-176.4	169.6	-169.1	0	0	108.7	Y54 G58 E59 Y61	Y54-E56 HydrophobicContact CD2-CB 4.31Å; Y54-E56 HydrophobicContact CE2-CB 4.06Å; E56-G58 PolarHBondContact O-N 2.88Å; E56-G58 VanDerWaalsContact O-N 3.09Å; E56-E59 PolarHBondContact N-O 3.28Å; E56-E59 PolarHBondContact O-N 2.96Å; E56-Y61 HydrophobicContact CB-CD2 4.02Å; E56-Y61 HydrophobicContact CB-CE2 3.7Å
57	A	93.5	Very high	87.7	Confident	101 Å²	101	80.9 Å²	80.9	84%	0.835	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	30.3	-175.7	0	0	0	0	0	115.2	E59	A57-E59 VanDerWaalsContact C-N 3.29Å
58	G	94	Very high	90.2	Very high	69 Å²	69	78.2 Å²	78.2	71%	0.711	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	5	-178	0	0	0	0	0	114.6	E56	E56-G58 PolarHBondContact O-N 2.88Å; E56-G58 VanDerWaalsContact O-N 3.09Å
59	E	96.2	Very high	92.5	Very high	51 Å²	51	74.2 Å²	74.2	24%	0.238	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.2	177	-55.2	-170.2	128.4	0	0	110.5	M55 E56 A57 Y61 Q81 H82 K105	M55-E59 VanDerWaalsContact CA-O 3.3Å; M55-E59 WeakPolarHBondContact CA-O 3.16Å; E56-E59 PolarHBondContact N-O 3.28Å; E56-E59 PolarHBondContact O-N 2.96Å; A57-E59 VanDerWaalsContact C-N 3.29Å; E59-Y61 HydrophobicContact CB-CE2 3.99Å; E59-Y61 WeakPolarHBondContact O-CD2 3.49Å; E59-Q81 PolarHBondContact OE1-OE1 2.98Å; E59-H82 VanDerWaalsContact CD-NE2 3.33Å; E59-H82 IonicContact OE1-NE2 2.94Å; E59-H82 IonicContact OE2-CD2 3.39Å; E59-H82 IonicContact OE2-CE1 2.82Å; E59-H82 PolarHBondContact OE2-CE1 2.73Å; E59-H82 IonicContact OE2-NE2 2.73Å; E59-H82 PolarHBondContact OE2-NE2 2.94Å; E59-K105 IonicContact OE1-NZ 3.26Å; E59-K105 PolarHBondContact OE1-NZ 3.1Å
60	K	97.4	Very high	93.7	Very high	30 Å²	30	70.5 Å²	70.5	13%	0.13	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.6	-173.8	-168.8	178.7	-173.4	175.6	0	111.2	E53 D79 I80 Q81 H82	E53-K60 WeakPolarHBondContact OE1-CE 3.04Å; E53-K60 IonicContact OE1-NZ 2.87Å; E53-K60 PolarHBondContact OE1-NZ 3.12Å; E53-K60 IonicContact OE2-NZ 3.74Å; K60-D79 WeakPolarHBondContact CD-OD2 3.38Å; K60-D79 IonicContact NZ-OD1 2.73Å; K60-D79 PolarHBondContact NZ-OD1 2.8Å; K60-D79 IonicContact NZ-OD2 3.55Å; K60-D79 PolarHBondContact NZ-OD2 2.84Å; K60-I80 HydrophobicContact CD-CG2 4.18Å; K60-I80 HydrophobicContact CG-CG2 4.29Å; K60-Q81 PolarHBondContact O-N 3.05Å; K60-H82 PolarHBondContact O-N 2.7Å
61	Y	97.9	Very high	94.1	Very high	37 Å²	37	68.3 Å²	68.3	15%	0.145	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.8	-178	-70.3	-106.3	0	0	0	110.9	E53 Y54 E56 E59 H82 L84	E53-Y61 WeakPolarHBondContact CA-O 3.26Å; Y54-Y61 HydrophobicContact CD2-CD2 4.4Å; Y54-Y61 HydrophobicContact CD2-CG 4.35Å; Y54-Y61 HydrophobicContact CE2-CD1 4.22Å; Y54-Y61 AromaticContact CE2-CD2 3.95Å; Y54-Y61 HydrophobicContact CE2-CD2 3.95Å; Y54-Y61 AromaticContact CE2-CG 3.67Å; Y54-Y61 HydrophobicContact CE2-CG 3.67Å; Y54-Y61 VanDerWaalsContact CZ-CB 3.48Å; Y54-Y61 AromaticContact CZ-CG 3.76Å; Y54-Y61 PolarHBondContact N-O 2.03Å; Y54-Y61 PolarHBondContact O-N 3.16Å; E56-Y61 HydrophobicContact CB-CD2 4.02Å; E56-Y61 HydrophobicContact CB-CE2 3.7Å; E59-Y61 HydrophobicContact CB-CE2 3.99Å; E59-Y61 WeakPolarHBondContact O-CD2 3.49Å; Y61-H82 WeakPolarHBondContact CA-O 3.28Å; Y61-H82 HydrophobicContact CD1-CB 3.29Å; Y61-H82 AromaticContact CD1-CG 3.87Å; Y61-H82 HydrophobicContact CD2-CB 4.37Å; Y61-H82 AromaticContact CD2-CD2 3.93Å; Y61-H82 HydrophobicContact CE1-CB 3.37Å; Y61-H82 AromaticContact CE1-CD2 3.61Å; Y61-H82 AromaticContact CE1-CG 3.43Å; Y61-H82 VanDerWaalsContact CE1-CG 3.43Å; Y61-H82 HydrophobicContact CE2-CB 4.43Å; Y61-H82 AromaticContact CE2-CD2 3.39Å; Y61-H82 WeakPolarHBondContact CE2-CD2 3.4Å; Y61-H82 HydrophobicContact CG-CB 3.82Å; Y61-H82 AromaticContact CZ-CD2 3.2Å; Y61-H82 AromaticContact CZ-CG 3.54Å; Y61-H82 AromaticContact CZ-NE2 3.69Å; Y61-H82 PolarHBondContact OH-CD2 3.48Å; Y61-H82 PolarHBondContact OH-NE2 3.09Å; Y61-L84 HydrophobicContact CD1-CD1 4.41Å
62	L	97.4	Very high	94.1	Very high	6 Å²	6	67.2 Å²	67.2	3%	0.031	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	108.5	164.7	-177.5	63.3	0	0	0	108.9	C51 W76 P77 I80 H82 L83 L84	C51-L62 HydrophobicContact CB-CD1 3.69Å; C51-L62 HydrophobicContact CB-CG 4.27Å; L62-W76 HydrophobicContact CD2-CB 4.07Å; L62-W76 HydrophobicContact CD2-CD2 3.8Å; L62-W76 HydrophobicContact CD2-CE3 3.83Å; L62-W76 HydrophobicContact CD2-CG 3.91Å; L62-P77 HydrophobicContact CD2-CG 4.37Å; L62-I80 HydrophobicContact CB-CD1 4.03Å; L62-I80 HydrophobicContact CB-CG2 4.04Å; L62-I80 HydrophobicContact CD2-CD1 4.07Å; L62-H82 PolarHBondContact N-O 2.74Å; L62-L83 HydrophobicContact CB-CD1 4.1Å; L62-L83 HydrophobicContact CD2-CD1 3.92Å; L62-L83 HydrophobicContact CG-CD1 4.16Å; L62-L84 PolarHBondContact O-N 3.15Å
63	D	96.6	Very high	93.8	Very high	45 Å²	45	66.1 Å²	66.1	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.3	-179	-174.8	9.9	0	0	0	111.5	C51 K52 Y54 Q65 L84	C51-D63 CarbonylContact C-O 3.22Å; C51-D63 VanDerWaalsContact CA-O 3.28Å; C51-D63 WeakPolarHBondContact CA-O 3.04Å; K52-D63 PolarHBondContact N-O 3.08Å; K52-D63 PolarHBondContact O-N 3.03Å; Y54-D63 HydrophobicContact CE1-CB 3.83Å; D63-Q65 WeakPolarHBondContact OD1-CB 3.24Å; D63-Q65 WeakPolarHBondContact OD1-CG 3.49Å; D63-Q65 PolarHBondContact OD1-N 3.13Å; D63-Q65 VanDerWaalsContact OD1-N 3.12Å; D63-Q65 PolarHBondContact OD1-NE2 3.38Å; D63-L84 HydrophobicContact CB-CD1 4.13Å
64	C	95.8	Very high	93.3	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	37%	0.365	C	S	.	.			trans	-116.5	23.8	179.6	-65.7	0	0	0	0	111.4	C51 T67 L69 L84 L85 N88	C51-C64 HydrophobicContact CB-CB 4.07Å; C51-C64 WeakPolarHBondContact CB-SG 3.27Å; C51-C64 WeakPolarHBondContact SG-CB 3.11Å; C51-C64 CovalentContact SG-SG 2.03Å; C51-C64 PolarHBondContact SG-SG 2.72Å; C64-T67 WeakPolarHBondContact O-CG2 3.39Å; C64-T67 PolarHBondContact O-OG1 3.25Å; C64-L69 HydrophobicContact CB-CD1 3.78Å; C64-L84 CarbonylContact C-O 3.42Å; C64-L84 WeakPolarHBondContact CA-O 3.36Å; C64-L84 WeakPolarHBondContact CB-O 3.39Å; C64-L84 PolarHBondContact N-O 3.08Å; C64-L85 HydrophobicContact CB-CD2 3.65Å; C64-N88 PolarHBondContact O-ND2 3.25Å
65	Q	94.4	Very high	92.9	Very high	42 Å²	42	71.4 Å²	71.4	20%	0.196	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	147.7	-177.9	-67.9	174.7	78.6	0	0	112.7	D63 T67 L84 A86	D63-Q65 WeakPolarHBondContact OD1-CB 3.24Å; D63-Q65 WeakPolarHBondContact OD1-CG 3.49Å; D63-Q65 PolarHBondContact OD1-N 3.13Å; D63-Q65 VanDerWaalsContact OD1-N 3.12Å; D63-Q65 PolarHBondContact OD1-NE2 3.38Å; Q65-T67 WeakPolarHBondContact O-CG2 3.04Å; Q65-T67 PolarHBondContact O-N 3.08Å; Q65-T67 VanDerWaalsContact O-N 3.16Å; Q65-L84 HydrophobicContact CG-CB 3.99Å; Q65-L84 PolarHBondContact N-O 3.32Å; Q65-A86 VanDerWaalsContact CA-O 3.29Å; Q65-A86 WeakPolarHBondContact CA-O 3.48Å; Q65-A86 HydrophobicContact CG-CB 3.93Å
66	D	93.8	Very high	92.7	Very high	88 Å²	88	65.1 Å²	65.1	47%	0.471	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	21.4	176.6	-59.4	-64.1	0	0	0	115.3	A86 R87	D66-A86 PolarHBondContact N-O 2.79Å; D66-R87 WeakPolarHBondContact CA-O 3.49Å; D66-R87 WeakPolarHBondContact OD1-CB 3.04Å; D66-R87 VanDerWaalsContact OD1-CD 3.24Å; D66-R87 WeakPolarHBondContact OD1-CD 3.22Å; D66-R87 IonicContact OD1-CZ 3.33Å; D66-R87 IonicContact OD1-NE 3.39Å; D66-R87 PolarHBondContact OD1-NE 3.25Å; D66-R87 IonicContact OD2-CZ 3.09Å; D66-R87 IonicContact OD2-NE 3.9Å; D66-R87 PolarHBondContact OD2-NE 3.2Å; D66-R87 IonicContact OD2-NH2 3.9Å; D66-R87 PolarHBondContact OD2-NH2 2.87Å
67	T	91.1	Very high	92.7	Very high	30 Å²	30	61.7 Å²	61.7	18%	0.184	34%	0.335	C	S	.	.	S	Bend	trans	-94.4	6.4	-174.8	56.5	0	0	0	0	114.1	Q49 C64 Q65 L69 N88	Q49-T67 HydrophobicContact CB-CG2 4.32Å; Q49-T67 VanDerWaalsContact O-CG2 3.26Å; Q49-T67 WeakPolarHBondContact O-CG2 3.44Å; C64-T67 WeakPolarHBondContact O-CG2 3.39Å; C64-T67 PolarHBondContact O-OG1 3.25Å; Q65-T67 WeakPolarHBondContact O-CG2 3.04Å; Q65-T67 PolarHBondContact O-N 3.08Å; Q65-T67 VanDerWaalsContact O-N 3.16Å; T67-L69 PolarHBondContact O-N 2.87Å; T67-L69 WeakPolarHBondContact OG1-CD1 3.39Å; T67-L69 WeakPolarHBondContact OG1-CG 3.29Å; T67-N88 PolarHBondContact N-OD1 3.45Å; T67-N88 VanDerWaalsContact N-OD1 3.12Å; T67-N88 PolarHBondContact OG1-OD1 3.35Å; T67-N88 VanDerWaalsContact OG1-OD1 3.1Å
68	Q	92.1	Very high	92.7	Very high	107 Å²	107	63 Å²	63	50%	0.5	32%	0.322	S	S	.	.			trans	61.6	23.5	-179.7	-53.3	-69.7	-60.6	0	0	113.8	N88 K89	Q68-N88 PolarHBondContact N-OD1 2.93Å; Q68-K89 HydrophobicContact CB-CD 4.49Å
69	L	91.4	Very high	92.8	Very high	30 Å²	30	63.1 Å²	63.1	16%	0.157	31%	0.306	C	S	.	.			trans	-65	142.9	-177.6	-71.4	167.1	0	0	0	112	C64 T67 W76 L85 N88 K89 I90	C64-L69 HydrophobicContact CB-CD1 3.78Å; T67-L69 PolarHBondContact O-N 2.87Å; T67-L69 WeakPolarHBondContact OG1-CD1 3.39Å; T67-L69 WeakPolarHBondContact OG1-CG 3.29Å; L69-W76 HydrophobicContact CD1-CH2 3.9Å; L69-W76 HydrophobicContact CD1-CZ2 4.01Å; L69-L85 HydrophobicContact CD1-CD2 3.94Å; L69-N88 HydrophobicContact CB-CB 4.22Å; L69-N88 PolarHBondContact N-OD1 3.39Å; L69-K89 CarbonylContact O-C 3.52Å; L69-K89 VanDerWaalsContact O-C 3.22Å; L69-K89 VanDerWaalsContact O-CA 3.27Å; L69-K89 WeakPolarHBondContact O-CA 3.38Å; L69-K89 PolarHBondContact O-N 2.81Å; L69-I90 PolarHBondContact O-N 3.45Å
70	T	87.9	Confident	92.8	Very high	77 Å²	77	60.7 Å²	60.7	47%	0.472	30%	0.295	S	S	.	.	S	Bend	trans	-112.5	-14.2	173.7	53.1	0	0	0	0	112.8	K89	T70-K89 HydrophobicContact CG2-CB 3.98Å
71	F	89	Confident	92.8	Very high	119 Å²	119	60.9 Å²	60.9	52%	0.522	30%	0.296	S	S	.	.	S	Bend	trans	-151.2	163.4	179.7	67.9	-82.6	0	0	0	111.3	R73	F71-R73 HydrophobicContact CD2-CG 4.44Å; F71-R73 HydrophobicContact CE2-CG 3.85Å; F71-R73 HydrophobicContact CZ-CG 4.44Å
72	V	90.5	Very high	92.8	Very high	16 Å²	16	59.9 Å²	59.9	10%	0.097	29%	0.293	C	S	.	.			trans	-90.3	134.7	175	173.2	0	0	0	0	109.5	W76 L85 M97 F98 F101	V72-W76 HydrophobicContact CB-CZ3 4.22Å; V72-W76 HydrophobicContact CG1-CE3 3.88Å; V72-W76 HydrophobicContact CG1-CH2 4.47Å; V72-W76 HydrophobicContact CG1-CZ3 3.69Å; V72-W76 HydrophobicContact CG2-CZ3 4.28Å; V72-L85 HydrophobicContact CG2-CD1 4.01Å; V72-M97 HydrophobicContact CB-CG 3.91Å; V72-M97 HydrophobicContact CB-SD 4.42Å; V72-M97 HydrophobicContact CG2-CG 3.88Å; V72-M97 HydrophobicContact CG2-SD 3.95Å; V72-F98 HydrophobicContact CG2-CD1 4.22Å; V72-F98 HydrophobicContact CG2-CE1 3.56Å; V72-F98 HydrophobicContact CG2-CZ 4.09Å; V72-F101 HydrophobicContact CG1-CE2 3.73Å; V72-F101 HydrophobicContact CG1-CZ 4.14Å
73	R	87.9	Confident	92.8	Very high	114 Å²	114	59.6 Å²	59.6	43%	0.43	29%	0.291	S	S	.	.			trans	-92.6	143.7	-177	-53.1	172.5	51.4	144.4	-2.7	112.2	F71 D75 W76 Q100	F71-R73 HydrophobicContact CD2-CG 4.44Å; F71-R73 HydrophobicContact CE2-CG 3.85Å; F71-R73 HydrophobicContact CZ-CG 4.44Å; R73-D75 VanDerWaalsContact C-N 3.31Å; R73-D75 WeakPolarHBondContact CB-OD1 2.95Å; R73-D75 IonicContact CZ-OD1 3.63Å; R73-D75 IonicContact CZ-OD2 3.51Å; R73-D75 IonicContact NE-OD1 2.88Å; R73-D75 PolarHBondContact NE-OD1 3.12Å; R73-D75 IonicContact NE-OD2 3.55Å; R73-D75 IonicContact NH2-OD1 3.51Å; R73-D75 IonicContact NH2-OD2 2.72Å; R73-D75 PolarHBondContact NH2-OD2 3.49Å; R73-D75 PolarHBondContact O-N 2.72Å; R73-W76 HydrophobicContact CB-CD2 4.28Å; R73-W76 HydrophobicContact CB-CG 4.31Å; R73-W76 HydrophobicContact CB-CZ2 4.3Å; R73-W76 HydrophobicContact CG-CZ2 4.07Å; R73-Q100 PolarHBondContact O-NE2 3.29Å; R73-Q100 VanDerWaalsContact O-NE2 3.09Å
74	Q	84.8	Confident	92.9	Very high	171 Å²	171	58.7 Å²	58.7	80%	0.799	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-15.6	179.9	-67.5	-177.2	-11.1	0	0	113.8	W76 Q100	Q74-W76 VanDerWaalsContact C-N 3.29Å; Q74-Q100 PolarHBondContact O-OE1 2.85Å
75	D	88	Confident	93	Very high	106 Å²	106	58.7 Å²	58.7	57%	0.567	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	3.7	179.4	62.8	-34	0	0	0	113.5	R73	R73-D75 VanDerWaalsContact C-N 3.31Å; R73-D75 WeakPolarHBondContact CB-OD1 2.95Å; R73-D75 IonicContact CZ-OD1 3.63Å; R73-D75 IonicContact CZ-OD2 3.51Å; R73-D75 IonicContact NE-OD1 2.88Å; R73-D75 PolarHBondContact NE-OD1 3.12Å; R73-D75 IonicContact NE-OD2 3.55Å; R73-D75 IonicContact NH2-OD1 3.51Å; R73-D75 IonicContact NH2-OD2 2.72Å; R73-D75 PolarHBondContact NH2-OD2 3.49Å; R73-D75 PolarHBondContact O-N 2.72Å
76	W	93.3	Very high	93.1	Very high	22 Å²	22	56.7 Å²	56.7	8%	0.083	28%	0.277	C	S	.	.	S	Bend	trans	-71.8	150.7	177.2	-71.7	-4.4	0	0	0	112.8	L62 L69 V72 R73 Q74 K78 L83 L85 F101	L62-W76 HydrophobicContact CD2-CB 4.07Å; L62-W76 HydrophobicContact CD2-CD2 3.8Å; L62-W76 HydrophobicContact CD2-CE3 3.83Å; L62-W76 HydrophobicContact CD2-CG 3.91Å; L69-W76 HydrophobicContact CD1-CH2 3.9Å; L69-W76 HydrophobicContact CD1-CZ2 4.01Å; V72-W76 HydrophobicContact CB-CZ3 4.22Å; V72-W76 HydrophobicContact CG1-CE3 3.88Å; V72-W76 HydrophobicContact CG1-CH2 4.47Å; V72-W76 HydrophobicContact CG1-CZ3 3.69Å; V72-W76 HydrophobicContact CG2-CZ3 4.28Å; R73-W76 HydrophobicContact CB-CD2 4.28Å; R73-W76 HydrophobicContact CB-CG 4.31Å; R73-W76 HydrophobicContact CB-CZ2 4.3Å; R73-W76 HydrophobicContact CG-CZ2 4.07Å; Q74-W76 VanDerWaalsContact C-N 3.29Å; W76-K78 PolarHBondContact O-N 2.92Å; W76-L83 HydrophobicContact CE3-CD1 4.21Å; W76-L83 HydrophobicContact CZ3-CD1 4.02Å; W76-L83 HydrophobicContact CZ3-CD2 4.41Å; W76-L85 HydrophobicContact CH2-CD2 3.68Å; W76-L85 HydrophobicContact CZ3-CD1 4.49Å; W76-L85 HydrophobicContact CZ3-CD2 3.9Å; W76-F101 HydrophobicContact CB-CE1 3.99Å; W76-F101 HydrophobicContact CB-CZ 3.94Å; W76-F101 AromaticContact CE3-CZ 3.86Å; W76-F101 HydrophobicContact CE3-CZ 3.86Å
77	P	93.3	Very high	93.2	Very high	34 Å²	34	56.5 Å²	56.5	22%	0.221	27%	0.27	C	S	.	.			trans	-59.8	130.9	179.1	22.8	-33	0	0	0	111.5	L62 I80 F101	L62-P77 HydrophobicContact CD2-CG 4.37Å; P77-I80 HydrophobicContact CB-CG2 4.06Å; P77-I80 HydrophobicContact CG-CG2 3.7Å; P77-I80 WeakPolarHBondContact O-CG2 3.43Å; P77-F101 WeakPolarHBondContact O-CE1 3.27Å
78	K	93.8	Very high	93.3	Very high	130 Å²	130	55.5 Å²	55.5	57%	0.565	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-17.1	-174.2	-59.4	-176	-178.7	-175.5	0	114	W76 I80 Q100	W76-K78 PolarHBondContact O-N 2.92Å; K78-I80 VanDerWaalsContact C-N 3.28Å; K78-I80 PolarHBondContact O-N 3.4Å; K78-Q100 HydrophobicContact CD-CB 4.46Å; K78-Q100 HydrophobicContact CG-CB 4.41Å
79	D	95.2	Very high	93.3	Very high	71 Å²	71	55.3 Å²	55.3	38%	0.38	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	12.2	-177.6	65.6	-35.8	0	0	0	113.3	K60	K60-D79 WeakPolarHBondContact CD-OD2 3.38Å; K60-D79 IonicContact NZ-OD1 2.73Å; K60-D79 PolarHBondContact NZ-OD1 2.8Å; K60-D79 IonicContact NZ-OD2 3.55Å; K60-D79 PolarHBondContact NZ-OD2 2.84Å
80	I	96.6	Very high	93.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.253	C	S	.	.			trans	-72.7	143.4	177.4	63.5	173.7	0	0	0	111.1	K60 L62 P77 K78 L83 F101 L104	K60-I80 HydrophobicContact CD-CG2 4.18Å; K60-I80 HydrophobicContact CG-CG2 4.29Å; L62-I80 HydrophobicContact CB-CD1 4.03Å; L62-I80 HydrophobicContact CB-CG2 4.04Å; L62-I80 HydrophobicContact CD2-CD1 4.07Å; P77-I80 HydrophobicContact CB-CG2 4.06Å; P77-I80 HydrophobicContact CG-CG2 3.7Å; P77-I80 WeakPolarHBondContact O-CG2 3.43Å; K78-I80 VanDerWaalsContact C-N 3.28Å; K78-I80 PolarHBondContact O-N 3.4Å; I80-L83 HydrophobicContact CD1-CB 4.06Å; I80-L83 HydrophobicContact CD1-CD1 4.02Å; I80-L83 HydrophobicContact CD1-CD2 4.35Å; I80-L83 HydrophobicContact CD1-CG 4.37Å; I80-F101 HydrophobicContact CD1-CD1 3.5Å; I80-F101 VanDerWaalsContact CD1-CD1 3.5Å; I80-F101 HydrophobicContact CD1-CE1 3.56Å; I80-F101 HydrophobicContact CD1-CG 4.2Å; I80-F101 HydrophobicContact CD1-CZ 4.31Å; I80-F101 HydrophobicContact CG1-CD1 3.58Å; I80-F101 HydrophobicContact CG1-CE1 4.07Å; I80-F101 HydrophobicContact CG1-CG 4.34Å; I80-L104 HydrophobicContact CD1-CD1 4.26Å; I80-L104 HydrophobicContact CG1-CD1 4.09Å
81	Q	98.1	Very high	93.5	Very high	33 Å²	33	55.7 Å²	55.7	15%	0.154	26%	0.256	C	S	.	.	S	Bend	trans	-106.1	-23.9	177.4	-64.5	179	28.9	0	0	111.6	E59 K60 K105 S106	E59-Q81 PolarHBondContact OE1-OE1 2.98Å; K60-Q81 PolarHBondContact O-N 3.05Å; Q81-K105 HydrophobicContact CB-CD 4.41Å; Q81-K105 HydrophobicContact CB-CG 4.46Å; Q81-K105 PolarHBondContact O-N 2.93Å; Q81-S106 PolarHBondContact O-N 3.37Å; Q81-S106 VanDerWaalsContact O-N 3.11Å
82	H	98.2	Very high	93.4	Very high	17 Å²	17	53.1 Å²	53.1	8%	0.079	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	122.9	-179.4	-58.5	-80.4	0	0	0	110.6	E59 K60 Y61 L62 S106	E59-H82 VanDerWaalsContact CD-NE2 3.33Å; E59-H82 IonicContact OE1-NE2 2.94Å; E59-H82 IonicContact OE2-CD2 3.39Å; E59-H82 IonicContact OE2-CE1 2.82Å; E59-H82 PolarHBondContact OE2-CE1 2.73Å; E59-H82 IonicContact OE2-NE2 2.73Å; E59-H82 PolarHBondContact OE2-NE2 2.94Å; K60-H82 PolarHBondContact O-N 2.7Å; Y61-H82 WeakPolarHBondContact CA-O 3.28Å; Y61-H82 HydrophobicContact CD1-CB 3.29Å; Y61-H82 AromaticContact CD1-CG 3.87Å; Y61-H82 HydrophobicContact CD2-CB 4.37Å; Y61-H82 AromaticContact CD2-CD2 3.93Å; Y61-H82 HydrophobicContact CE1-CB 3.37Å; Y61-H82 AromaticContact CE1-CD2 3.61Å; Y61-H82 AromaticContact CE1-CG 3.43Å; Y61-H82 VanDerWaalsContact CE1-CG 3.43Å; Y61-H82 HydrophobicContact CE2-CB 4.43Å; Y61-H82 AromaticContact CE2-CD2 3.39Å; Y61-H82 WeakPolarHBondContact CE2-CD2 3.4Å; Y61-H82 HydrophobicContact CG-CB 3.82Å; Y61-H82 AromaticContact CZ-CD2 3.2Å; Y61-H82 AromaticContact CZ-CG 3.54Å; Y61-H82 AromaticContact CZ-NE2 3.69Å; Y61-H82 PolarHBondContact OH-CD2 3.48Å; Y61-H82 PolarHBondContact OH-NE2 3.09Å; L62-H82 PolarHBondContact N-O 2.74Å; H82-S106 WeakPolarHBondContact CA-O 3.33Å; H82-S106 WeakPolarHBondContact ND1-CB 3.42Å
83	L	98.1	Very high	93.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	112.7	-178.5	179.3	55.2	0	0	0	109.7	L62 W76 I80 L85 F98 F101 L104 S106 L107 D108	L62-L83 HydrophobicContact CB-CD1 4.1Å; L62-L83 HydrophobicContact CD2-CD1 3.92Å; L62-L83 HydrophobicContact CG-CD1 4.16Å; W76-L83 HydrophobicContact CE3-CD1 4.21Å; W76-L83 HydrophobicContact CZ3-CD1 4.02Å; W76-L83 HydrophobicContact CZ3-CD2 4.41Å; I80-L83 HydrophobicContact CD1-CB 4.06Å; I80-L83 HydrophobicContact CD1-CD1 4.02Å; I80-L83 HydrophobicContact CD1-CD2 4.35Å; I80-L83 HydrophobicContact CD1-CG 4.37Å; L83-L85 HydrophobicContact CD1-CD1 4.3Å; L83-L85 HydrophobicContact CD1-CD2 4.4Å; L83-L85 HydrophobicContact CD1-CG 4.08Å; L83-L85 HydrophobicContact CD2-CD1 3.79Å; L83-L85 HydrophobicContact CD2-CG 4.44Å; L83-L85 HydrophobicContact CG-CD1 3.8Å; L83-L85 HydrophobicContact CG-CG 3.93Å; L83-F98 HydrophobicContact CD2-CD1 4.18Å; L83-F98 HydrophobicContact CD2-CE1 4.29Å; L83-F101 HydrophobicContact CD2-CD2 4.24Å; L83-F101 HydrophobicContact CD2-CE2 4.02Å; L83-F101 HydrophobicContact CD2-CZ 4.42Å; L83-L104 HydrophobicContact CB-CD1 3.68Å; L83-L104 HydrophobicContact CB-CD2 4.26Å; L83-S106 PolarHBondContact N-O 2.98Å; L83-L107 HydrophobicContact CB-CD1 4.03Å; L83-L107 HydrophobicContact CD2-CD1 3.93Å; L83-L107 HydrophobicContact CG-CD1 4Å; L83-D108 PolarHBondContact O-N 3.28Å
84	L	97.9	Very high	93.5	Very high	25 Å²	25	54.3 Å²	54.3	13%	0.131	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	105.7	-177.9	-45.4	178.4	0	0	0	110.1	Y61 L62 D63 C64 Q65 D108	Y61-L84 HydrophobicContact CD1-CD1 4.41Å; L62-L84 PolarHBondContact O-N 3.15Å; D63-L84 HydrophobicContact CB-CD1 4.13Å; C64-L84 CarbonylContact C-O 3.42Å; C64-L84 WeakPolarHBondContact CA-O 3.36Å; C64-L84 WeakPolarHBondContact CB-O 3.39Å; C64-L84 PolarHBondContact N-O 3.08Å; Q65-L84 HydrophobicContact CG-CB 3.99Å; Q65-L84 PolarHBondContact N-O 3.32Å; L84-D108 HydrophobicContact CD2-CB 4.06Å
85	L	97.4	Very high	93.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	23%	0.23	C	C	.	.			trans	-118.4	18	-178.8	-68.1	167	0	0	0	112.4	C64 L69 V72 W76 L83 N88 I90 F98 L107 D108 L109 N112	C64-L85 HydrophobicContact CB-CD2 3.65Å; L69-L85 HydrophobicContact CD1-CD2 3.94Å; V72-L85 HydrophobicContact CG2-CD1 4.01Å; W76-L85 HydrophobicContact CH2-CD2 3.68Å; W76-L85 HydrophobicContact CZ3-CD1 4.49Å; W76-L85 HydrophobicContact CZ3-CD2 3.9Å; L83-L85 HydrophobicContact CD1-CD1 4.3Å; L83-L85 HydrophobicContact CD1-CD2 4.4Å; L83-L85 HydrophobicContact CD1-CG 4.08Å; L83-L85 HydrophobicContact CD2-CD1 3.79Å; L83-L85 HydrophobicContact CD2-CG 4.44Å; L83-L85 HydrophobicContact CG-CD1 3.8Å; L83-L85 HydrophobicContact CG-CG 3.93Å; L85-N88 PolarHBondContact O-ND2 2.88Å; L85-I90 HydrophobicContact CB-CD1 4.42Å; L85-I90 HydrophobicContact CD1-CD1 4.38Å; L85-F98 HydrophobicContact CD1-CE1 4.04Å; L85-L107 HydrophobicContact CD1-CD1 4.23Å; L85-D108 CarbonylContact C-O 3.55Å; L85-D108 VanDerWaalsContact C-O 3.28Å; L85-D108 WeakPolarHBondContact CA-O 3.2Å; L85-D108 VanDerWaalsContact CB-O 3.3Å; L85-D108 WeakPolarHBondContact CB-O 3.22Å; L85-D108 PolarHBondContact N-O 2.96Å; L85-L109 HydrophobicContact CB-CD2 3.93Å; L85-L109 HydrophobicContact CD1-CD2 3.86Å; L85-N112 PolarHBondContact O-ND2 3.07Å
86	A	96.6	Very high	93.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	153.1	179.1	0	0	0	0	0	112.9	Q65 D66 N88 D108 Q110	Q65-A86 VanDerWaalsContact CA-O 3.29Å; Q65-A86 WeakPolarHBondContact CA-O 3.48Å; Q65-A86 HydrophobicContact CG-CB 3.93Å; D66-A86 PolarHBondContact N-O 2.79Å; A86-N88 VanDerWaalsContact C-N 3.33Å; A86-N88 PolarHBondContact O-N 3.03Å; A86-N88 PolarHBondContact O-ND2 3.11Å; A86-D108 PolarHBondContact N-O 3.06Å; A86-Q110 WeakPolarHBondContact CA-O 3.22Å; A86-Q110 HydrophobicContact CB-CG 3.61Å
87	R	95.8	Very high	93.8	Very high	84 Å²	84	48.3 Å²	48.3	32%	0.317	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	40.3	175.8	-60.3	-175.9	-61.2	-71.5	-3.7	114	D66 Q110 Q111	D66-R87 WeakPolarHBondContact CA-O 3.49Å; D66-R87 WeakPolarHBondContact OD1-CB 3.04Å; D66-R87 VanDerWaalsContact OD1-CD 3.24Å; D66-R87 WeakPolarHBondContact OD1-CD 3.22Å; D66-R87 IonicContact OD1-CZ 3.33Å; D66-R87 IonicContact OD1-NE 3.39Å; D66-R87 PolarHBondContact OD1-NE 3.25Å; D66-R87 IonicContact OD2-CZ 3.09Å; D66-R87 IonicContact OD2-NE 3.9Å; D66-R87 PolarHBondContact OD2-NE 3.2Å; D66-R87 IonicContact OD2-NH2 3.9Å; D66-R87 PolarHBondContact OD2-NH2 2.87Å; R87-Q110 PolarHBondContact N-O 2.97Å; R87-Q110 VanDerWaalsContact N-O 3.13Å; R87-Q111 VanDerWaalsContact CA-O 3.27Å; R87-Q111 WeakPolarHBondContact CA-O 3.3Å; R87-Q111 VanDerWaalsContact CD-OE1 3.24Å; R87-Q111 HydrophobicContact CG-CB 3.89Å; R87-Q111 PolarHBondContact N-O 3.06Å
88	N	93.7	Very high	93.9	Very high	8 Å²	8	46.7 Å²	46.7	4%	0.043	21%	0.214	C	C	.	.	S	Bend	trans	-110.2	-168.1	174.7	-79.4	-59.8	0	0	0	111.4	C64 T67 Q68 L69 L85 A86 I90 N112	C64-N88 PolarHBondContact O-ND2 3.25Å; T67-N88 PolarHBondContact N-OD1 3.45Å; T67-N88 VanDerWaalsContact N-OD1 3.12Å; T67-N88 PolarHBondContact OG1-OD1 3.35Å; T67-N88 VanDerWaalsContact OG1-OD1 3.1Å; Q68-N88 PolarHBondContact N-OD1 2.93Å; L69-N88 HydrophobicContact CB-CB 4.22Å; L69-N88 PolarHBondContact N-OD1 3.39Å; L85-N88 PolarHBondContact O-ND2 2.88Å; A86-N88 VanDerWaalsContact C-N 3.33Å; A86-N88 PolarHBondContact O-N 3.03Å; A86-N88 PolarHBondContact O-ND2 3.11Å; N88-I90 HydrophobicContact CB-CG1 4.43Å; N88-N112 WeakPolarHBondContact CA-OD1 3.22Å; N88-N112 WeakPolarHBondContact CB-OD1 3.41Å; N88-N112 PolarHBondContact N-OD1 3.47Å; N88-N112 PolarHBondContact O-OD1 3.39Å
89	K	92.5	Very high	93.9	Very high	103 Å²	103	45.4 Å²	45.4	45%	0.448	21%	0.21	S	C	.	.			trans	-117.5	26.1	-176.3	-71.7	179.2	163.3	167.6	0	112.4	Q68 L69 T70 Q91 N112	Q68-K89 HydrophobicContact CB-CD 4.49Å; L69-K89 CarbonylContact O-C 3.52Å; L69-K89 VanDerWaalsContact O-C 3.22Å; L69-K89 VanDerWaalsContact O-CA 3.27Å; L69-K89 WeakPolarHBondContact O-CA 3.38Å; L69-K89 PolarHBondContact O-N 2.81Å; T70-K89 HydrophobicContact CG2-CB 3.98Å; K89-Q91 PolarHBondContact O-N 3.2Å; K89-N112 PolarHBondContact N-OD1 3.06Å
90	I	93.9	Very high	93.8	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.201	C	C	.	.			trans	-68	126.8	178.9	-56.4	172.9	0	0	0	108.5	L69 L85 N88 L93 L109 N112 V113 I114	L69-I90 PolarHBondContact O-N 3.45Å; L85-I90 HydrophobicContact CB-CD1 4.42Å; L85-I90 HydrophobicContact CD1-CD1 4.38Å; N88-I90 HydrophobicContact CB-CG1 4.43Å; I90-L93 HydrophobicContact CG2-CD2 3.85Å; I90-L109 HydrophobicContact CD1-CD2 3.95Å; I90-N112 HydrophobicContact CB-CB 4.46Å; I90-N112 WeakPolarHBondContact CB-OD1 3.2Å; I90-N112 PolarHBondContact N-OD1 2.85Å; I90-N112 VanDerWaalsContact N-OD1 3.08Å; I90-V113 CarbonylContact O-C 3.16Å; I90-V113 WeakPolarHBondContact O-CG2 3.37Å; I90-V113 PolarHBondContact O-N 3.25Å; I90-V113 VanDerWaalsContact O-N 3.13Å; I90-I114 HydrophobicContact CB-CG1 4.32Å; I90-I114 HydrophobicContact CG2-CG1 4.16Å; I90-I114 WeakPolarHBondContact O-CG1 2.76Å; I90-I114 PolarHBondContact O-N 3.28Å; I90-I114 VanDerWaalsContact O-N 3.08Å
91	Q	89.2	Confident	93.8	Very high	116 Å²	116	44 Å²	44	54%	0.542	20%	0.201	S	C	.	.			trans	-107.3	-34	-175.9	-72	177.6	33.9	0	0	113.6	K89 V113 I114 S115	K89-Q91 PolarHBondContact O-N 3.2Å; Q91-V113 HydrophobicContact CB-CG2 4.49Å; Q91-V113 HydrophobicContact CG-CB 4.44Å; Q91-V113 HydrophobicContact CG-CG2 3.47Å; Q91-V113 VanDerWaalsContact CG-CG2 3.47Å; Q91-I114 WeakPolarHBondContact O-CA 3.37Å; Q91-S115 PolarHBondContact O-N 3.39Å; Q91-S115 PolarHBondContact O-OG 3.35Å
92	I	87.6	Confident	93.6	Very high	64 Å²	64	46.1 Å²	46.1	33%	0.328	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	127.7	-173.9	-56.1	175.7	0	0	0	107.4	R94 V116	I92-R94 HydrophobicContact CG2-CG 3.99Å; I92-V116 WeakPolarHBondContact CA-O 3.38Å; I92-V116 HydrophobicContact CG1-CB 4.39Å; I92-V116 HydrophobicContact CG2-CB 4.29Å; I92-V116 HydrophobicContact CG2-CG1 4.41Å
93	L	93.4	Very high	93.5	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	111.4	166.9	-56.6	-175.9	0	0	0	107.4	I90 M97 F98 L109 I114 V116 I117 E118 A121 F122 L133	I90-L93 HydrophobicContact CG2-CD2 3.85Å; L93-M97 HydrophobicContact CD2-SD 4.09Å; L93-F98 HydrophobicContact CD2-CE2 4.25Å; L93-F98 HydrophobicContact CD2-CZ 4.21Å; L93-L109 HydrophobicContact CD1-CD1 3.93Å; L93-L109 HydrophobicContact CD2-CD1 4.18Å; L93-L109 HydrophobicContact CD2-CD2 4.45Å; L93-I114 HydrophobicContact CD1-CD1 4.23Å; L93-I114 HydrophobicContact CD1-CG2 4.32Å; L93-I114 HydrophobicContact CD2-CD1 3.93Å; L93-I114 HydrophobicContact CD2-CG1 4.34Å; L93-I114 HydrophobicContact CG-CD1 4.17Å; L93-I114 HydrophobicContact CG-CG1 4.48Å; L93-I114 HydrophobicContact CG-CG2 3.96Å; L93-V116 PolarHBondContact N-O 3.31Å; L93-I117 HydrophobicContact CB-CG1 4.46Å; L93-I117 HydrophobicContact CB-CG2 4.21Å; L93-I117 HydrophobicContact CD1-CD1 4.21Å; L93-I117 HydrophobicContact CD1-CG1 4.03Å; L93-I117 HydrophobicContact CD1-CG2 4.28Å; L93-I117 HydrophobicContact CG-CG1 4.37Å; L93-E118 PolarHBondContact O-N 3.29Å; L93-A121 HydrophobicContact CB-CB 3.9Å; L93-F122 HydrophobicContact CD1-CE1 3.92Å; L93-F122 HydrophobicContact CD1-CE2 4.37Å; L93-F122 HydrophobicContact CD1-CZ 3.47Å; L93-F122 VanDerWaalsContact CD1-CZ 3.47Å; L93-L133 HydrophobicContact CD1-CD2 4.25Å
94	R	87.1	Confident	93.5	Very high	156 Å²	156	50 Å²	50	59%	0.589	23%	0.234	S	C	*	.			trans	-90.5	158	-177	-63.6	-172.3	-178.3	-174.2	-1.2	111.9	I92 N96 M97 E118 A121	I92-R94 HydrophobicContact CG2-CG 3.99Å; R94-N96 PolarHBondContact O-N 3.48Å; R94-M97 HydrophobicContact CB-CE 4.07Å; R94-M97 HydrophobicContact CG-CE 4.24Å; R94-M97 WeakPolarHBondContact O-CB 3.36Å; R94-M97 PolarHBondContact O-N 2.82Å; R94-M97 VanDerWaalsContact O-N 3.13Å; R94-E118 WeakPolarHBondContact CA-OE2 3.19Å; R94-E118 WeakPolarHBondContact CB-OE2 3.41Å; R94-A121 VanDerWaalsContact O-CA 3.3Å; R94-A121 WeakPolarHBondContact O-CA 3.35Å
95	D	88.9	Confident	93.5	Very high	71 Å²	71	52.1 Å²	52.1	38%	0.38	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	134.3	174.7	-67.8	-24.3	0	0	0	111.6	M97 E118 D120	D95-M97 PolarHBondContact O-N 3.13Å; D95-E118 PolarHBondContact N-OE2 2.88Å; D95-E118 WeakPolarHBondContact OD1-CB 3.4Å; D95-D120 HydrophobicContact CB-CB 4.12Å; D95-D120 WeakPolarHBondContact OD1-CA 3.28Å; D95-D120 PolarHBondContact OD1-N 2.98Å
96	N	89	Confident	93.6	Very high	65 Å²	65	52.9 Å²	52.9	35%	0.348	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	17.5	177.6	-51.6	-59.4	0	0	0	115	R94 F98 E99 D120 S123	R94-N96 PolarHBondContact O-N 3.48Å; N96-F98 PolarHBondContact O-N 3.06Å; N96-F98 VanDerWaalsContact O-N 3.08Å; N96-E99 HydrophobicContact CB-CB 4.01Å; N96-E99 WeakPolarHBondContact O-CB 3.41Å; N96-E99 PolarHBondContact O-N 3.33Å; N96-E99 VanDerWaalsContact O-N 3.16Å; N96-D120 PolarHBondContact N-O 3.02Å; N96-S123 WeakPolarHBondContact OD1-CB 3.37Å; N96-S123 PolarHBondContact OD1-OG 2.89Å
97	M	92.8	Very high	93.7	Very high	36 Å²	36	52.9 Å²	52.9	18%	0.177	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.7	-178	176	173.5	-74.6	0	0	113.5	V72 L93 R94 D95	V72-M97 HydrophobicContact CB-CG 3.91Å; V72-M97 HydrophobicContact CB-SD 4.42Å; V72-M97 HydrophobicContact CG2-CG 3.88Å; V72-M97 HydrophobicContact CG2-SD 3.95Å; L93-M97 HydrophobicContact CD2-SD 4.09Å; R94-M97 HydrophobicContact CB-CE 4.07Å; R94-M97 HydrophobicContact CG-CE 4.24Å; R94-M97 WeakPolarHBondContact O-CB 3.36Å; R94-M97 PolarHBondContact O-N 2.82Å; R94-M97 VanDerWaalsContact O-N 3.13Å; D95-M97 PolarHBondContact O-N 3.13Å
98	F	96	Very high	93.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	8.2	-178.1	-54.3	-80.9	0	0	0	113.9	V72 L83 L85 L93 N96 Q100 F101 L107 L109 A121 F122 L125	V72-F98 HydrophobicContact CG2-CD1 4.22Å; V72-F98 HydrophobicContact CG2-CE1 3.56Å; V72-F98 HydrophobicContact CG2-CZ 4.09Å; L83-F98 HydrophobicContact CD2-CD1 4.18Å; L83-F98 HydrophobicContact CD2-CE1 4.29Å; L85-F98 HydrophobicContact CD1-CE1 4.04Å; L93-F98 HydrophobicContact CD2-CE2 4.25Å; L93-F98 HydrophobicContact CD2-CZ 4.21Å; N96-F98 PolarHBondContact O-N 3.06Å; N96-F98 VanDerWaalsContact O-N 3.08Å; F98-Q100 PolarHBondContact O-N 3.3Å; F98-F101 HydrophobicContact CB-CD2 4.16Å; F98-F101 HydrophobicContact CD1-CD2 4.33Å; F98-F101 HydrophobicContact CD1-CE2 4.42Å; F98-F101 WeakPolarHBondContact O-CD2 3.44Å; F98-F101 PolarHBondContact O-N 2.82Å; F98-L107 HydrophobicContact CD1-CD1 4.35Å; F98-L107 HydrophobicContact CD1-CD2 4.14Å; F98-L107 HydrophobicContact CD2-CD2 4.23Å; F98-L107 HydrophobicContact CE1-CD1 3.95Å; F98-L107 HydrophobicContact CE1-CD2 4.01Å; F98-L107 HydrophobicContact CE2-CD2 4.13Å; F98-L107 HydrophobicContact CG-CD2 4.25Å; F98-L107 HydrophobicContact CZ-CD1 4.5Å; F98-L107 HydrophobicContact CZ-CD2 4.03Å; F98-L109 HydrophobicContact CE2-CD1 4.38Å; F98-L109 HydrophobicContact CZ-CD1 3.94Å; F98-L109 HydrophobicContact CZ-CD2 4.19Å; F98-A121 WeakPolarHBondContact CD2-O 3.29Å; F98-F122 HydrophobicContact CD2-CD1 4.06Å; F98-F122 HydrophobicContact CD2-CE1 4.35Å; F98-F122 HydrophobicContact CE2-CD1 4.22Å; F98-F122 HydrophobicContact CE2-CE1 4.04Å; F98-L125 HydrophobicContact CB-CD1 3.84Å; F98-L125 HydrophobicContact CB-CD2 3.87Å; F98-L125 HydrophobicContact CB-CG 4.06Å; F98-L125 HydrophobicContact CD2-CD1 4.48Å; F98-L125 HydrophobicContact CG-CD1 4.32Å
99	E	94.4	Very high	94	Very high	104 Å²	104	49 Å²	49	49%	0.486	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-34.2	-169.9	-175.3	-175	-166	0	0	113.3	N96 F101 S123	N96-E99 HydrophobicContact CB-CB 4.01Å; N96-E99 WeakPolarHBondContact O-CB 3.41Å; N96-E99 PolarHBondContact O-N 3.33Å; N96-E99 VanDerWaalsContact O-N 3.16Å; E99-F101 VanDerWaalsContact C-N 3.25Å; E99-F101 PolarHBondContact O-N 2.95Å; E99-S123 WeakPolarHBondContact CA-O 3.07Å
100	Q	93.2	Very high	94.3	Very high	42 Å²	42	45.7 Å²	45.7	20%	0.196	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.2	-179.3	68.9	-179.4	0.9	0	0	114.7	R73 Q74 K78 F98 T102	R73-Q100 PolarHBondContact O-NE2 3.29Å; R73-Q100 VanDerWaalsContact O-NE2 3.09Å; Q74-Q100 PolarHBondContact O-OE1 2.85Å; K78-Q100 HydrophobicContact CD-CB 4.46Å; K78-Q100 HydrophobicContact CG-CB 4.41Å; F98-Q100 PolarHBondContact O-N 3.3Å; Q100-T102 PolarHBondContact O-N 2.78Å
101	F	95.6	Very high	94.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.			trans	-95.4	60.3	-175.8	-52.2	-65.9	0	0	0	111.3	V72 W76 P77 I80 L83 F98 E99 Q103 L104 L125	V72-F101 HydrophobicContact CG1-CE2 3.73Å; V72-F101 HydrophobicContact CG1-CZ 4.14Å; W76-F101 HydrophobicContact CB-CE1 3.99Å; W76-F101 HydrophobicContact CB-CZ 3.94Å; W76-F101 AromaticContact CE3-CZ 3.86Å; W76-F101 HydrophobicContact CE3-CZ 3.86Å; P77-F101 WeakPolarHBondContact O-CE1 3.27Å; I80-F101 HydrophobicContact CD1-CD1 3.5Å; I80-F101 VanDerWaalsContact CD1-CD1 3.5Å; I80-F101 HydrophobicContact CD1-CE1 3.56Å; I80-F101 HydrophobicContact CD1-CG 4.2Å; I80-F101 HydrophobicContact CD1-CZ 4.31Å; I80-F101 HydrophobicContact CG1-CD1 3.58Å; I80-F101 HydrophobicContact CG1-CE1 4.07Å; I80-F101 HydrophobicContact CG1-CG 4.34Å; L83-F101 HydrophobicContact CD2-CD2 4.24Å; L83-F101 HydrophobicContact CD2-CE2 4.02Å; L83-F101 HydrophobicContact CD2-CZ 4.42Å; F98-F101 HydrophobicContact CB-CD2 4.16Å; F98-F101 HydrophobicContact CD1-CD2 4.33Å; F98-F101 HydrophobicContact CD1-CE2 4.42Å; F98-F101 WeakPolarHBondContact O-CD2 3.44Å; F98-F101 PolarHBondContact O-N 2.82Å; E99-F101 VanDerWaalsContact C-N 3.25Å; E99-F101 PolarHBondContact O-N 2.95Å; F101-Q103 PolarHBondContact O-N 3.13Å; F101-Q103 VanDerWaalsContact O-N 3.13Å; F101-L104 HydrophobicContact CB-CB 4.03Å; F101-L104 HydrophobicContact CB-CD1 4.46Å; F101-L104 HydrophobicContact CB-CD2 4.34Å; F101-L104 WeakPolarHBondContact O-CB 3.23Å; F101-L104 PolarHBondContact O-N 3.43Å; F101-L104 VanDerWaalsContact O-N 3.07Å; F101-L125 HydrophobicContact CB-CD2 4.42Å
102	T	94.9	Very high	94.6	Very high	77 Å²	77	44.5 Å²	44.5	47%	0.472	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-17.3	-173.1	57.6	0	0	0	0	114.4	Q100	Q100-T102 PolarHBondContact O-N 2.78Å
103	Q	96.3	Very high	94.9	Very high	97 Å²	97	44.1 Å²	44.1	45%	0.453	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	4.5	177.3	-62.6	-172.8	55	0	0	113.6	F101 K105	F101-Q103 PolarHBondContact O-N 3.13Å; F101-Q103 VanDerWaalsContact O-N 3.13Å; Q103-K105 PolarHBondContact O-N 3.05Å
104	L	98.1	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.			trans	-68.2	125.2	-173.6	-158.9	72	0	0	0	111.1	I80 L83 F101 L107 L125 Q127 L128	I80-L104 HydrophobicContact CD1-CD1 4.26Å; I80-L104 HydrophobicContact CG1-CD1 4.09Å; L83-L104 HydrophobicContact CB-CD1 3.68Å; L83-L104 HydrophobicContact CB-CD2 4.26Å; F101-L104 HydrophobicContact CB-CB 4.03Å; F101-L104 HydrophobicContact CB-CD1 4.46Å; F101-L104 HydrophobicContact CB-CD2 4.34Å; F101-L104 WeakPolarHBondContact O-CB 3.23Å; F101-L104 PolarHBondContact O-N 3.43Å; F101-L104 VanDerWaalsContact O-N 3.07Å; L104-L107 HydrophobicContact CD2-CB 3.99Å; L104-L107 HydrophobicContact CD2-CD1 4.31Å; L104-L107 HydrophobicContact CD2-CD2 4.48Å; L104-L107 HydrophobicContact CD2-CG 4.49Å; L104-L125 HydrophobicContact CB-CD2 4.1Å; L104-L125 HydrophobicContact CD2-CD2 4.02Å; L104-Q127 CarbonylContact O-C 3.28Å; L104-L128 HydrophobicContact CB-CD1 4.24Å; L104-L128 HydrophobicContact CD2-CD1 3.9Å; L104-L128 HydrophobicContact CG-CD1 3.89Å; L104-L128 VanDerWaalsContact O-CA 3.28Å; L104-L128 WeakPolarHBondContact O-CA 3.28Å; L104-L128 PolarHBondContact O-N 2.92Å; L104-L128 VanDerWaalsContact O-N 3.14Å
105	K	98.2	Very high	95.2	Very high	71 Å²	71	39.4 Å²	39.4	31%	0.309	21%	0.205	S	C	.	.			trans	-102.5	-32.1	176.8	-62.9	179.7	-177.1	164.7	0	112.2	E59 Q81 Q103 T129 T130	E59-K105 IonicContact OE1-NZ 3.26Å; E59-K105 PolarHBondContact OE1-NZ 3.1Å; Q81-K105 HydrophobicContact CB-CD 4.41Å; Q81-K105 HydrophobicContact CB-CG 4.46Å; Q81-K105 PolarHBondContact O-N 2.93Å; Q103-K105 PolarHBondContact O-N 3.05Å; K105-T129 PolarHBondContact O-N 3.33Å; K105-T129 PolarHBondContact O-OG1 2.93Å; K105-T130 PolarHBondContact O-N 3.5Å; K105-T130 VanDerWaalsContact O-N 3.08Å
106	S	98.4	Very high	95	Very high	16 Å²	16	39.5 Å²	39.5	11%	0.112	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.9	178.9	-168	0	0	0	0	112.4	Q81 H82 L83 T130	Q81-S106 PolarHBondContact O-N 3.37Å; Q81-S106 VanDerWaalsContact O-N 3.11Å; H82-S106 WeakPolarHBondContact CA-O 3.33Å; H82-S106 WeakPolarHBondContact ND1-CB 3.42Å; L83-S106 PolarHBondContact N-O 2.98Å; S106-T130 WeakPolarHBondContact CA-O 3.43Å
107	L	98.6	Very high	95.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	115.6	175.9	178.8	55.4	0	0	0	109.9	L83 L85 F98 L104 L109 F122 L125 L128 T130 L131 L132	L83-L107 HydrophobicContact CB-CD1 4.03Å; L83-L107 HydrophobicContact CD2-CD1 3.93Å; L83-L107 HydrophobicContact CG-CD1 4Å; L85-L107 HydrophobicContact CD1-CD1 4.23Å; F98-L107 HydrophobicContact CD1-CD1 4.35Å; F98-L107 HydrophobicContact CD1-CD2 4.14Å; F98-L107 HydrophobicContact CD2-CD2 4.23Å; F98-L107 HydrophobicContact CE1-CD1 3.95Å; F98-L107 HydrophobicContact CE1-CD2 4.01Å; F98-L107 HydrophobicContact CE2-CD2 4.13Å; F98-L107 HydrophobicContact CG-CD2 4.25Å; F98-L107 HydrophobicContact CZ-CD1 4.5Å; F98-L107 HydrophobicContact CZ-CD2 4.03Å; L104-L107 HydrophobicContact CD2-CB 3.99Å; L104-L107 HydrophobicContact CD2-CD1 4.31Å; L104-L107 HydrophobicContact CD2-CD2 4.48Å; L104-L107 HydrophobicContact CD2-CG 4.49Å; L107-L109 HydrophobicContact CD1-CD1 4.34Å; L107-L109 HydrophobicContact CD1-CG 4.1Å; L107-L109 HydrophobicContact CD2-CD1 3.81Å; L107-L109 HydrophobicContact CD2-CG 4.45Å; L107-L109 HydrophobicContact CG-CD1 3.9Å; L107-L109 HydrophobicContact CG-CG 4.02Å; L107-F122 HydrophobicContact CD2-CD1 4.27Å; L107-F122 HydrophobicContact CD2-CE1 4.03Å; L107-L125 HydrophobicContact CD2-CD1 4.14Å; L107-L128 HydrophobicContact CB-CD1 3.89Å; L107-L128 HydrophobicContact CB-CD2 4.37Å; L107-T130 PolarHBondContact N-O 3.16Å; L107-L131 HydrophobicContact CB-CD1 4.05Å; L107-L131 HydrophobicContact CD2-CD1 3.97Å; L107-L131 HydrophobicContact CG-CD1 4.02Å; L107-L132 PolarHBondContact O-N 3.08Å
108	D	98.3	Very high	94.7	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	107.1	176.7	-172.2	4.6	0	0	0	111.7	L83 L84 L85 A86 Q110 L132	L83-D108 PolarHBondContact O-N 3.28Å; L84-D108 HydrophobicContact CD2-CB 4.06Å; L85-D108 CarbonylContact C-O 3.55Å; L85-D108 VanDerWaalsContact C-O 3.28Å; L85-D108 WeakPolarHBondContact CA-O 3.2Å; L85-D108 VanDerWaalsContact CB-O 3.3Å; L85-D108 WeakPolarHBondContact CB-O 3.22Å; L85-D108 PolarHBondContact N-O 2.96Å; A86-D108 PolarHBondContact N-O 3.06Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.47Å; D108-Q110 WeakPolarHBondContact OD1-CG 3.3Å; D108-Q110 PolarHBondContact OD1-N 3.27Å; D108-Q110 PolarHBondContact OD1-NE2 3.01Å; D108-Q110 PolarHBondContact OD2-NE2 2.9Å; D108-L132 HydrophobicContact CB-CB 4.48Å; D108-L132 HydrophobicContact CB-CD1 4.05Å; D108-L132 WeakPolarHBondContact OD1-CB 3.48Å
109	L	98.4	Very high	94.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.			trans	-115.1	14.8	177.5	-72.6	164.8	0	0	0	112	L85 I90 L93 F98 L107 N112 I114 F122 L131 L132 L133 N136	L85-L109 HydrophobicContact CB-CD2 3.93Å; L85-L109 HydrophobicContact CD1-CD2 3.86Å; I90-L109 HydrophobicContact CD1-CD2 3.95Å; L93-L109 HydrophobicContact CD1-CD1 3.93Å; L93-L109 HydrophobicContact CD2-CD1 4.18Å; L93-L109 HydrophobicContact CD2-CD2 4.45Å; F98-L109 HydrophobicContact CE2-CD1 4.38Å; F98-L109 HydrophobicContact CZ-CD1 3.94Å; F98-L109 HydrophobicContact CZ-CD2 4.19Å; L107-L109 HydrophobicContact CD1-CD1 4.34Å; L107-L109 HydrophobicContact CD1-CG 4.1Å; L107-L109 HydrophobicContact CD2-CD1 3.81Å; L107-L109 HydrophobicContact CD2-CG 4.45Å; L107-L109 HydrophobicContact CG-CD1 3.9Å; L107-L109 HydrophobicContact CG-CG 4.02Å; L109-N112 PolarHBondContact O-ND2 3.13Å; L109-I114 HydrophobicContact CB-CD1 3.97Å; L109-I114 HydrophobicContact CD1-CD1 4.49Å; L109-I114 HydrophobicContact CD2-CD1 4.34Å; L109-F122 HydrophobicContact CD1-CE1 4.22Å; L109-L131 HydrophobicContact CD1-CD1 4.45Å; L109-L132 CarbonylContact C-O 3.5Å; L109-L132 WeakPolarHBondContact CA-O 3.1Å; L109-L132 WeakPolarHBondContact CB-O 3.08Å; L109-L132 PolarHBondContact N-O 3.26Å; L109-L133 HydrophobicContact CB-CD2 3.87Å; L109-L133 HydrophobicContact CD1-CD2 3.98Å; L109-N136 PolarHBondContact O-ND2 3.14Å
110	Q	97.1	Very high	93.8	Very high	35 Å²	35	41.3 Å²	41.3	16%	0.164	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	157.4	-176.8	77.6	-172	-48.7	0	0	112.4	A86 R87 D108 N112 L132 Q134	A86-Q110 WeakPolarHBondContact CA-O 3.22Å; A86-Q110 HydrophobicContact CB-CG 3.61Å; R87-Q110 PolarHBondContact N-O 2.97Å; R87-Q110 VanDerWaalsContact N-O 3.13Å; D108-Q110 WeakPolarHBondContact OD1-CB 3.47Å; D108-Q110 WeakPolarHBondContact OD1-CG 3.3Å; D108-Q110 PolarHBondContact OD1-N 3.27Å; D108-Q110 PolarHBondContact OD1-NE2 3.01Å; D108-Q110 PolarHBondContact OD2-NE2 2.9Å; Q110-N112 PolarHBondContact O-N 3.29Å; Q110-N112 PolarHBondContact O-ND2 2.89Å; Q110-L132 PolarHBondContact N-O 3.04Å; Q110-Q134 WeakPolarHBondContact CA-O 3.19Å; Q110-Q134 HydrophobicContact CB-CG 3.94Å; Q110-Q134 WeakPolarHBondContact CB-O 3.49Å
111	Q	96.1	Very high	93.8	Very high	81 Å²	81	39.3 Å²	39.3	38%	0.379	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	35.8	175.1	-60.8	178.9	-10.1	0	0	113.4	R87 Q134 H135	R87-Q111 VanDerWaalsContact CA-O 3.27Å; R87-Q111 WeakPolarHBondContact CA-O 3.3Å; R87-Q111 VanDerWaalsContact CD-OE1 3.24Å; R87-Q111 HydrophobicContact CG-CB 3.89Å; R87-Q111 PolarHBondContact N-O 3.06Å; Q111-Q134 PolarHBondContact N-O 2.85Å; Q111-H135 VanDerWaalsContact CA-O 3.28Å; Q111-H135 WeakPolarHBondContact CA-O 3.11Å; Q111-H135 HydrophobicContact CB-CB 4.48Å; Q111-H135 HydrophobicContact CG-CB 3.71Å; Q111-H135 PolarHBondContact N-O 3.04Å
112	N	95.1	Very high	93.8	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	21%	0.211	C	C	.	.	S	Bend	trans	-99.2	-164.3	167.6	-84.9	-87.4	0	0	0	109.6	L85 N88 K89 I90 L109 Q110 I114 N136	L85-N112 PolarHBondContact O-ND2 3.07Å; N88-N112 WeakPolarHBondContact CA-OD1 3.22Å; N88-N112 WeakPolarHBondContact CB-OD1 3.41Å; N88-N112 PolarHBondContact N-OD1 3.47Å; N88-N112 PolarHBondContact O-OD1 3.39Å; K89-N112 PolarHBondContact N-OD1 3.06Å; I90-N112 HydrophobicContact CB-CB 4.46Å; I90-N112 WeakPolarHBondContact CB-OD1 3.2Å; I90-N112 PolarHBondContact N-OD1 2.85Å; I90-N112 VanDerWaalsContact N-OD1 3.08Å; L109-N112 PolarHBondContact O-ND2 3.13Å; Q110-N112 PolarHBondContact O-N 3.29Å; Q110-N112 PolarHBondContact O-ND2 2.89Å; N112-I114 HydrophobicContact CB-CD1 4.03Å; N112-I114 HydrophobicContact CB-CG1 3.91Å; N112-N136 VanDerWaalsContact CA-OD1 3.23Å; N112-N136 WeakPolarHBondContact CA-OD1 3.22Å; N112-N136 WeakPolarHBondContact CB-OD1 3.49Å; N112-N136 PolarHBondContact N-OD1 3.09Å; N112-N136 PolarHBondContact O-OD1 3.33Å
113	V	93.8	Very high	93.9	Very high	56 Å²	56	37.3 Å²	37.3	34%	0.339	20%	0.2	S	C	.	.			trans	-118.5	32.3	174.6	-71.2	0	0	0	0	111	I90 Q91 S115 N136	I90-V113 CarbonylContact O-C 3.16Å; I90-V113 WeakPolarHBondContact O-CG2 3.37Å; I90-V113 PolarHBondContact O-N 3.25Å; I90-V113 VanDerWaalsContact O-N 3.13Å; Q91-V113 HydrophobicContact CB-CG2 4.49Å; Q91-V113 HydrophobicContact CG-CB 4.44Å; Q91-V113 HydrophobicContact CG-CG2 3.47Å; Q91-V113 VanDerWaalsContact CG-CG2 3.47Å; V113-S115 PolarHBondContact O-N 3.18Å; V113-N136 PolarHBondContact N-OD1 2.96Å
114	I	96.9	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.192	C	C	.	.			trans	-64.8	122.7	-175.3	-60.4	164	0	0	0	108.8	I90 Q91 L93 L109 N112 I117 L133 N136 R137 I138	I90-I114 HydrophobicContact CB-CG1 4.32Å; I90-I114 HydrophobicContact CG2-CG1 4.16Å; I90-I114 WeakPolarHBondContact O-CG1 2.76Å; I90-I114 PolarHBondContact O-N 3.28Å; I90-I114 VanDerWaalsContact O-N 3.08Å; Q91-I114 WeakPolarHBondContact O-CA 3.37Å; L93-I114 HydrophobicContact CD1-CD1 4.23Å; L93-I114 HydrophobicContact CD1-CG2 4.32Å; L93-I114 HydrophobicContact CD2-CD1 3.93Å; L93-I114 HydrophobicContact CD2-CG1 4.34Å; L93-I114 HydrophobicContact CG-CD1 4.17Å; L93-I114 HydrophobicContact CG-CG1 4.48Å; L93-I114 HydrophobicContact CG-CG2 3.96Å; L109-I114 HydrophobicContact CB-CD1 3.97Å; L109-I114 HydrophobicContact CD1-CD1 4.49Å; L109-I114 HydrophobicContact CD2-CD1 4.34Å; N112-I114 HydrophobicContact CB-CD1 4.03Å; N112-I114 HydrophobicContact CB-CG1 3.91Å; I114-I117 HydrophobicContact CG2-CG1 4.01Å; I114-L133 HydrophobicContact CD1-CD2 4.14Å; I114-N136 HydrophobicContact CB-CB 4.22Å; I114-N136 WeakPolarHBondContact CB-OD1 3.48Å; I114-N136 WeakPolarHBondContact CG1-OD1 3.5Å; I114-N136 PolarHBondContact N-OD1 3.02Å; I114-R137 CarbonylContact O-C 3.58Å; I114-R137 WeakPolarHBondContact O-CA 3.38Å; I114-R137 WeakPolarHBondContact O-CB 3.5Å; I114-R137 PolarHBondContact O-N 2.99Å; I114-I138 HydrophobicContact CG2-CG1 4.18Å; I114-I138 PolarHBondContact O-N 3.03Å; I114-I138 VanDerWaalsContact O-N 3.11Å
115	S	88.6	Confident	93.6	Very high	57 Å²	57	34.1 Å²	34.1	40%	0.399	19%	0.192	S	C	.	.			trans	-119.9	-25.4	-179.5	58.6	0	0	0	0	113	Q91 V113	Q91-S115 PolarHBondContact O-N 3.39Å; Q91-S115 PolarHBondContact O-OG 3.35Å; V113-S115 PolarHBondContact O-N 3.18Å
116	V	85.1	Confident	93.4	Very high	74 Å²	74	33.1 Å²	33.1	45%	0.448	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.2	-178.9	-178.4	0	0	0	0	109.1	I92 L93	I92-V116 WeakPolarHBondContact CA-O 3.38Å; I92-V116 HydrophobicContact CG1-CB 4.39Å; I92-V116 HydrophobicContact CG2-CB 4.29Å; I92-V116 HydrophobicContact CG2-CG1 4.41Å; L93-V116 PolarHBondContact N-O 3.31Å
117	I	92.2	Very high	93.3	Very high	26 Å²	26	36 Å²	36	13%	0.133	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	119.3	172.9	-53.8	179.4	0	0	0	105.8	L93 I114 A121 F122 L133 I138 V145	L93-I117 HydrophobicContact CB-CG1 4.46Å; L93-I117 HydrophobicContact CB-CG2 4.21Å; L93-I117 HydrophobicContact CD1-CD1 4.21Å; L93-I117 HydrophobicContact CD1-CG1 4.03Å; L93-I117 HydrophobicContact CD1-CG2 4.28Å; L93-I117 HydrophobicContact CG-CG1 4.37Å; I114-I117 HydrophobicContact CG2-CG1 4.01Å; I117-A121 HydrophobicContact CG2-CB 3.87Å; I117-F122 HydrophobicContact CG2-CE2 3.9Å; I117-F122 HydrophobicContact CG2-CZ 4.47Å; I117-L133 HydrophobicContact CD1-CD1 4.38Å; I117-I138 HydrophobicContact CD1-CD1 3.83Å; I117-I138 HydrophobicContact CD1-CG1 4.3Å; I117-V145 HydrophobicContact CG2-CG1 3.69Å; I117-V145 HydrophobicContact CG2-CG2 4.08Å
118	E	84.1	Confident	93.3	Very high	66 Å²	66	36 Å²	36	31%	0.308	21%	0.206	S	C	.	.			trans	-76.7	157	175.4	-61.3	175.2	177.7	0	0	110.5	L93 R94 D95 D120 A121	L93-E118 PolarHBondContact O-N 3.29Å; R94-E118 WeakPolarHBondContact CA-OE2 3.19Å; R94-E118 WeakPolarHBondContact CB-OE2 3.41Å; D95-E118 PolarHBondContact N-OE2 2.88Å; D95-E118 WeakPolarHBondContact OD1-CB 3.4Å; E118-D120 VanDerWaalsContact C-N 3.3Å; E118-D120 PolarHBondContact O-N 3.32Å; E118-A121 WeakPolarHBondContact O-CB 3.3Å; E118-A121 PolarHBondContact O-N 2.95Å; E118-A121 VanDerWaalsContact O-N 3.14Å
119	D	82.7	Confident	93.3	Very high	68 Å²	68	37.9 Å²	37.9	36%	0.364	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-38.7	-167.8	-71	-0.5	0	0	0	112.1	K282	D119-K282 IonicContact OD2-NZ 3.19Å; D119-K282 PolarHBondContact OD2-NZ 3.31Å
120	D	87.1	Confident	93.3	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	18.5	-177.7	-68.5	-42.8	0	0	0	112.7	D95 N96 E118 F122 S123	D95-D120 HydrophobicContact CB-CB 4.12Å; D95-D120 WeakPolarHBondContact OD1-CA 3.28Å; D95-D120 PolarHBondContact OD1-N 2.98Å; N96-D120 PolarHBondContact N-O 3.02Å; E118-D120 VanDerWaalsContact C-N 3.3Å; E118-D120 PolarHBondContact O-N 3.32Å; D120-F122 PolarHBondContact O-N 3.4Å; D120-F122 VanDerWaalsContact O-N 3.09Å; D120-S123 VanDerWaalsContact O-CB 3.27Å; D120-S123 WeakPolarHBondContact O-CB 3.47Å; D120-S123 PolarHBondContact O-N 3.32Å
121	A	93.6	Very high	93.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.9	-175.5	0	0	0	0	0	113.6	L93 R94 F98 I117 E118	L93-A121 HydrophobicContact CB-CB 3.9Å; R94-A121 VanDerWaalsContact O-CA 3.3Å; R94-A121 WeakPolarHBondContact O-CA 3.35Å; F98-A121 WeakPolarHBondContact CD2-O 3.29Å; I117-A121 HydrophobicContact CG2-CB 3.87Å; E118-A121 WeakPolarHBondContact O-CB 3.3Å; E118-A121 PolarHBondContact O-N 2.95Å; E118-A121 VanDerWaalsContact O-N 3.14Å
122	F	96.9	Very high	93.4	Very high	1 Å²	1	35 Å²	35	0%	0.004	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	14.5	-179.8	-58.7	-63.4	0	0	0	114	L93 F98 L107 L109 I117 D120 L125 L131 L133 V145 L149	L93-F122 HydrophobicContact CD1-CE1 3.92Å; L93-F122 HydrophobicContact CD1-CE2 4.37Å; L93-F122 HydrophobicContact CD1-CZ 3.47Å; L93-F122 VanDerWaalsContact CD1-CZ 3.47Å; F98-F122 HydrophobicContact CD2-CD1 4.06Å; F98-F122 HydrophobicContact CD2-CE1 4.35Å; F98-F122 HydrophobicContact CE2-CD1 4.22Å; F98-F122 HydrophobicContact CE2-CE1 4.04Å; L107-F122 HydrophobicContact CD2-CD1 4.27Å; L107-F122 HydrophobicContact CD2-CE1 4.03Å; L109-F122 HydrophobicContact CD1-CE1 4.22Å; I117-F122 HydrophobicContact CG2-CE2 3.9Å; I117-F122 HydrophobicContact CG2-CZ 4.47Å; D120-F122 PolarHBondContact O-N 3.4Å; D120-F122 VanDerWaalsContact O-N 3.09Å; F122-L125 HydrophobicContact CB-CD1 4.18Å; F122-L125 HydrophobicContact CD1-CD1 3.99Å; F122-L125 WeakPolarHBondContact O-CB 3.23Å; F122-L125 WeakPolarHBondContact O-CG 3.19Å; F122-L125 PolarHBondContact O-N 3.08Å; F122-L131 HydrophobicContact CE1-CD1 4.14Å; F122-L131 HydrophobicContact CE1-CD2 4.25Å; F122-L131 HydrophobicContact CE2-CD2 4.18Å; F122-L131 HydrophobicContact CZ-CD1 4.36Å; F122-L131 HydrophobicContact CZ-CD2 3.97Å; F122-L133 HydrophobicContact CZ-CD1 4.32Å; F122-V145 HydrophobicContact CD2-CG1 3.55Å; F122-V145 WeakPolarHBondContact CD2-O 3.49Å; F122-V145 HydrophobicContact CE2-CG1 3.37Å; F122-L149 HydrophobicContact CB-CD1 4.26Å; F122-L149 HydrophobicContact CB-CD2 4.02Å; F122-L149 HydrophobicContact CB-CG 4.25Å; F122-L149 HydrophobicContact CD2-CD1 4.48Å; F122-L149 HydrophobicContact CG-CD1 4.38Å
123	S	95.2	Very high	93.6	Very high	34 Å²	34	34.9 Å²	34.9	24%	0.238	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	144.7	175	-174.2	0	0	0	0	111.9	N96 E99 D120 L125	N96-S123 WeakPolarHBondContact OD1-CB 3.37Å; N96-S123 PolarHBondContact OD1-OG 2.89Å; E99-S123 WeakPolarHBondContact CA-O 3.07Å; D120-S123 VanDerWaalsContact O-CB 3.27Å; D120-S123 WeakPolarHBondContact O-CB 3.47Å; D120-S123 PolarHBondContact O-N 3.32Å; S123-L125 VanDerWaalsContact C-N 3.3Å; S123-L125 PolarHBondContact O-N 3.14Å
124	G	91.8	Very high	93.7	Very high	28 Å²	28	32.2 Å²	32.2	29%	0.289	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	-12.5	-177.3	0	0	0	0	0	115.6	S126	G124-S126 PolarHBondContact O-N 3.26Å
125	L	96.8	Very high	93.7	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	21%	0.206	C	C	.	.			trans	-84.7	46.7	-175.7	-60.5	-173	0	0	0	114.4	F98 F101 L104 L107 F122 S123 Q127 L128 L149	F98-L125 HydrophobicContact CB-CD1 3.84Å; F98-L125 HydrophobicContact CB-CD2 3.87Å; F98-L125 HydrophobicContact CB-CG 4.06Å; F98-L125 HydrophobicContact CD2-CD1 4.48Å; F98-L125 HydrophobicContact CG-CD1 4.32Å; F101-L125 HydrophobicContact CB-CD2 4.42Å; L104-L125 HydrophobicContact CB-CD2 4.1Å; L104-L125 HydrophobicContact CD2-CD2 4.02Å; L107-L125 HydrophobicContact CD2-CD1 4.14Å; F122-L125 HydrophobicContact CB-CD1 4.18Å; F122-L125 HydrophobicContact CD1-CD1 3.99Å; F122-L125 WeakPolarHBondContact O-CB 3.23Å; F122-L125 WeakPolarHBondContact O-CG 3.19Å; F122-L125 PolarHBondContact O-N 3.08Å; S123-L125 VanDerWaalsContact C-N 3.3Å; S123-L125 PolarHBondContact O-N 3.14Å; L125-Q127 PolarHBondContact O-N 3.48Å; L125-Q127 VanDerWaalsContact O-N 3.09Å; L125-L128 HydrophobicContact CB-CB 4.13Å; L125-L128 HydrophobicContact CD1-CD2 4.15Å; L125-L128 WeakPolarHBondContact O-CB 3.22Å; L125-L128 PolarHBondContact O-N 2.99Å; L125-L128 VanDerWaalsContact O-N 3.1Å; L125-L149 HydrophobicContact CB-CD2 3.58Å; L125-L149 HydrophobicContact CD1-CD2 4.46Å
126	S	94.3	Very high	94.2	Very high	50 Å²	50	33.2 Å²	33.2	35%	0.35	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-16.2	-174.1	65.2	0	0	0	0	116	G124	G124-S126 PolarHBondContact O-N 3.26Å
127	Q	97.3	Very high	94.7	Very high	78 Å²	78	37.4 Å²	37.4	36%	0.364	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-1.3	179.3	-58.7	-57.3	-40.5	0	0	113.3	L104 L125 T129	L104-Q127 CarbonylContact O-C 3.28Å; L125-Q127 PolarHBondContact O-N 3.48Å; L125-Q127 VanDerWaalsContact O-N 3.09Å; Q127-T129 PolarHBondContact O-N 3.44Å
128	L	98.3	Very high	94.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.			trans	-69.6	126.3	-173.3	-161.4	79.6	0	0	0	110.7	L104 L107 L125 L131 L149 R151 L152	L104-L128 HydrophobicContact CB-CD1 4.24Å; L104-L128 HydrophobicContact CD2-CD1 3.9Å; L104-L128 HydrophobicContact CG-CD1 3.89Å; L104-L128 VanDerWaalsContact O-CA 3.28Å; L104-L128 WeakPolarHBondContact O-CA 3.28Å; L104-L128 PolarHBondContact O-N 2.92Å; L104-L128 VanDerWaalsContact O-N 3.14Å; L107-L128 HydrophobicContact CB-CD1 3.89Å; L107-L128 HydrophobicContact CB-CD2 4.37Å; L125-L128 HydrophobicContact CB-CB 4.13Å; L125-L128 HydrophobicContact CD1-CD2 4.15Å; L125-L128 WeakPolarHBondContact O-CB 3.22Å; L125-L128 PolarHBondContact O-N 2.99Å; L125-L128 VanDerWaalsContact O-N 3.1Å; L128-L131 HydrophobicContact CD2-CB 4.12Å; L128-L131 HydrophobicContact CD2-CD1 4.47Å; L128-L149 HydrophobicContact CB-CD2 4.05Å; L128-L149 HydrophobicContact CD2-CD1 4.27Å; L128-L149 HydrophobicContact CD2-CD2 3.87Å; L128-R151 CarbonylContact O-C 3.07Å; L128-R151 VanDerWaalsContact O-C 3.22Å; L128-L152 HydrophobicContact CD2-CD1 4.48Å; L128-L152 WeakPolarHBondContact O-CA 3.35Å; L128-L152 PolarHBondContact O-N 3.3Å
129	T	97.4	Very high	95.2	Very high	48 Å²	48	39.8 Å²	39.8	29%	0.294	20%	0.201	S	C	.	.			trans	-108.9	-29.9	178.7	63.1	0	0	0	0	112.1	K105 Q127 T153 Y154	K105-T129 PolarHBondContact O-N 3.33Å; K105-T129 PolarHBondContact O-OG1 2.93Å; Q127-T129 PolarHBondContact O-N 3.44Å; T129-T153 PolarHBondContact O-N 3.1Å; T129-T153 PolarHBondContact O-OG1 2.94Å; T129-Y154 PolarHBondContact O-N 3.25Å
130	T	97.9	Very high	95.6	Very high	33 Å²	33	38.8 Å²	38.8	20%	0.202	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.4	-173.7	-63	0	0	0	0	110.9	K105 S106 L107 L132 Y154	K105-T130 PolarHBondContact O-N 3.5Å; K105-T130 VanDerWaalsContact O-N 3.08Å; S106-T130 WeakPolarHBondContact CA-O 3.43Å; L107-T130 PolarHBondContact N-O 3.16Å; T130-L132 HydrophobicContact CG2-CD2 3.79Å; T130-L132 HydrophobicContact CG2-CG 4.13Å; T130-Y154 WeakPolarHBondContact CA-O 3.43Å; T130-Y154 HydrophobicContact CG2-CD1 4.11Å
131	L	98.4	Very high	95.8	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.8	175.4	179.6	56.6	0	0	0	110.5	L107 L109 F122 L128 L133 L149 L152 Y154 L155 R156	L107-L131 HydrophobicContact CB-CD1 4.05Å; L107-L131 HydrophobicContact CD2-CD1 3.97Å; L107-L131 HydrophobicContact CG-CD1 4.02Å; L109-L131 HydrophobicContact CD1-CD1 4.45Å; F122-L131 HydrophobicContact CE1-CD1 4.14Å; F122-L131 HydrophobicContact CE1-CD2 4.25Å; F122-L131 HydrophobicContact CE2-CD2 4.18Å; F122-L131 HydrophobicContact CZ-CD1 4.36Å; F122-L131 HydrophobicContact CZ-CD2 3.97Å; L128-L131 HydrophobicContact CD2-CB 4.12Å; L128-L131 HydrophobicContact CD2-CD1 4.47Å; L131-L133 HydrophobicContact CD1-CD1 4.38Å; L131-L133 HydrophobicContact CD1-CG 4.2Å; L131-L133 HydrophobicContact CD2-CD1 3.89Å; L131-L133 HydrophobicContact CG-CD1 3.98Å; L131-L133 HydrophobicContact CG-CG 4.13Å; L131-L149 HydrophobicContact CD2-CD1 3.98Å; L131-L152 HydrophobicContact CB-CD1 3.82Å; L131-Y154 PolarHBondContact N-O 3.43Å; L131-L155 HydrophobicContact CB-CD1 3.97Å; L131-L155 HydrophobicContact CD2-CD1 3.91Å; L131-L155 HydrophobicContact CG-CD1 3.89Å; L131-L155 WeakPolarHBondContact O-CA 3.35Å; L131-R156 PolarHBondContact O-N 2.9Å
132	L	98.3	Very high	95.6	Very high	22 Å²	22	36.6 Å²	36.6	12%	0.115	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	113	-178.4	-46.1	-177	0	0	0	110	L107 D108 L109 Q110 T130 Y154 R156	L107-L132 PolarHBondContact O-N 3.08Å; D108-L132 HydrophobicContact CB-CB 4.48Å; D108-L132 HydrophobicContact CB-CD1 4.05Å; D108-L132 WeakPolarHBondContact OD1-CB 3.48Å; L109-L132 CarbonylContact C-O 3.5Å; L109-L132 WeakPolarHBondContact CA-O 3.1Å; L109-L132 WeakPolarHBondContact CB-O 3.08Å; L109-L132 PolarHBondContact N-O 3.26Å; Q110-L132 PolarHBondContact N-O 3.04Å; T130-L132 HydrophobicContact CG2-CD2 3.79Å; T130-L132 HydrophobicContact CG2-CG 4.13Å; L132-Y154 HydrophobicContact CD2-CD1 4.13Å; L132-Y154 HydrophobicContact CD2-CE1 4.16Å; L132-R156 HydrophobicContact CD2-CB 4.15Å; L132-R156 HydrophobicContact CD2-CG 4.08Å
133	L	98.1	Very high	95	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.201	C	C	.	.			trans	-125.6	7.2	-177.9	-75.1	166.9	0	0	0	112.5	L93 L109 I114 I117 F122 L131 N136 I138 L155 R156 I157 N160	L93-L133 HydrophobicContact CD1-CD2 4.25Å; L109-L133 HydrophobicContact CB-CD2 3.87Å; L109-L133 HydrophobicContact CD1-CD2 3.98Å; I114-L133 HydrophobicContact CD1-CD2 4.14Å; I117-L133 HydrophobicContact CD1-CD1 4.38Å; F122-L133 HydrophobicContact CZ-CD1 4.32Å; L131-L133 HydrophobicContact CD1-CD1 4.38Å; L131-L133 HydrophobicContact CD1-CG 4.2Å; L131-L133 HydrophobicContact CD2-CD1 3.89Å; L131-L133 HydrophobicContact CG-CD1 3.98Å; L131-L133 HydrophobicContact CG-CG 4.13Å; L133-N136 PolarHBondContact O-ND2 2.97Å; L133-I138 HydrophobicContact CB-CD1 4.22Å; L133-I138 HydrophobicContact CD2-CD1 4.36Å; L133-L155 HydrophobicContact CD1-CD1 4.38Å; L133-R156 CarbonylContact C-O 3.31Å; L133-R156 WeakPolarHBondContact CA-O 3.41Å; L133-R156 WeakPolarHBondContact CB-O 3.03Å; L133-R156 PolarHBondContact N-O 2.88Å; L133-I157 HydrophobicContact CB-CG2 4.08Å; L133-I157 HydrophobicContact CD1-CG2 4.34Å; L133-N160 PolarHBondContact O-ND2 3.22Å
134	Q	97.2	Very high	94.5	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.196	C	C	.	.			trans	-63	156.7	-179.4	67.7	-83.5	13	0	0	113	Q110 Q111 N136 R156 F158	Q110-Q134 WeakPolarHBondContact CA-O 3.19Å; Q110-Q134 HydrophobicContact CB-CG 3.94Å; Q110-Q134 WeakPolarHBondContact CB-O 3.49Å; Q111-Q134 PolarHBondContact N-O 2.85Å; Q134-N136 PolarHBondContact O-N 2.84Å; Q134-N136 PolarHBondContact O-ND2 3.03Å; Q134-R156 HydrophobicContact CB-CB 4.5Å; Q134-R156 PolarHBondContact N-O 2.8Å; Q134-R156 PolarHBondContact OE1-O 2.66Å; Q134-F158 WeakPolarHBondContact CA-O 3.49Å; Q134-F158 HydrophobicContact CB-CD1 4.13Å; Q134-F158 HydrophobicContact CB-CD2 4.04Å; Q134-F158 HydrophobicContact CB-CE1 4Å; Q134-F158 HydrophobicContact CB-CE2 3.87Å; Q134-F158 HydrophobicContact CB-CG 4.15Å; Q134-F158 HydrophobicContact CB-CZ 3.85Å; Q134-F158 WeakPolarHBondContact CB-O 3.42Å; Q134-F158 HydrophobicContact CG-CE1 4.16Å; Q134-F158 HydrophobicContact CG-CE2 4.05Å; Q134-F158 HydrophobicContact CG-CZ 3.74Å
135	H	97.1	Very high	94.5	Very high	71 Å²	71	37.3 Å²	37.3	33%	0.329	18%	0.184	S	C	.	.	S	Bend	trans	58.3	44.4	-179.1	-53.6	-71.9	0	0	0	113.5	Q111 F158 D159	Q111-H135 VanDerWaalsContact CA-O 3.28Å; Q111-H135 WeakPolarHBondContact CA-O 3.11Å; Q111-H135 HydrophobicContact CB-CB 4.48Å; Q111-H135 HydrophobicContact CG-CB 3.71Å; Q111-H135 PolarHBondContact N-O 3.04Å; H135-F158 PolarHBondContact N-O 3.26Å; H135-F158 AromaticContact NE2-CE2 3.86Å; H135-D159 VanDerWaalsContact CA-O 3.22Å; H135-D159 WeakPolarHBondContact CA-O 2.94Å; H135-D159 IonicContact CE1-OD2 3.93Å; H135-D159 PolarHBondContact CE1-OD2 3.28Å; H135-D159 PolarHBondContact N-O 2.88Å; H135-D159 WeakPolarHBondContact ND1-CB 3.39Å; H135-D159 IonicContact ND1-OD2 2.74Å; H135-D159 PolarHBondContact ND1-OD2 2.81Å; H135-D159 IonicContact NE2-OD2 2.82Å
136	N	97.9	Very high	94.3	Very high	6 Å²	6	38.3 Å²	38.3	3%	0.032	19%	0.189	C	C	.	.	S	Bend	trans	-114.4	-162.9	173.8	-86.4	-72.8	0	0	0	110.4	L109 N112 V113 I114 L133 Q134 I138 N160	L109-N136 PolarHBondContact O-ND2 3.14Å; N112-N136 VanDerWaalsContact CA-OD1 3.23Å; N112-N136 WeakPolarHBondContact CA-OD1 3.22Å; N112-N136 WeakPolarHBondContact CB-OD1 3.49Å; N112-N136 PolarHBondContact N-OD1 3.09Å; N112-N136 PolarHBondContact O-OD1 3.33Å; V113-N136 PolarHBondContact N-OD1 2.96Å; I114-N136 HydrophobicContact CB-CB 4.22Å; I114-N136 WeakPolarHBondContact CB-OD1 3.48Å; I114-N136 WeakPolarHBondContact CG1-OD1 3.5Å; I114-N136 PolarHBondContact N-OD1 3.02Å; L133-N136 PolarHBondContact O-ND2 2.97Å; Q134-N136 PolarHBondContact O-N 2.84Å; Q134-N136 PolarHBondContact O-ND2 3.03Å; N136-I138 HydrophobicContact CB-CD1 4.23Å; N136-I138 HydrophobicContact CB-CG1 4.19Å; N136-N160 WeakPolarHBondContact CA-OD1 3.02Å; N136-N160 WeakPolarHBondContact CB-OD1 3.4Å; N136-N160 PolarHBondContact N-OD1 3.43Å; N136-N160 PolarHBondContact O-OD1 3.28Å
137	R	95.6	Very high	94	Very high	162 Å²	162	41.9 Å²	41.9	61%	0.611	20%	0.204	S	C	*	.			trans	-116.7	23.8	179.8	-60.9	-61.8	-171.2	171.7	1.2	112.4	I114 R139 N160	I114-R137 CarbonylContact O-C 3.58Å; I114-R137 WeakPolarHBondContact O-CA 3.38Å; I114-R137 WeakPolarHBondContact O-CB 3.5Å; I114-R137 PolarHBondContact O-N 2.99Å; R137-R139 PolarHBondContact O-N 3.11Å; R137-N160 PolarHBondContact N-OD1 3.18Å
138	I	96.3	Very high	93.7	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.196	C	C	.	.			trans	-69.8	123.9	-177.1	-54.8	162.5	0	0	0	108.9	I114 I117 L133 N136 S140 N160 P161 W162	I114-I138 HydrophobicContact CG2-CG1 4.18Å; I114-I138 PolarHBondContact O-N 3.03Å; I114-I138 VanDerWaalsContact O-N 3.11Å; I117-I138 HydrophobicContact CD1-CD1 3.83Å; I117-I138 HydrophobicContact CD1-CG1 4.3Å; L133-I138 HydrophobicContact CB-CD1 4.22Å; L133-I138 HydrophobicContact CD2-CD1 4.36Å; N136-I138 HydrophobicContact CB-CD1 4.23Å; N136-I138 HydrophobicContact CB-CG1 4.19Å; I138-S140 WeakPolarHBondContact CG2-O 3.11Å; I138-N160 HydrophobicContact CB-CB 4.25Å; I138-N160 WeakPolarHBondContact CB-OD1 3.21Å; I138-N160 WeakPolarHBondContact CG1-OD1 3.45Å; I138-N160 PolarHBondContact N-OD1 2.74Å; I138-P161 CarbonylContact O-C 3.43Å; I138-P161 VanDerWaalsContact O-CD 3.23Å; I138-P161 WeakPolarHBondContact O-CD 3.48Å; I138-W162 HydrophobicContact CB-CH2 4.13Å; I138-W162 HydrophobicContact CB-CZ2 4.3Å; I138-W162 HydrophobicContact CG2-CE3 4.46Å; I138-W162 HydrophobicContact CG2-CH2 3.4Å; I138-W162 VanDerWaalsContact CG2-CH2 3.4Å; I138-W162 HydrophobicContact CG2-CZ2 4.06Å; I138-W162 HydrophobicContact CG2-CZ3 3.65Å
139	R	91.8	Very high	93.6	Very high	141 Å²	141	40 Å²	40	53%	0.532	20%	0.198	S	C	.	.			trans	-96.8	-38	177.1	-69.6	-176.1	175.2	-116.8	7.1	112.4	R137 P161 W162 S163 E191	R137-R139 PolarHBondContact O-N 3.11Å; R139-P161 WeakPolarHBondContact CA-O 3.39Å; R139-P161 HydrophobicContact CG-CG 4.15Å; R139-W162 CarbonylContact O-C 3.47Å; R139-W162 WeakPolarHBondContact O-CA 3.39Å; R139-S163 WeakPolarHBondContact O-CB 3.4Å; R139-S163 PolarHBondContact O-N 3.25Å; R139-E191 IonicContact NH1-OE1 2.72Å; R139-E191 PolarHBondContact NH1-OE1 3.4Å; R139-E191 IonicContact NH1-OE2 3.18Å; R139-E191 PolarHBondContact NH1-OE2 3.45Å
140	S	91.1	Very high	93.3	Very high	48 Å²	48	42.5 Å²	42.5	34%	0.336	22%	0.215	S	C	.	.			trans	-148.7	154.8	178.8	-161.6	0	0	0	0	109.4	I138	I138-S140 WeakPolarHBondContact CG2-O 3.11Å
141	A	91.1	Very high	93.2	Very high	16 Å²	16	47.6 Å²	47.6	13%	0.132	23%	0.231	C	C	.	.			trans	-156.7	154.6	170.9	0	0	0	0	0	107.3	W162 L171	A141-W162 HydrophobicContact CB-CH2 4.12Å; A141-W162 HydrophobicContact CB-CZ3 4.04Å; A141-L171 HydrophobicContact CB-CD2 4.08Å; A141-L171 VanDerWaalsContact O-CB 3.23Å; A141-L171 WeakPolarHBondContact O-CB 3.27Å
142	S	88.3	Confident	93.1	Very high	21 Å²	21	48.4 Å²	48.4	15%	0.147	24%	0.235	C	C	.	.			trans	-113.6	175.9	-179.5	66	0	0	0	0	110.5	E144 S170	S142-E144 VanDerWaalsContact C-N 3.27Å; S142-E144 WeakPolarHBondContact CB-OE2 3.35Å; S142-E144 PolarHBondContact O-N 3.4Å; S142-E144 PolarHBondContact OG-OE2 3Å; S142-S170 WeakPolarHBondContact CA-OG 3.44Å
143	E	85.1	Confident	92.9	Very high	42 Å²	42	51.3 Å²	51.3	20%	0.196	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-68.2	-24.7	-179.7	71.1	-175.5	166.9	0	0	113.7	V145 L146 L147 S170 T174	E143-V145 PolarHBondContact O-N 2.74Å; E143-L146 WeakPolarHBondContact O-CA 3.28Å; E143-L146 WeakPolarHBondContact O-CB 3.39Å; E143-L146 PolarHBondContact O-N 2.7Å; E143-L147 PolarHBondContact O-N 3.14Å; E143-S170 PolarHBondContact N-OG 2.87Å; E143-T174 VanDerWaalsContact CB-OG1 3.26Å; E143-T174 WeakPolarHBondContact CB-OG1 3.45Å
144	E	85.4	Confident	92.8	Very high	27 Å²	27	54.6 Å²	54.6	13%	0.126	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-53.8	-39.1	178.8	-67.4	92.4	143.3	0	0	111.6	S142 L146 L147 P148 K282 L306	S142-E144 VanDerWaalsContact C-N 3.27Å; S142-E144 WeakPolarHBondContact CB-OE2 3.35Å; S142-E144 PolarHBondContact O-N 3.4Å; S142-E144 PolarHBondContact OG-OE2 3Å; E144-L146 PolarHBondContact O-N 3.47Å; E144-L146 VanDerWaalsContact O-N 3.1Å; E144-L147 HydrophobicContact CB-CD1 4.5Å; E144-L147 HydrophobicContact CG-CD1 4.39Å; E144-L147 PolarHBondContact O-N 3.34Å; E144-L147 VanDerWaalsContact O-N 3.11Å; E144-P148 VanDerWaalsContact O-CD 3.23Å; E144-P148 WeakPolarHBondContact O-CD 3.04Å; E144-K282 IonicContact OE1-NZ 3.18Å; E144-L306 WeakPolarHBondContact OE1-CD1 3.39Å
145	V	90.6	Very high	92.8	Very high	8 Å²	8	54.8 Å²	54.8	5%	0.048	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-60.2	-23.9	177.2	178.6	0	0	0	0	112.5	I117 F122 E143	I117-V145 HydrophobicContact CG2-CG1 3.69Å; I117-V145 HydrophobicContact CG2-CG2 4.08Å; F122-V145 HydrophobicContact CD2-CG1 3.55Å; F122-V145 WeakPolarHBondContact CD2-O 3.49Å; F122-V145 HydrophobicContact CE2-CG1 3.37Å; E143-V145 PolarHBondContact O-N 2.74Å
146	L	92.2	Very high	92.7	Very high	22 Å²	22	55.7 Å²	55.7	12%	0.115	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-100.4	-14.7	179.9	-58.1	-178.8	0	0	0	113.4	E143 E144 L149 L152 L155 L171 T174	E143-L146 WeakPolarHBondContact O-CA 3.28Å; E143-L146 WeakPolarHBondContact O-CB 3.39Å; E143-L146 PolarHBondContact O-N 2.7Å; E144-L146 PolarHBondContact O-N 3.47Å; E144-L146 VanDerWaalsContact O-N 3.1Å; L146-L149 HydrophobicContact CD2-CD1 4.31Å; L146-L149 WeakPolarHBondContact O-CB 3.34Å; L146-L149 PolarHBondContact O-N 2.92Å; L146-L152 HydrophobicContact CD2-CD2 3.92Å; L146-L155 HydrophobicContact CD1-CD2 4.11Å; L146-L155 HydrophobicContact CD2-CD2 3.99Å; L146-L171 HydrophobicContact CD1-CD1 3.79Å; L146-T174 HydrophobicContact CD1-CG2 4.04Å
147	L	89	Confident	92.7	Very high	125 Å²	125	55.7 Å²	55.7	65%	0.654	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-39.9	-179.5	-65.9	177.5	0	0	0	113.5	E143 E144 L149	E143-L147 PolarHBondContact O-N 3.14Å; E144-L147 HydrophobicContact CB-CD1 4.5Å; E144-L147 HydrophobicContact CG-CD1 4.39Å; E144-L147 PolarHBondContact O-N 3.34Å; E144-L147 VanDerWaalsContact O-N 3.11Å; L147-L149 PolarHBondContact O-N 3.09Å
148	P	91.7	Very high	92.7	Very high	31 Å²	31	49.9 Å²	49.9	20%	0.201	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.2	176.9	-22.4	34.6	0	0	0	114.9	E144 P150	E144-P148 VanDerWaalsContact O-CD 3.23Å; E144-P148 WeakPolarHBondContact O-CD 3.04Å; P148-P150 WeakPolarHBondContact O-CD 3.13Å
149	L	94.9	Very high	92.6	Very high	7 Å²	7	54.6 Å²	54.6	4%	0.037	27%	0.272	C	S	.	.			trans	-115.7	61.8	-169.2	-53.4	178.7	0	0	0	112.7	F122 L125 L128 L131 L146 L147 R151 L152	F122-L149 HydrophobicContact CB-CD1 4.26Å; F122-L149 HydrophobicContact CB-CD2 4.02Å; F122-L149 HydrophobicContact CB-CG 4.25Å; F122-L149 HydrophobicContact CD2-CD1 4.48Å; F122-L149 HydrophobicContact CG-CD1 4.38Å; L125-L149 HydrophobicContact CB-CD2 3.58Å; L125-L149 HydrophobicContact CD1-CD2 4.46Å; L128-L149 HydrophobicContact CB-CD2 4.05Å; L128-L149 HydrophobicContact CD2-CD1 4.27Å; L128-L149 HydrophobicContact CD2-CD2 3.87Å; L131-L149 HydrophobicContact CD2-CD1 3.98Å; L146-L149 HydrophobicContact CD2-CD1 4.31Å; L146-L149 WeakPolarHBondContact O-CB 3.34Å; L146-L149 PolarHBondContact O-N 2.92Å; L147-L149 PolarHBondContact O-N 3.09Å; L149-R151 PolarHBondContact O-N 3.41Å; L149-R151 VanDerWaalsContact O-N 3.08Å; L149-L152 HydrophobicContact CB-CB 4Å; L149-L152 HydrophobicContact CB-CD2 4.44Å; L149-L152 HydrophobicContact CD1-CD2 4.09Å; L149-L152 WeakPolarHBondContact O-CB 3.25Å; L149-L152 PolarHBondContact O-N 3.05Å; L149-L152 VanDerWaalsContact O-N 3.12Å
150	P	91.9	Very high	92.9	Very high	102 Å²	102	48.3 Å²	48.3	66%	0.662	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-17	-172.5	28.7	-37.4	0	0	0	114.4	P148	P148-P150 WeakPolarHBondContact O-CD 3.13Å
151	R	95.6	Very high	93.2	Very high	139 Å²	139	47.6 Å²	47.6	53%	0.525	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	7.4	179.4	-72	-168.4	159.6	90.5	3.1	113.8	L128 L149 T153	L128-R151 CarbonylContact O-C 3.07Å; L128-R151 VanDerWaalsContact O-C 3.22Å; L149-R151 PolarHBondContact O-N 3.41Å; L149-R151 VanDerWaalsContact O-N 3.08Å; R151-T153 PolarHBondContact O-N 3.35Å; R151-T153 VanDerWaalsContact O-N 3.17Å
152	L	96.5	Very high	93.4	Very high	18 Å²	18	47 Å²	47	9%	0.094	24%	0.238	C	C	.	.			trans	-66.1	118.2	-175.9	-168.5	68.7	0	0	0	110.7	L128 L131 L146 L149 L155 L183	L128-L152 HydrophobicContact CD2-CD1 4.48Å; L128-L152 WeakPolarHBondContact O-CA 3.35Å; L128-L152 PolarHBondContact O-N 3.3Å; L131-L152 HydrophobicContact CB-CD1 3.82Å; L146-L152 HydrophobicContact CD2-CD2 3.92Å; L149-L152 HydrophobicContact CB-CB 4Å; L149-L152 HydrophobicContact CB-CD2 4.44Å; L149-L152 HydrophobicContact CD1-CD2 4.09Å; L149-L152 WeakPolarHBondContact O-CB 3.25Å; L149-L152 PolarHBondContact O-N 3.05Å; L149-L152 VanDerWaalsContact O-N 3.12Å; L152-L155 HydrophobicContact CD2-CB 4.14Å; L152-L155 HydrophobicContact CD2-CD2 4.46Å; L152-L183 HydrophobicContact CD2-CD2 4.31Å; L152-L183 HydrophobicContact CG-CD2 4.13Å
153	T	93.2	Very high	93.7	Very high	83 Å²	83	46.7 Å²	46.7	51%	0.509	24%	0.236	S	C	.	.			trans	-112.8	-21	179.1	57.3	0	0	0	0	112.2	T129 R151 N182	T129-T153 PolarHBondContact O-N 3.1Å; T129-T153 PolarHBondContact O-OG1 2.94Å; R151-T153 PolarHBondContact O-N 3.35Å; R151-T153 VanDerWaalsContact O-N 3.17Å; T153-N182 WeakPolarHBondContact O-CB 3.5Å
154	Y	95.6	Very high	94.2	Very high	76 Å²	76	44.8 Å²	44.8	30%	0.298	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	112.4	-175.6	-160.5	-101.1	0	0	0	111.5	T129 T130 L131 L132 R156 N182	T129-Y154 PolarHBondContact O-N 3.25Å; T130-Y154 WeakPolarHBondContact CA-O 3.43Å; T130-Y154 HydrophobicContact CG2-CD1 4.11Å; L131-Y154 PolarHBondContact N-O 3.43Å; L132-Y154 HydrophobicContact CD2-CD1 4.13Å; L132-Y154 HydrophobicContact CD2-CE1 4.16Å; Y154-R156 HydrophobicContact CD1-CG 4.36Å; Y154-R156 HydrophobicContact CE1-CG 3.65Å; Y154-R156 VanDerWaalsContact CE1-NE 3.3Å; Y154-R156 VanDerWaalsContact OH-CZ 3.27Å; Y154-R156 PolarHBondContact OH-NE 3.23Å; Y154-R156 PolarHBondContact OH-NH2 2.75Å; Y154-N182 HydrophobicContact CD2-CB 4.29Å
155	L	97.1	Very high	94.3	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.7	178.2	174.3	64.3	0	0	0	110.1	L131 L133 L146 L152 I157 L175 L183 G184	L131-L155 HydrophobicContact CB-CD1 3.97Å; L131-L155 HydrophobicContact CD2-CD1 3.91Å; L131-L155 HydrophobicContact CG-CD1 3.89Å; L131-L155 WeakPolarHBondContact O-CA 3.35Å; L133-L155 HydrophobicContact CD1-CD1 4.38Å; L146-L155 HydrophobicContact CD1-CD2 4.11Å; L146-L155 HydrophobicContact CD2-CD2 3.99Å; L152-L155 HydrophobicContact CD2-CB 4.14Å; L152-L155 HydrophobicContact CD2-CD2 4.46Å; L155-I157 HydrophobicContact CD1-CG2 3.81Å; L155-I157 HydrophobicContact CD2-CG2 4.27Å; L155-I157 HydrophobicContact CG-CG2 3.93Å; L155-L175 HydrophobicContact CD2-CD2 4.27Å; L155-L183 HydrophobicContact CB-CB 4Å; L155-L183 HydrophobicContact CB-CD2 3.64Å; L155-L183 HydrophobicContact CB-CG 4.32Å; L155-L183 HydrophobicContact CD2-CB 4.38Å; L155-G184 PolarHBondContact O-N 3.17Å
156	R	96	Very high	94	Very high	91 Å²	91	49 Å²	49	34%	0.343	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.6	172.3	-73.3	-171.7	178.1	172.3	7.9	110.8	L131 L132 L133 Q134 Y154 F158	L131-R156 PolarHBondContact O-N 2.9Å; L132-R156 HydrophobicContact CD2-CB 4.15Å; L132-R156 HydrophobicContact CD2-CG 4.08Å; L133-R156 CarbonylContact C-O 3.31Å; L133-R156 WeakPolarHBondContact CA-O 3.41Å; L133-R156 WeakPolarHBondContact CB-O 3.03Å; L133-R156 PolarHBondContact N-O 2.88Å; Q134-R156 HydrophobicContact CB-CB 4.5Å; Q134-R156 PolarHBondContact N-O 2.8Å; Q134-R156 PolarHBondContact OE1-O 2.66Å; Y154-R156 HydrophobicContact CD1-CG 4.36Å; Y154-R156 HydrophobicContact CE1-CG 3.65Å; Y154-R156 VanDerWaalsContact CE1-NE 3.3Å; Y154-R156 VanDerWaalsContact OH-CZ 3.27Å; Y154-R156 PolarHBondContact OH-NE 3.23Å; Y154-R156 PolarHBondContact OH-NH2 2.75Å; R156-F158 HydrophobicContact CB-CD1 4.39Å; R156-F158 HydrophobicContact CB-CE1 4.19Å; R156-F158 HydrophobicContact CG-CE1 4.11Å
157	I	96.8	Very high	93.6	Very high	6 Å²	6	50.4 Å²	50.4	3%	0.031	25%	0.254	C	S	.	.			trans	-132.5	8.5	-179	49.2	152	0	0	0	113.1	L133 L155 N160 W162 L171 L175 A187 L200	L133-I157 HydrophobicContact CB-CG2 4.08Å; L133-I157 HydrophobicContact CD1-CG2 4.34Å; L155-I157 HydrophobicContact CD1-CG2 3.81Å; L155-I157 HydrophobicContact CD2-CG2 4.27Å; L155-I157 HydrophobicContact CG-CG2 3.93Å; I157-N160 PolarHBondContact O-ND2 2.83Å; I157-W162 HydrophobicContact CB-CZ2 3.76Å; I157-W162 HydrophobicContact CD1-CZ2 3.97Å; I157-W162 HydrophobicContact CG1-CZ2 4.45Å; I157-W162 HydrophobicContact CG2-CZ2 4.19Å; I157-W162 PolarHBondContact O-NE1 2.83Å; I157-L171 HydrophobicContact CD1-CD2 4.5Å; I157-L175 HydrophobicContact CD1-CD1 3.85Å; I157-A187 HydrophobicContact CD1-CB 3.91Å; I157-A187 HydrophobicContact CG1-CB 3.95Å; I157-L200 HydrophobicContact CD1-CD1 4.16Å
158	F	96.1	Very high	93.7	Very high	39 Å²	39	44.5 Å²	44.5	17%	0.171	22%	0.222	C	C	.	.			trans	-66.1	166.6	177.2	67.5	-96.5	0	0	0	112	Q134 H135 R156 N160	Q134-F158 WeakPolarHBondContact CA-O 3.49Å; Q134-F158 HydrophobicContact CB-CD1 4.13Å; Q134-F158 HydrophobicContact CB-CD2 4.04Å; Q134-F158 HydrophobicContact CB-CE1 4Å; Q134-F158 HydrophobicContact CB-CE2 3.87Å; Q134-F158 HydrophobicContact CB-CG 4.15Å; Q134-F158 HydrophobicContact CB-CZ 3.85Å; Q134-F158 WeakPolarHBondContact CB-O 3.42Å; Q134-F158 HydrophobicContact CG-CE1 4.16Å; Q134-F158 HydrophobicContact CG-CE2 4.05Å; Q134-F158 HydrophobicContact CG-CZ 3.74Å; H135-F158 PolarHBondContact N-O 3.26Å; H135-F158 AromaticContact NE2-CE2 3.86Å; R156-F158 HydrophobicContact CB-CD1 4.39Å; R156-F158 HydrophobicContact CB-CE1 4.19Å; R156-F158 HydrophobicContact CG-CE1 4.11Å; F158-N160 PolarHBondContact O-N 3.46Å; F158-N160 PolarHBondContact O-ND2 2.8Å
159	D	95.6	Very high	93.4	Very high	100 Å²	100	43.2 Å²	43.2	54%	0.535	21%	0.214	S	C	.	.	S	Bend	trans	53.1	41	-176.5	-66.6	-5.5	0	0	0	113.8	H135	H135-D159 VanDerWaalsContact CA-O 3.22Å; H135-D159 WeakPolarHBondContact CA-O 2.94Å; H135-D159 IonicContact CE1-OD2 3.93Å; H135-D159 PolarHBondContact CE1-OD2 3.28Å; H135-D159 PolarHBondContact N-O 2.88Å; H135-D159 WeakPolarHBondContact ND1-CB 3.39Å; H135-D159 IonicContact ND1-OD2 2.74Å; H135-D159 PolarHBondContact ND1-OD2 2.81Å; H135-D159 IonicContact NE2-OD2 2.82Å
160	N	97.7	Very high	93.1	Very high	9 Å²	9	42.9 Å²	42.9	5%	0.048	21%	0.212	C	C	.	.	S	Bend	trans	-114.6	149.5	163.7	-84.3	-78.8	0	0	0	108.9	L133 N136 R137 I138 I157 F158 W162	L133-N160 PolarHBondContact O-ND2 3.22Å; N136-N160 WeakPolarHBondContact CA-OD1 3.02Å; N136-N160 WeakPolarHBondContact CB-OD1 3.4Å; N136-N160 PolarHBondContact N-OD1 3.43Å; N136-N160 PolarHBondContact O-OD1 3.28Å; R137-N160 PolarHBondContact N-OD1 3.18Å; I138-N160 HydrophobicContact CB-CB 4.25Å; I138-N160 WeakPolarHBondContact CB-OD1 3.21Å; I138-N160 WeakPolarHBondContact CG1-OD1 3.45Å; I138-N160 PolarHBondContact N-OD1 2.74Å; I157-N160 PolarHBondContact O-ND2 2.83Å; F158-N160 PolarHBondContact O-N 3.46Å; F158-N160 PolarHBondContact O-ND2 2.8Å; N160-W162 HydrophobicContact CB-CD2 4.42Å; N160-W162 HydrophobicContact CB-CG 4.45Å; N160-W162 HydrophobicContact CB-CZ2 4.09Å; N160-W162 PolarHBondContact O-N 3.23Å
161	P	96.1	Very high	93.2	Very high	33 Å²	33	38.3 Å²	38.3	21%	0.214	18%	0.182	C	C	.	.			trans	-75.3	58.5	179.9	34.1	-38.1	0	0	0	112.6	I138 R139 S163 A190	I138-P161 CarbonylContact O-C 3.43Å; I138-P161 VanDerWaalsContact O-CD 3.23Å; I138-P161 WeakPolarHBondContact O-CD 3.48Å; R139-P161 WeakPolarHBondContact CA-O 3.39Å; R139-P161 HydrophobicContact CG-CG 4.15Å; P161-S163 PolarHBondContact O-N 2.02Å; P161-A190 HydrophobicContact CB-CB 4.19Å
162	W	96.8	Very high	93.1	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.011	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	121.9	-176.4	-67.4	107.1	0	0	0	112.3	I138 R139 A141 I157 N160 C164 L168 L171 A190 E191 L200	I138-W162 HydrophobicContact CB-CH2 4.13Å; I138-W162 HydrophobicContact CB-CZ2 4.3Å; I138-W162 HydrophobicContact CG2-CE3 4.46Å; I138-W162 HydrophobicContact CG2-CH2 3.4Å; I138-W162 VanDerWaalsContact CG2-CH2 3.4Å; I138-W162 HydrophobicContact CG2-CZ2 4.06Å; I138-W162 HydrophobicContact CG2-CZ3 3.65Å; R139-W162 CarbonylContact O-C 3.47Å; R139-W162 WeakPolarHBondContact O-CA 3.39Å; A141-W162 HydrophobicContact CB-CH2 4.12Å; A141-W162 HydrophobicContact CB-CZ3 4.04Å; I157-W162 HydrophobicContact CB-CZ2 3.76Å; I157-W162 HydrophobicContact CD1-CZ2 3.97Å; I157-W162 HydrophobicContact CG1-CZ2 4.45Å; I157-W162 HydrophobicContact CG2-CZ2 4.19Å; I157-W162 PolarHBondContact O-NE1 2.83Å; N160-W162 HydrophobicContact CB-CD2 4.42Å; N160-W162 HydrophobicContact CB-CG 4.45Å; N160-W162 HydrophobicContact CB-CZ2 4.09Å; N160-W162 PolarHBondContact O-N 3.23Å; W162-C164 PolarHBondContact O-N 3.44Å; W162-L168 HydrophobicContact CB-CD2 4.39Å; W162-L168 HydrophobicContact CE3-CD1 3.51Å; W162-L168 HydrophobicContact CE3-CD2 4.38Å; W162-L168 HydrophobicContact CZ3-CD1 3.74Å; W162-L171 HydrophobicContact CH2-CD2 3.99Å; W162-L171 HydrophobicContact CZ3-CD2 3.87Å; W162-A190 PolarHBondContact O-N 2.82Å; W162-E191 PolarHBondContact O-N 2.63Å; W162-L200 HydrophobicContact CB-CD2 4.31Å; W162-L200 HydrophobicContact CD2-CD1 4.06Å; W162-L200 HydrophobicContact CG-CD1 3.98Å
163	S	94.2	Very high	92.7	Very high	15 Å²	15	34.8 Å²	34.8	11%	0.105	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	94.9	171.4	-160	0	0	0	0	108.8	R139 P161 R165 E191	R139-S163 WeakPolarHBondContact O-CB 3.4Å; R139-S163 PolarHBondContact O-N 3.25Å; P161-S163 PolarHBondContact O-N 2.02Å; S163-R165 PolarHBondContact O-N 3.45Å; S163-E191 WeakPolarHBondContact CB-OE1 2.96Å; S163-E191 WeakPolarHBondContact OG-CG 3.37Å; S163-E191 PolarHBondContact OG-OE1 2.87Å
164	C	94.4	Very high	92.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.014	15%	0.15	C	C	.	.			trans	-77.4	64.7	179.4	-69.1	0	0	0	0	110.9	W162 L168 C189 E191 P192 L195 L200 L203 L208	W162-C164 PolarHBondContact O-N 3.44Å; C164-L168 HydrophobicContact CB-CD2 4.37Å; C164-C189 HydrophobicContact CB-CB 3.73Å; C164-C189 WeakPolarHBondContact CB-SG 3.15Å; C164-C189 WeakPolarHBondContact SG-CA 3.21Å; C164-C189 WeakPolarHBondContact SG-CB 3.34Å; C164-C189 CovalentContact SG-SG 2.01Å; C164-C189 PolarHBondContact SG-SG 3.49Å; C164-E191 WeakPolarHBondContact CB-O 3.38Å; C164-E191 PolarHBondContact N-O 2.99Å; C164-P192 WeakPolarHBondContact O-CD 3.41Å; C164-L195 HydrophobicContact CB-CB 4.28Å; C164-L195 HydrophobicContact CB-CD1 3.96Å; C164-L195 WeakPolarHBondContact O-CD1 3.48Å; C164-L200 WeakPolarHBondContact SG-CD2 3.48Å; C164-L203 HydrophobicContact CB-CD1 4.14Å; C164-L203 VanDerWaalsContact SG-CD1 3.57Å; C164-L208 HydrophobicContact CB-CD2 3.68Å
165	R	88.5	Confident	92.3	Very high	109 Å²	109	28.4 Å²	28.4	41%	0.411	14%	0.136	S	C	.	.	S	Bend	trans	-109.5	-179.5	169.9	-64.6	-178.7	171.8	-152.2	-6.8	108.7	S163 P167 L168 L208 E216	S163-R165 PolarHBondContact O-N 3.45Å; R165-P167 VanDerWaalsContact C-N 3.34Å; R165-L168 WeakPolarHBondContact O-CB 3.23Å; R165-L168 PolarHBondContact O-N 2.83Å; R165-L168 VanDerWaalsContact O-N 3.09Å; R165-L208 CarbonylContact C-O 3.52Å; R165-L208 VanDerWaalsContact C-O 3.27Å; R165-L208 WeakPolarHBondContact CA-O 3.45Å; R165-E216 IonicContact CZ-OE1 3.5Å; R165-E216 VanDerWaalsContact CZ-OE1 3.27Å; R165-E216 IonicContact NH1-OE1 3.7Å; R165-E216 PolarHBondContact NH1-OE1 2.99Å; R165-E216 IonicContact NH2-OE1 3.25Å; R165-E216 PolarHBondContact NH2-OE1 2.91Å
166	C	83.4	Confident	92	Very high	15 Å²	15	32 Å²	32	10%	0.101	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-53.6	-37.7	-176	-155.7	0	0	0	0	115.6	L168 D169 L208 C209 K285	C166-L168 PolarHBondContact O-N 3.2Å; C166-D169 VanDerWaalsContact O-CB 3.29Å; C166-D169 WeakPolarHBondContact O-CB 2.92Å; C166-D169 PolarHBondContact O-N 2.95Å; C166-L208 PolarHBondContact N-O 3.45Å; C166-C209 WeakPolarHBondContact CA-SG 3.48Å; C166-C209 HydrophobicContact CB-CB 3.83Å; C166-C209 WeakPolarHBondContact CB-SG 3.26Å; C166-C209 WeakPolarHBondContact SG-CB 3.36Å; C166-C209 CovalentContact SG-SG 2.05Å; C166-C209 PolarHBondContact SG-SG 3.33Å; C166-K285 PolarHBondContact SG-NZ 3.28Å; C166-K285 VanDerWaalsContact SG-NZ 3.37Å
167	P	85	Confident	91.5	Very high	52 Å²	52	30.7 Å²	30.7	34%	0.338	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-62.5	-15	178.8	-26.2	36.5	0	0	0	115.4	R165 D169	R165-P167 VanDerWaalsContact C-N 3.34Å; P167-D169 VanDerWaalsContact C-N 3.31Å
168	L	90.1	Very high	90.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-84.7	-6.1	178.4	-163	64.5	0	0	0	112.7	W162 C164 R165 C166 S170 L171 V172 L200	W162-L168 HydrophobicContact CB-CD2 4.39Å; W162-L168 HydrophobicContact CE3-CD1 3.51Å; W162-L168 HydrophobicContact CE3-CD2 4.38Å; W162-L168 HydrophobicContact CZ3-CD1 3.74Å; C164-L168 HydrophobicContact CB-CD2 4.37Å; R165-L168 WeakPolarHBondContact O-CB 3.23Å; R165-L168 PolarHBondContact O-N 2.83Å; R165-L168 VanDerWaalsContact O-N 3.09Å; C166-L168 PolarHBondContact O-N 3.2Å; L168-S170 PolarHBondContact O-N 3.48Å; L168-L171 HydrophobicContact CD1-CD2 3.87Å; L168-V172 HydrophobicContact CD2-CG2 4.36Å; L168-V172 HydrophobicContact CG-CG2 4.07Å; L168-V172 WeakPolarHBondContact O-CG2 3.47Å; L168-V172 PolarHBondContact O-N 3.14Å; L168-L200 HydrophobicContact CD2-CD1 4.4Å; L168-L200 HydrophobicContact CD2-CD2 3.84Å
169	D	86.3	Confident	90	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-46.8	-172	-173.9	52.6	0	0	0	112.9	C166 P167 L171 V172 R173 A205 L208 Y307	C166-D169 VanDerWaalsContact O-CB 3.29Å; C166-D169 WeakPolarHBondContact O-CB 2.92Å; C166-D169 PolarHBondContact O-N 2.95Å; P167-D169 VanDerWaalsContact C-N 3.31Å; D169-L171 PolarHBondContact O-N 3.19Å; D169-V172 PolarHBondContact O-N 3.17Å; D169-R173 VanDerWaalsContact CG-NE 3.33Å; D169-R173 WeakPolarHBondContact O-CG 3.36Å; D169-R173 PolarHBondContact O-N 3.09Å; D169-R173 IonicContact OD1-NE 2.73Å; D169-R173 PolarHBondContact OD1-NE 2.54Å; D169-R173 IonicContact OD2-CZ 3.29Å; D169-R173 IonicContact OD2-NE 2.77Å; D169-R173 PolarHBondContact OD2-NE 3.44Å; D169-R173 IonicContact OD2-NH2 3.5Å; D169-R173 PolarHBondContact OD2-NH2 3.48Å; D169-A205 WeakPolarHBondContact OD1-CA 3.23Å; D169-A205 WeakPolarHBondContact OD1-CB 3.26Å; D169-L208 HydrophobicContact CB-CD1 4.17Å; D169-Y307 HydrophobicContact CB-CE1 4.29Å
170	S	88.6	Confident	89.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-47	-176.6	76.5	0	0	0	0	111.5	S142 E143 L168 V172 R173 T174 Y307	S142-S170 WeakPolarHBondContact CA-OG 3.44Å; E143-S170 PolarHBondContact N-OG 2.87Å; L168-S170 PolarHBondContact O-N 3.48Å; S170-V172 VanDerWaalsContact C-N 3.34Å; S170-V172 PolarHBondContact O-N 3.27Å; S170-R173 WeakPolarHBondContact O-CB 3.5Å; S170-R173 PolarHBondContact O-N 3.19Å; S170-R173 VanDerWaalsContact O-N 3.14Å; S170-T174 PolarHBondContact O-N 2.98Å; S170-T174 PolarHBondContact O-OG1 3Å; S170-Y307 WeakPolarHBondContact CB-OH 3.46Å; S170-Y307 PolarHBondContact OG-OH 3.01Å; S170-Y307 VanDerWaalsContact OG-OH 3.13Å
171	L	92.8	Very high	88.8	Confident	6 Å²	6	43 Å²	43	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-57.3	-46.7	174.4	179.7	68.9	0	0	0	111.4	A141 L146 I157 W162 L168 D169 R173 T174 L175	A141-L171 HydrophobicContact CB-CD2 4.08Å; A141-L171 VanDerWaalsContact O-CB 3.23Å; A141-L171 WeakPolarHBondContact O-CB 3.27Å; L146-L171 HydrophobicContact CD1-CD1 3.79Å; I157-L171 HydrophobicContact CD1-CD2 4.5Å; W162-L171 HydrophobicContact CH2-CD2 3.99Å; W162-L171 HydrophobicContact CZ3-CD2 3.87Å; L168-L171 HydrophobicContact CD1-CD2 3.87Å; D169-L171 PolarHBondContact O-N 3.19Å; L171-R173 VanDerWaalsContact C-N 3.28Å; L171-R173 PolarHBondContact O-N 3.11Å; L171-T174 WeakPolarHBondContact O-CB 3.44Å; L171-T174 PolarHBondContact O-N 3.05Å; L171-L175 HydrophobicContact CD1-CG 4.47Å; L171-L175 HydrophobicContact CG-CD1 4.2Å; L171-L175 HydrophobicContact CG-CG 4.43Å; L171-L175 VanDerWaalsContact O-CG 3.22Å; L171-L175 WeakPolarHBondContact O-CG 3.49Å; L171-L175 PolarHBondContact O-N 3.01Å
172	V	93.9	Very high	88.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.8	-42.7	178.9	165.2	0	0	0	0	111.3	L168 D169 S170 L175 Q176 L200 L203 L208	L168-V172 HydrophobicContact CD2-CG2 4.36Å; L168-V172 HydrophobicContact CG-CG2 4.07Å; L168-V172 WeakPolarHBondContact O-CG2 3.47Å; L168-V172 PolarHBondContact O-N 3.14Å; D169-V172 PolarHBondContact O-N 3.17Å; S170-V172 VanDerWaalsContact C-N 3.34Å; S170-V172 PolarHBondContact O-N 3.27Å; V172-L175 WeakPolarHBondContact O-CB 3.45Å; V172-L175 PolarHBondContact O-N 3.1Å; V172-Q176 VanDerWaalsContact O-CG 3.32Å; V172-Q176 WeakPolarHBondContact O-CG 3.23Å; V172-Q176 PolarHBondContact O-N 2.84Å; V172-Q176 VanDerWaalsContact O-N 3.1Å; V172-L200 WeakPolarHBondContact CG1-O 3.39Å; V172-L200 HydrophobicContact CG2-CB 4.27Å; V172-L203 HydrophobicContact CG1-CB 4.24Å; V172-L208 HydrophobicContact CB-CD1 4.22Å; V172-L208 HydrophobicContact CG1-CD1 4.39Å; V172-L208 HydrophobicContact CG2-CD1 4.08Å
173	R	87.8	Confident	88.1	Confident	83 Å²	83	45.9 Å²	45.9	31%	0.313	24%	0.235	S	C	.	.	H	α-helix	trans	-65.2	-44	177.1	-69.6	173.5	-178.2	-107.8	16.8	111.9	D169 S170 L171 L175 Q176 V177 F331	D169-R173 VanDerWaalsContact CG-NE 3.33Å; D169-R173 WeakPolarHBondContact O-CG 3.36Å; D169-R173 PolarHBondContact O-N 3.09Å; D169-R173 IonicContact OD1-NE 2.73Å; D169-R173 PolarHBondContact OD1-NE 2.54Å; D169-R173 IonicContact OD2-CZ 3.29Å; D169-R173 IonicContact OD2-NE 2.77Å; D169-R173 PolarHBondContact OD2-NE 3.44Å; D169-R173 IonicContact OD2-NH2 3.5Å; D169-R173 PolarHBondContact OD2-NH2 3.48Å; S170-R173 WeakPolarHBondContact O-CB 3.5Å; S170-R173 PolarHBondContact O-N 3.19Å; S170-R173 VanDerWaalsContact O-N 3.14Å; L171-R173 VanDerWaalsContact C-N 3.28Å; L171-R173 PolarHBondContact O-N 3.11Å; R173-L175 PolarHBondContact O-N 2.89Å; R173-Q176 WeakPolarHBondContact O-CB 3.43Å; R173-Q176 PolarHBondContact O-N 3.48Å; R173-V177 WeakPolarHBondContact O-CG2 3.48Å; R173-V177 PolarHBondContact O-N 3.09Å; R173-F331 VanDerWaalsContact NH1-CD1 3.31Å
174	T	89.2	Confident	87.9	Confident	23 Å²	23	45.2 Å²	45.2	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-55.4	-41.7	173.4	-43.9	0	0	0	0	111	E143 L146 S170 L171 Q176 V177 N180	E143-T174 VanDerWaalsContact CB-OG1 3.26Å; E143-T174 WeakPolarHBondContact CB-OG1 3.45Å; L146-T174 HydrophobicContact CD1-CG2 4.04Å; S170-T174 PolarHBondContact O-N 2.98Å; S170-T174 PolarHBondContact O-OG1 3Å; L171-T174 WeakPolarHBondContact O-CB 3.44Å; L171-T174 PolarHBondContact O-N 3.05Å; T174-Q176 VanDerWaalsContact C-N 3.28Å; T174-Q176 PolarHBondContact O-N 3.08Å; T174-V177 PolarHBondContact O-N 3.04Å; T174-N180 WeakPolarHBondContact O-CB 3.11Å; T174-N180 PolarHBondContact O-ND2 2.94Å
175	L	91.8	Very high	87.7	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-70.6	-20.2	178.5	-62.8	176.3	0	0	0	113.9	L155 I157 L171 V172 R173 L183 L200 K201	L155-L175 HydrophobicContact CD2-CD2 4.27Å; I157-L175 HydrophobicContact CD1-CD1 3.85Å; L171-L175 HydrophobicContact CD1-CG 4.47Å; L171-L175 HydrophobicContact CG-CD1 4.2Å; L171-L175 HydrophobicContact CG-CG 4.43Å; L171-L175 VanDerWaalsContact O-CG 3.22Å; L171-L175 WeakPolarHBondContact O-CG 3.49Å; L171-L175 PolarHBondContact O-N 3.01Å; V172-L175 WeakPolarHBondContact O-CB 3.45Å; V172-L175 PolarHBondContact O-N 3.1Å; R173-L175 PolarHBondContact O-N 2.89Å; L175-L183 HydrophobicContact CD2-CB 3.62Å; L175-L200 HydrophobicContact CD1-CB 4.49Å; L175-L200 HydrophobicContact CD1-CD1 4.49Å; L175-K201 HydrophobicContact CB-CG 4.2Å; L175-K201 VanDerWaalsContact O-CE 3.24Å; L175-K201 WeakPolarHBondContact O-CE 3.47Å
176	Q	90.5	Very high	88	Confident	79 Å²	79	50.2 Å²	50.2	37%	0.369	26%	0.255	S	S	.	.	H	α-helix	trans	-87.4	-17.2	179.2	-76.2	172.8	-20.8	0	0	113.4	V172 R173 T174 K201 L203	V172-Q176 VanDerWaalsContact O-CG 3.32Å; V172-Q176 WeakPolarHBondContact O-CG 3.23Å; V172-Q176 PolarHBondContact O-N 2.84Å; V172-Q176 VanDerWaalsContact O-N 3.1Å; R173-Q176 WeakPolarHBondContact O-CB 3.43Å; R173-Q176 PolarHBondContact O-N 3.48Å; T174-Q176 VanDerWaalsContact C-N 3.28Å; T174-Q176 PolarHBondContact O-N 3.08Å; Q176-K201 WeakPolarHBondContact CG-O 3.19Å; Q176-K201 PolarHBondContact NE2-O 3.34Å; Q176-L203 PolarHBondContact NE2-O 2.8Å
177	V	86	Confident	88.6	Confident	64 Å²	64	49.6 Å²	49.6	39%	0.388	25%	0.251	S	S	.	.	S	Bend	trans	-56.1	131.3	178	-174.2	0	0	0	0	110	R173 T174 S179 N180	R173-V177 WeakPolarHBondContact O-CG2 3.48Å; R173-V177 PolarHBondContact O-N 3.09Å; T174-V177 PolarHBondContact O-N 3.04Å; V177-S179 VanDerWaalsContact CG1-OG 3.23Å; V177-S179 WeakPolarHBondContact CG1-OG 3.09Å; V177-S179 PolarHBondContact O-N 2.82Å; V177-S179 VanDerWaalsContact O-N 3.1Å; V177-N180 HydrophobicContact CB-CB 4.36Å; V177-N180 WeakPolarHBondContact O-CA 3.4Å; V177-N180 WeakPolarHBondContact O-CB 3.18Å; V177-N180 PolarHBondContact O-N 3.28Å
178	P	79.9	Confident	89.2	Confident	94 Å²	94	52.7 Å²	52.7	61%	0.61	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-60.4	-21.3	-176.5	-27.9	35.4	0	0	0	115.9	N180 R181	P178-N180 VanDerWaalsContact C-N 3.31Å; P178-R181 WeakPolarHBondContact O-CD 3.18Å; P178-R181 VanDerWaalsContact O-CG 3.24Å; P178-R181 WeakPolarHBondContact O-CG 3.4Å; P178-R181 PolarHBondContact O-NE 3.45Å
179	S	80.6	Confident	89.6	Confident	99 Å²	99	53 Å²	53	69%	0.692	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-72.4	-24.5	171	50.9	0	0	0	0	112.4	V177 R181	V177-S179 VanDerWaalsContact CG1-OG 3.23Å; V177-S179 WeakPolarHBondContact CG1-OG 3.09Å; V177-S179 PolarHBondContact O-N 2.82Å; V177-S179 VanDerWaalsContact O-N 3.1Å; S179-R181 PolarHBondContact O-N 3.1Å
180	N	85.9	Confident	90	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.182	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-96.2	30.7	-173.8	-67.9	-16.2	0	0	0	113.4	T174 V177 P178 N182 L183 K201	T174-N180 WeakPolarHBondContact O-CB 3.11Å; T174-N180 PolarHBondContact O-ND2 2.94Å; V177-N180 HydrophobicContact CB-CB 4.36Å; V177-N180 WeakPolarHBondContact O-CA 3.4Å; V177-N180 WeakPolarHBondContact O-CB 3.18Å; V177-N180 PolarHBondContact O-N 3.28Å; P178-N180 VanDerWaalsContact C-N 3.31Å; N180-N182 PolarHBondContact O-N 2.67Å; N180-L183 HydrophobicContact CB-CB 4.3Å; N180-L183 HydrophobicContact CB-CD1 3.71Å; N180-L183 HydrophobicContact CB-CG 3.88Å; N180-L183 PolarHBondContact O-N 2.8Å; N180-K201 PolarHBondContact O-NZ 3.28Å
181	R	82.9	Confident	89.9	Confident	186 Å²	186	57.7 Å²	57.7	70%	0.702	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.8	-176.6	-75.5	166.6	-169.2	-151.4	0.4	113.8	P178 S179 N185 K201	P178-R181 WeakPolarHBondContact O-CD 3.18Å; P178-R181 VanDerWaalsContact O-CG 3.24Å; P178-R181 WeakPolarHBondContact O-CG 3.4Å; P178-R181 PolarHBondContact O-NE 3.45Å; S179-R181 PolarHBondContact O-N 3.1Å; R181-N185 PolarHBondContact O-ND2 3.09Å; R181-N185 VanDerWaalsContact O-ND2 3.17Å; R181-N185 PolarHBondContact O-OD1 2.63Å; R181-K201 PolarHBondContact O-NZ 3.29Å
182	N	86.6	Confident	89.9	Confident	90 Å²	90	58.6 Å²	58.6	48%	0.481	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-6.3	-176.3	-69.9	-25.1	0	0	0	114.3	T153 Y154 N180	T153-N182 WeakPolarHBondContact O-CB 3.5Å; Y154-N182 HydrophobicContact CD2-CB 4.29Å; N180-N182 PolarHBondContact O-N 2.67Å
183	L	92.4	Very high	89.6	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-84.8	134.6	-178.8	-51.9	-168.6	0	0	0	110.9	L152 L155 L175 N180 N185 K201	L152-L183 HydrophobicContact CD2-CD2 4.31Å; L152-L183 HydrophobicContact CG-CD2 4.13Å; L155-L183 HydrophobicContact CB-CB 4Å; L155-L183 HydrophobicContact CB-CD2 3.64Å; L155-L183 HydrophobicContact CB-CG 4.32Å; L155-L183 HydrophobicContact CD2-CB 4.38Å; L175-L183 HydrophobicContact CD2-CB 3.62Å; N180-L183 HydrophobicContact CB-CB 4.3Å; N180-L183 HydrophobicContact CB-CD1 3.71Å; N180-L183 HydrophobicContact CB-CG 3.88Å; N180-L183 PolarHBondContact O-N 2.8Å; L183-N185 VanDerWaalsContact C-N 3.28Å; L183-N185 PolarHBondContact O-N 3.47Å; L183-K201 WeakPolarHBondContact O-CE 3.36Å; L183-K201 PolarHBondContact O-NZ 3.32Å
184	G	89.2	Confident	89.8	Confident	2 Å²	2	70.6 Å²	70.6	2%	0.021	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	23.4	169.7	0	0	0	0	0	116.2	L155 A187	L155-G184 PolarHBondContact O-N 3.17Å; G184-A187 WeakPolarHBondContact O-CB 2.92Å; G184-A187 PolarHBondContact O-N 3.05Å
185	N	91.1	Very high	90	Very high	52 Å²	52	70.1 Å²	70.1	28%	0.278	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	140.2	175.3	-71.9	-28.2	0	0	0	111	R181 L183 A187 K201	R181-N185 PolarHBondContact O-ND2 3.09Å; R181-N185 VanDerWaalsContact O-ND2 3.17Å; R181-N185 PolarHBondContact O-OD1 2.63Å; L183-N185 VanDerWaalsContact C-N 3.28Å; L183-N185 PolarHBondContact O-N 3.47Å; N185-A187 PolarHBondContact O-N 2.99Å; N185-K201 WeakPolarHBondContact OD1-CE 3.42Å; N185-K201 PolarHBondContact OD1-NZ 2.88Å
186	Y	94.1	Very high	90.2	Very high	163 Å²	163	77.1 Å²	77.1	64%	0.639	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	-1.4	-178.5	-45.8	-76.1	0	0	0	116.8	R188	Y186-R188 PolarHBondContact O-N 2.82Å
187	A	96.6	Very high	90.3	Very high	2 Å²	2	75 Å²	75	2%	0.017	38%	0.377	C	S	.	.			trans	-63.4	136.1	174	0	0	0	0	0	111	I157 G184 N185 K199 L200	I157-A187 HydrophobicContact CD1-CB 3.91Å; I157-A187 HydrophobicContact CG1-CB 3.95Å; G184-A187 WeakPolarHBondContact O-CB 2.92Å; G184-A187 PolarHBondContact O-N 3.05Å; N185-A187 PolarHBondContact O-N 2.99Å; A187-K199 WeakPolarHBondContact O-CA 3.34Å; A187-L200 HydrophobicContact CB-CB 4.33Å; A187-L200 HydrophobicContact CB-CD1 3.61Å; A187-L200 HydrophobicContact CB-CG 3.77Å; A187-L200 PolarHBondContact O-N 2.78Å
188	R	97.4	Very high	90.8	Very high	118 Å²	118	76 Å²	76	45%	0.445	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-136.8	151.3	-175.4	-67.2	171.1	-172.3	-89.7	8.7	111.3	Y186 G197 Q198 K199	Y186-R188 PolarHBondContact O-N 2.82Å; R188-G197 WeakPolarHBondContact CD-O 3.49Å; R188-G197 PolarHBondContact NH1-O 2.94Å; R188-Q198 CarbonylContact C-O 3.21Å; R188-Q198 WeakPolarHBondContact CA-O 3.4Å; R188-Q198 WeakPolarHBondContact CB-O 3.03Å; R188-K199 HydrophobicContact CG-CG 4.39Å
189	C	97	Very high	91.6	Very high	5 Å²	5	75.3 Å²	75.3	3%	0.034	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	136.4	172.2	-55.5	0	0	0	0	111.6	C164 L195 G197 Q198 L203	C164-C189 HydrophobicContact CB-CB 3.73Å; C164-C189 WeakPolarHBondContact CB-SG 3.15Å; C164-C189 WeakPolarHBondContact SG-CA 3.21Å; C164-C189 WeakPolarHBondContact SG-CB 3.34Å; C164-C189 CovalentContact SG-SG 2.01Å; C164-C189 PolarHBondContact SG-SG 3.49Å; C189-L195 HydrophobicContact CB-CB 4.29Å; C189-L195 WeakPolarHBondContact CB-O 3.46Å; C189-G197 PolarHBondContact O-N 2.84Å; C189-Q198 PolarHBondContact N-O 3.24Å; C189-L203 WeakPolarHBondContact SG-CD1 3.48Å
190	A	96.1	Very high	92.3	Very high	39 Å²	39	70.6 Å²	70.6	32%	0.322	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-36	165.2	0	0	0	0	0	111.7	P161 W162 K196	P161-A190 HydrophobicContact CB-CB 4.19Å; W162-A190 PolarHBondContact O-N 2.82Å; A190-K196 WeakPolarHBondContact O-CG 3.35Å
191	E	86.8	Confident	92.6	Very high	65 Å²	65	71.5 Å²	71.5	30%	0.304	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	162.1	176.9	67.3	-175	-169.3	0	0	109.5	R139 W162 S163 C164	R139-E191 IonicContact NH1-OE1 2.72Å; R139-E191 PolarHBondContact NH1-OE1 3.4Å; R139-E191 IonicContact NH1-OE2 3.18Å; R139-E191 PolarHBondContact NH1-OE2 3.45Å; W162-E191 PolarHBondContact O-N 2.63Å; S163-E191 WeakPolarHBondContact CB-OE1 2.96Å; S163-E191 WeakPolarHBondContact OG-CG 3.37Å; S163-E191 PolarHBondContact OG-OE1 2.87Å; C164-E191 WeakPolarHBondContact CB-O 3.38Å; C164-E191 PolarHBondContact N-O 2.99Å
192	P	91.6	Very high	93.1	Very high	24 Å²	24	69.7 Å²	69.7	16%	0.156	33%	0.332	C	S	.	.	S	Bend	cis	-65.4	169.4	-10	30	-35.7	0	0	0	112.6	C164 S194 L195 K196	C164-P192 WeakPolarHBondContact O-CD 3.41Å; P192-S194 WeakPolarHBondContact CG-OG 3.12Å; P192-S194 PolarHBondContact O-N 3.09Å; P192-S194 VanDerWaalsContact O-N 3.17Å; P192-L195 HydrophobicContact CG-CB 4.38Å; P192-L195 HydrophobicContact CG-CD1 4.29Å; P192-L195 HydrophobicContact CG-CG 4.31Å; P192-L195 PolarHBondContact O-N 3.12Å; P192-K196 PolarHBondContact O-N 3.37Å
193	R	89.2	Confident	93.3	Very high	244 Å²	244	65.4 Å²	65.4	92%	0.921	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-32.3	-178.1	-67.9	-176.1	-176.1	173.5	3.1	113	L195	R193-L195 VanDerWaalsContact C-N 3.31Å; R193-L195 PolarHBondContact O-N 2.98Å
194	S	91.2	Very high	93.1	Very high	92 Å²	92	68.4 Å²	68.4	64%	0.643	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-32.9	177.3	47.5	0	0	0	0	113.3	P192	P192-S194 WeakPolarHBondContact CG-OG 3.12Å; P192-S194 PolarHBondContact O-N 3.09Å; P192-S194 VanDerWaalsContact O-N 3.17Å
195	L	94	Very high	92.6	Very high	12 Å²	12	68.8 Å²	68.8	6%	0.063	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-4.7	-177.7	-62.6	179.5	0	0	0	113.1	C164 C189 P192 R193 G197 Q198 L203 L207 L208	C164-L195 HydrophobicContact CB-CB 4.28Å; C164-L195 HydrophobicContact CB-CD1 3.96Å; C164-L195 WeakPolarHBondContact O-CD1 3.48Å; C189-L195 HydrophobicContact CB-CB 4.29Å; C189-L195 WeakPolarHBondContact CB-O 3.46Å; P192-L195 HydrophobicContact CG-CB 4.38Å; P192-L195 HydrophobicContact CG-CD1 4.29Å; P192-L195 HydrophobicContact CG-CG 4.31Å; P192-L195 PolarHBondContact O-N 3.12Å; R193-L195 VanDerWaalsContact C-N 3.31Å; R193-L195 PolarHBondContact O-N 2.98Å; L195-G197 PolarHBondContact O-N 2.01Å; L195-Q198 HydrophobicContact CD2-CG 4.45Å; L195-Q198 WeakPolarHBondContact O-CB 3.3Å; L195-Q198 VanDerWaalsContact O-CG 3.24Å; L195-Q198 WeakPolarHBondContact O-CG 3.38Å; L195-Q198 PolarHBondContact O-N 3.48Å; L195-L203 HydrophobicContact CD2-CD2 4.29Å; L195-L207 HydrophobicContact CD2-CB 4.48Å; L195-L208 HydrophobicContact CD1-CD2 4.46Å
196	K	94.6	Very high	92.1	Very high	150 Å²	150	70.8 Å²	70.8	65%	0.652	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	126.5	-177.4	-175.5	174.2	-178.7	-178.8	0	111.8	A190 P192 Q198	A190-K196 WeakPolarHBondContact O-CG 3.35Å; P192-K196 PolarHBondContact O-N 3.37Å; K196-Q198 VanDerWaalsContact C-N 3.32Å
197	G	93.9	Very high	91.7	Very high	33 Å²	33	67 Å²	67	34%	0.34	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-12.1	-179.4	0	0	0	0	0	115.4	R188 C189 L195	R188-G197 WeakPolarHBondContact CD-O 3.49Å; R188-G197 PolarHBondContact NH1-O 2.94Å; C189-G197 PolarHBondContact O-N 2.84Å; L195-G197 PolarHBondContact O-N 2.01Å
198	Q	96.3	Very high	91.1	Very high	87 Å²	87	67.3 Å²	67.3	41%	0.407	33%	0.333	S	S	.	.			trans	-63	139.4	173.8	-70.6	-81.4	33.4	0	0	110.6	R188 C189 L195 K196 L203	R188-Q198 CarbonylContact C-O 3.21Å; R188-Q198 WeakPolarHBondContact CA-O 3.4Å; R188-Q198 WeakPolarHBondContact CB-O 3.03Å; C189-Q198 PolarHBondContact N-O 3.24Å; L195-Q198 HydrophobicContact CD2-CG 4.45Å; L195-Q198 WeakPolarHBondContact O-CB 3.3Å; L195-Q198 VanDerWaalsContact O-CG 3.24Å; L195-Q198 WeakPolarHBondContact O-CG 3.38Å; L195-Q198 PolarHBondContact O-N 3.48Å; K196-Q198 VanDerWaalsContact C-N 3.32Å; Q198-L203 HydrophobicContact CB-CD2 3.84Å; Q198-L203 HydrophobicContact CG-CD2 4.41Å
199	K	96.3	Very high	90.3	Very high	78 Å²	78	62.6 Å²	62.6	34%	0.339	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-72.9	133.6	176.9	-66.6	-174.9	179.7	-174.8	0	109.6	A187 R188 K201 K202	A187-K199 WeakPolarHBondContact O-CA 3.34Å; R188-K199 HydrophobicContact CG-CG 4.39Å; K199-K201 VanDerWaalsContact C-N 3.32Å; K199-K201 PolarHBondContact O-N 2.93Å; K199-K202 HydrophobicContact CB-CB 4.48Å; K199-K202 HydrophobicContact CB-CD 4.44Å; K199-K202 HydrophobicContact CB-CG 4.2Å; K199-K202 PolarHBondContact O-N 3.02Å
200	L	95.4	Very high	89.2	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.005	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-54	-46.8	-178.5	-64	-166	0	0	0	112.3	I157 W162 C164 L168 V172 L175 A187 K202 L203	I157-L200 HydrophobicContact CD1-CD1 4.16Å; W162-L200 HydrophobicContact CB-CD2 4.31Å; W162-L200 HydrophobicContact CD2-CD1 4.06Å; W162-L200 HydrophobicContact CG-CD1 3.98Å; C164-L200 WeakPolarHBondContact SG-CD2 3.48Å; L168-L200 HydrophobicContact CD2-CD1 4.4Å; L168-L200 HydrophobicContact CD2-CD2 3.84Å; V172-L200 WeakPolarHBondContact CG1-O 3.39Å; V172-L200 HydrophobicContact CG2-CB 4.27Å; L175-L200 HydrophobicContact CD1-CB 4.49Å; L175-L200 HydrophobicContact CD1-CD1 4.49Å; A187-L200 HydrophobicContact CB-CB 4.33Å; A187-L200 HydrophobicContact CB-CD1 3.61Å; A187-L200 HydrophobicContact CB-CG 3.77Å; A187-L200 PolarHBondContact O-N 2.78Å; L200-K202 PolarHBondContact O-N 3.39Å; L200-L203 HydrophobicContact CD2-CD1 3.86Å; L200-L203 WeakPolarHBondContact O-CB 3.32Å; L200-L203 PolarHBondContact O-N 2.81Å
201	K	92.9	Very high	87.4	Confident	53 Å²	53	69.5 Å²	69.5	23%	0.23	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-59.9	-15.2	178.3	-67.6	-167.9	174.6	-172.1	0	115.6	L175 Q176 N180 R181 L183 N185 K199	L175-K201 HydrophobicContact CB-CG 4.2Å; L175-K201 VanDerWaalsContact O-CE 3.24Å; L175-K201 WeakPolarHBondContact O-CE 3.47Å; Q176-K201 WeakPolarHBondContact CG-O 3.19Å; Q176-K201 PolarHBondContact NE2-O 3.34Å; N180-K201 PolarHBondContact O-NZ 3.28Å; R181-K201 PolarHBondContact O-NZ 3.29Å; L183-K201 WeakPolarHBondContact O-CE 3.36Å; L183-K201 PolarHBondContact O-NZ 3.32Å; N185-K201 WeakPolarHBondContact OD1-CE 3.42Å; N185-K201 PolarHBondContact OD1-NZ 2.88Å; K199-K201 VanDerWaalsContact C-N 3.32Å; K199-K201 PolarHBondContact O-N 2.93Å
202	K	92.3	Very high	85.6	Confident	147 Å²	147	71.6 Å²	71.6	64%	0.639	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-96.9	-5.3	179.1	-67.1	-168	170.8	-163.4	0	113.1	K199 L200	K199-K202 HydrophobicContact CB-CB 4.48Å; K199-K202 HydrophobicContact CB-CD 4.44Å; K199-K202 HydrophobicContact CB-CG 4.2Å; K199-K202 PolarHBondContact O-N 3.02Å; L200-K202 PolarHBondContact O-N 3.39Å
203	L	90.6	Very high	83.3	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.005	40%	0.398	C	S	.	.			trans	-80.8	151	-177.5	-60.1	170.8	0	0	0	110.4	C164 V172 Q176 C189 L195 Q198 L200 L208	C164-L203 HydrophobicContact CB-CD1 4.14Å; C164-L203 VanDerWaalsContact SG-CD1 3.57Å; V172-L203 HydrophobicContact CG1-CB 4.24Å; Q176-L203 PolarHBondContact NE2-O 2.8Å; C189-L203 WeakPolarHBondContact SG-CD1 3.48Å; L195-L203 HydrophobicContact CD2-CD2 4.29Å; Q198-L203 HydrophobicContact CB-CD2 3.84Å; Q198-L203 HydrophobicContact CG-CD2 4.41Å; L200-L203 HydrophobicContact CD2-CD1 3.86Å; L200-L203 WeakPolarHBondContact O-CB 3.32Å; L200-L203 PolarHBondContact O-N 2.81Å; L203-L208 HydrophobicContact CB-CD1 4.32Å; L203-L208 HydrophobicContact CB-CD2 4.38Å; L203-L208 HydrophobicContact CB-CG 4.21Å; L203-L208 HydrophobicContact CD1-CD2 3.8Å
204	T	88.1	Confident	81.3	Confident	68 Å²	68	75.5 Å²	75.5	42%	0.417	39%	0.39	S	S	.	.			trans	-117.5	158.8	173.8	60.2	0	0	0	0	109.1	D206 L207 L208	T204-D206 PolarHBondContact O-N 2.87Å; T204-L207 PolarHBondContact O-N 2.87Å; T204-L207 WeakPolarHBondContact OG1-CG 3.29Å; T204-L208 PolarHBondContact O-N 3.27Å
205	A	79.3	Confident	78.8	Confident	10 Å²	10	77.4 Å²	77.4	8%	0.083	40%	0.4	C	S	.	.	H	α-helix	trans	-54.9	-34.3	176.3	0	0	0	0	0	112.4	D169 L208 C209	D169-A205 WeakPolarHBondContact OD1-CA 3.23Å; D169-A205 WeakPolarHBondContact OD1-CB 3.26Å; A205-L208 PolarHBondContact O-N 2.79Å; A205-C209 WeakPolarHBondContact O-CB 3.45Å; A205-C209 PolarHBondContact O-N 3.33Å; A205-C209 PolarHBondContact O-SG 3.13Å
206	D	81.2	Confident	76.1	Confident	95 Å²	95	83.1 Å²	83.1	51%	0.508	43%	0.427	S	S	.	.	H	α-helix	trans	-69.9	-32.9	178.4	-58.7	-38.3	0	0	0	112.4	T204 A210 R333	T204-D206 PolarHBondContact O-N 2.87Å; D206-A210 WeakPolarHBondContact O-CA 3.15Å; D206-A210 VanDerWaalsContact O-CB 3.29Å; D206-A210 WeakPolarHBondContact O-CB 3.38Å; D206-A210 PolarHBondContact O-N 3.05Å; D206-R333 IonicContact OD1-CZ 3.09Å; D206-R333 IonicContact OD1-NH1 3.64Å; D206-R333 PolarHBondContact OD1-NH1 2.85Å; D206-R333 IonicContact OD1-NH2 3.62Å; D206-R333 PolarHBondContact OD1-NH2 2.93Å
207	L	85.4	Confident	73.3	Confident	83 Å²	83	84.4 Å²	84.4	44%	0.435	44%	0.435	S	S	.	.	H	α-helix	trans	-74.2	-39.9	175	-70.2	171.4	0	0	0	111.9	L195 T204	L195-L207 HydrophobicContact CD2-CB 4.48Å; T204-L207 PolarHBondContact O-N 2.87Å; T204-L207 WeakPolarHBondContact OG1-CG 3.29Å
208	L	83.7	Confident	70.7	Confident	9 Å²	9	88.9 Å²	88.9	5%	0.047	46%	0.459	C	S	.	.	H	α-helix	trans	-72.9	-34.6	-179.9	-70	172.6	0	0	0	112.6	C164 R165 C166 D169 V172 L195 L203 T204 A205	C164-L208 HydrophobicContact CB-CD2 3.68Å; R165-L208 CarbonylContact C-O 3.52Å; R165-L208 VanDerWaalsContact C-O 3.27Å; R165-L208 WeakPolarHBondContact CA-O 3.45Å; C166-L208 PolarHBondContact N-O 3.45Å; D169-L208 HydrophobicContact CB-CD1 4.17Å; V172-L208 HydrophobicContact CB-CD1 4.22Å; V172-L208 HydrophobicContact CG1-CD1 4.39Å; V172-L208 HydrophobicContact CG2-CD1 4.08Å; L195-L208 HydrophobicContact CD1-CD2 4.46Å; L203-L208 HydrophobicContact CB-CD1 4.32Å; L203-L208 HydrophobicContact CB-CD2 4.38Å; L203-L208 HydrophobicContact CB-CG 4.21Å; L203-L208 HydrophobicContact CD1-CD2 3.8Å; T204-L208 PolarHBondContact O-N 3.27Å; A205-L208 PolarHBondContact O-N 2.79Å
209	C	80.3	Confident	67.9	Low	18 Å²	18	92.8 Å²	92.8	12%	0.122	48%	0.477	C	S	.	.	S	Bend	trans	-115.3	23.1	-175	-51.6	0	0	0	0	112.5	C166 A205 E211 R309	C166-C209 WeakPolarHBondContact CA-SG 3.48Å; C166-C209 HydrophobicContact CB-CB 3.83Å; C166-C209 WeakPolarHBondContact CB-SG 3.26Å; C166-C209 WeakPolarHBondContact SG-CB 3.36Å; C166-C209 CovalentContact SG-SG 2.05Å; C166-C209 PolarHBondContact SG-SG 3.33Å; A205-C209 WeakPolarHBondContact O-CB 3.45Å; A205-C209 PolarHBondContact O-N 3.33Å; A205-C209 PolarHBondContact O-SG 3.13Å; C209-E211 PolarHBondContact O-N 3.04Å; C209-R309 PolarHBondContact SG-NH2 3.06Å
210	A	74.4	Confident	65.3	Low	66 Å²	66	95.4 Å²	95.4	55%	0.545	50%	0.502	S	S	.	.			trans	-58	132.2	168.2	0	0	0	0	0	108.2	D206 D212	D206-A210 WeakPolarHBondContact O-CA 3.15Å; D206-A210 VanDerWaalsContact O-CB 3.29Å; D206-A210 WeakPolarHBondContact O-CB 3.38Å; D206-A210 PolarHBondContact O-N 3.05Å; A210-D212 PolarHBondContact O-N 3.48Å
211	E	57.6	Low	62.7	Low	124 Å²	124	98.8 Å²	98.8	58%	0.579	54%	0.537	S	S	*	.			trans	-63.3	104.3	172.2	-68.8	-158.8	165	0	0	108.3	C209 N213 R239	C209-E211 PolarHBondContact O-N 3.04Å; E211-N213 VanDerWaalsContact C-N 3.3Å; E211-N213 PolarHBondContact O-N 3.17Å; E211-R239 IonicContact OE1-CZ 2.75Å; E211-R239 IonicContact OE1-NE 3.87Å; E211-R239 IonicContact OE1-NH2 2.9Å; E211-R239 PolarHBondContact OE1-NH2 3.08Å; E211-R239 IonicContact OE2-CZ 3.78Å; E211-R239 IonicContact OE2-NH2 3.27Å; E211-R239 PolarHBondContact OE2-NH2 3.12Å
212	D	50.4	Low	60	Low	108 Å²	108	107.2 Å²	107.2	58%	0.578	57%	0.567	S	S	*	*			trans	-66.7	95.5	169	-120.2	-21.9	0	0	0	106.3	A210 R214	A210-D212 PolarHBondContact O-N 3.48Å; D212-R214 PolarHBondContact O-N 3.36Å
213	N	43.3	Very low	57.6	Low	151 Å²	151	105.9 Å²	105.9	81%	0.807	57%	0.573	S	S	*	*			trans	-67.4	34.9	172.4	-86	-33.6	0	0	0	112.2	E211	E211-N213 VanDerWaalsContact C-N 3.3Å; E211-N213 PolarHBondContact O-N 3.17Å
214	R	46	Very low	55.6	Low	199 Å²	199	111 Å²	111	75%	0.751	60%	0.6	S	S	*	*	S	Bend	trans	-116.5	135.5	179.2	-66.6	-173.9	-175.7	-158.5	1.1	109.4	D212 E216	D212-R214 PolarHBondContact O-N 3.36Å; R214-E216 PolarHBondContact O-N 3.12Å
215	P	39.4	Very low	53.5	Low	132 Å²	132	113.4 Å²	113.4	86%	0.857	61%	0.614	S	S	*	*			trans	-59.6	114.4	172.8	-13	25.5	0	0	0	108.7	E217	P215-E217 PolarHBondContact O-N 3.43Å
216	E	37.2	Very low	51.7	Low	133 Å²	133	123.9 Å²	123.9	62%	0.621	65%	0.651	S	S	*	*			trans	-64.7	125.9	165.3	-109.9	179.3	162.1	0	0	107.8	R165 R214	R165-E216 IonicContact CZ-OE1 3.5Å; R165-E216 VanDerWaalsContact CZ-OE1 3.27Å; R165-E216 IonicContact NH1-OE1 3.7Å; R165-E216 PolarHBondContact NH1-OE1 2.99Å; R165-E216 IonicContact NH2-OE1 3.25Å; R165-E216 PolarHBondContact NH2-OE1 2.91Å; R214-E216 PolarHBondContact O-N 3.12Å
217	E	35.7	Very low	50.4	Low	176 Å²	176	120.6 Å²	120.6	82%	0.822	64%	0.635	S	S	*	*			trans	-56.2	136.4	167.8	-81.7	178.9	156	0	0	108.9	P215 Q219	P215-E217 PolarHBondContact O-N 3.43Å; E217-Q219 PolarHBondContact O-N 3.13Å
218	P	38	Very low	49	Very low	128 Å²	128	121.7 Å²	121.7	83%	0.831	64%	0.641	S	S	*	*			trans	-66.8	112.6	-175.8	17.6	-16.8	0	0	0	109.5
219	Q	37.7	Very low	47.8	Very low	168 Å²	168	121.3 Å²	121.3	79%	0.785	64%	0.639	S	S	*	*			trans	-73.5	141.4	158.1	-66.5	-172.1	29.4	0	0	108.2	E217 G221	E217-Q219 PolarHBondContact O-N 3.13Å; Q219-G221 PolarHBondContact O-N 2.98Å
220	P	42.9	Very low	46.9	Very low	134 Å²	134	122.8 Å²	122.8	87%	0.87	65%	0.648	S	S	*	*			trans	-61.9	111.3	177.5	-13.8	26.5	0	0	0	109.1
221	G	40.5	Very low	46.5	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-61.2	139.2	-178.2	0	0	0	0	0	112.1	Q219	Q219-G221 PolarHBondContact O-N 2.98Å
222	R	37	Very low	47.3	Very low	230 Å²	230	122.3 Å²	122.3	87%	0.868	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-55.9	146.3	155.5	-85.5	178.6	174.2	-174	-2	108.6	I224	R222-I224 PolarHBondContact O-N 3.21Å; R222-I224 VanDerWaalsContact O-N 3.15Å
223	P	40.8	Very low	48.9	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-63.2	121.1	177.1	25.6	-30.4	0	0	0	109.1	V225	P223-V225 PolarHBondContact O-N 3.46Å; P223-V225 VanDerWaalsContact O-N 3.08Å
224	I	48.4	Very low	50.8	Low	109 Å²	109	116.3 Å²	116.3	56%	0.559	61%	0.611	S	S	*	*			trans	-62.1	109.4	169.3	-60.8	170.7	0	0	0	106.4	R222 R226 Y237	R222-I224 PolarHBondContact O-N 3.21Å; R222-I224 VanDerWaalsContact O-N 3.15Å; I224-R226 PolarHBondContact O-N 2.82Å; I224-Y237 WeakPolarHBondContact CD1-OH 3.33Å
225	V	44.2	Very low	52.5	Low	118 Å²	118	108.1 Å²	108.1	72%	0.715	58%	0.582	S	S	*	*			trans	-62.9	121.5	169.9	179	0	0	0	0	106.6	P223 T227	P223-V225 PolarHBondContact O-N 3.46Å; P223-V225 VanDerWaalsContact O-N 3.08Å; V225-T227 PolarHBondContact O-N 2.84Å
226	R	41.9	Very low	54.3	Low	230 Å²	230	106.1 Å²	106.1	87%	0.868	56%	0.56	S	S	*	*			trans	-66.1	103.1	177	-69.3	-179.8	175	161	-2.2	108.3	I224	I224-R226 PolarHBondContact O-N 2.82Å
227	T	53.8	Low	55.7	Low	26 Å²	26	106.6 Å²	106.6	16%	0.16	56%	0.557	C	S	.	*			trans	-84.3	155.1	168.8	64.6	0	0	0	0	110.3	V225 A229 V230 E255	V225-T227 PolarHBondContact O-N 2.84Å; T227-A229 PolarHBondContact O-N 3.25Å; T227-V230 PolarHBondContact O-N 3.1Å; T227-E255 VanDerWaalsContact CB-O 3.28Å; T227-E255 WeakPolarHBondContact CB-O 3.41Å; T227-E255 PolarHBondContact OG1-O 3.46Å
228	D	55.7	Low	56.4	Low	107 Å²	107	104 Å²	104	57%	0.572	56%	0.555	S	S	*	*	H	α-helix	trans	-58.5	-30.6	-178.5	-73.2	-22.1	0	0	0	112.8	V230 S231	D228-V230 VanDerWaalsContact C-N 3.29Å; D228-V230 PolarHBondContact O-N 2.86Å; D228-S231 WeakPolarHBondContact O-CB 3.47Å; D228-S231 PolarHBondContact O-N 2.99Å; D228-S231 VanDerWaalsContact O-N 3.08Å
229	A	59.3	Low	57.6	Low	0 Å²	0	105.7 Å²	105.7	0%	0	55%	0.545	C	S	.	.	H	α-helix	trans	-59.8	-34	175.2	0	0	0	0	0	113.5	T227 S231 I232 C233 P253 L256	T227-A229 PolarHBondContact O-N 3.25Å; A229-S231 PolarHBondContact O-N 3.11Å; A229-I232 PolarHBondContact O-N 3.39Å; A229-C233 WeakPolarHBondContact O-CB 3.38Å; A229-C233 PolarHBondContact O-N 3.22Å; A229-P253 HydrophobicContact CB-CB 3.99Å; A229-L256 HydrophobicContact CB-CD2 4.24Å
230	V	60.5	Low	59.7	Low	50 Å²	50	99.7 Å²	99.7	30%	0.303	52%	0.518	S	S	.	.	H	α-helix	trans	-76.1	-14.5	179	-172.5	0	0	0	0	112	T227 D228 P257	T227-V230 PolarHBondContact O-N 3.1Å; D228-V230 VanDerWaalsContact C-N 3.29Å; D228-V230 PolarHBondContact O-N 2.86Å; V230-P257 HydrophobicContact CG2-CG 3.86Å
231	S	66.3	Low	61.7	Low	101 Å²	101	95.8 Å²	95.8	71%	0.706	49%	0.49	S	S	*	.	H	α-helix	trans	-81.9	-24.1	173.7	-54.7	0	0	0	0	112.5	D228 A229	D228-S231 WeakPolarHBondContact O-CB 3.47Å; D228-S231 PolarHBondContact O-N 2.99Å; D228-S231 VanDerWaalsContact O-N 3.08Å; A229-S231 PolarHBondContact O-N 3.11Å
232	I	75.4	Confident	64	Low	78 Å²	78	92.4 Å²	92.4	40%	0.4	46%	0.455	S	S	.	.	H	α-helix	trans	-98.9	-39.5	-177	-59.9	169.3	0	0	0	110.8	A229 L249	A229-I232 PolarHBondContact O-N 3.39Å; I232-L249 HydrophobicContact CG2-CD2 3.94Å
233	C	83.4	Confident	66.6	Low	8 Å²	8	82.6 Å²	82.6	5%	0.054	42%	0.42	C	S	.	.	S	Bend	trans	-107.4	154	-173.7	-55.3	0	0	0	0	112.2	A229 L242 D243 C244	A229-C233 WeakPolarHBondContact O-CB 3.38Å; A229-C233 PolarHBondContact O-N 3.22Å; C233-L242 HydrophobicContact CB-CD1 3.62Å; C233-L242 HydrophobicContact CB-CD2 4.46Å; C233-L242 HydrophobicContact CB-CG 3.87Å; C233-D243 WeakPolarHBondContact CA-O 3.39Å; C233-D243 WeakPolarHBondContact CB-O 3.34Å; C233-C244 HydrophobicContact CB-CB 3.97Å; C233-C244 WeakPolarHBondContact CB-SG 3.5Å; C233-C244 WeakPolarHBondContact SG-CB 3.41Å; C233-C244 CovalentContact SG-SG 2.02Å; C233-C244 PolarHBondContact SG-SG 3.5Å
234	H	82.7	Confident	69	Low	125 Å²	125	77 Å²	77	58%	0.579	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.1	179.2	-167.5	68.1	0	0	0	110.9	K236 D243	H234-K236 PolarHBondContact O-N 3.11Å; H234-D243 PolarHBondContact N-O 2.92Å; H234-D243 PolarHBondContact O-N 3.49Å
235	L	80.9	Confident	71.1	Confident	27 Å²	27	72.9 Å²	72.9	14%	0.141	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	116.1	175.3	-168.1	69.6	0	0	0	110.1	Y237 L240 L242	L235-Y237 HydrophobicContact CD2-CE1 4.33Å; L235-Y237 HydrophobicContact CD2-CE2 3.88Å; L235-Y237 VanDerWaalsContact CD2-OH 3.29Å; L235-Y237 WeakPolarHBondContact CD2-OH 3.25Å; L235-Y237 HydrophobicContact CG-CE2 4.21Å; L235-L240 HydrophobicContact CD2-CD2 4.4Å; L235-L242 HydrophobicContact CD1-CD1 4.12Å
236	K	78.1	Confident	73.4	Confident	90 Å²	90	73.3 Å²	73.3	39%	0.391	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122	177.9	-66.2	-178.3	-175.7	169	0	110.7	H234 L240 L241 D243	H234-K236 PolarHBondContact O-N 3.11Å; K236-L240 PolarHBondContact O-N 3.15Å; K236-L241 HydrophobicContact CB-CB 4.26Å; K236-L241 HydrophobicContact CD-CD2 4.33Å; K236-L241 PolarHBondContact N-O 3.22Å; K236-L241 PolarHBondContact O-N 3.43Å; K236-L241 VanDerWaalsContact O-N 3.1Å; K236-D243 HydrophobicContact CD-CB 4.33Å; K236-D243 WeakPolarHBondContact CE-OD2 3.31Å; K236-D243 IonicContact NZ-OD2 2.88Å; K236-D243 PolarHBondContact NZ-OD2 3.1Å
237	Y	66.4	Low	75.8	Confident	143 Å²	143	67.6 Å²	67.6	56%	0.561	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	154.3	173	-69.3	-83.1	0	0	0	111.1	I224 L235 L240	I224-Y237 WeakPolarHBondContact CD1-OH 3.33Å; L235-Y237 HydrophobicContact CD2-CE1 4.33Å; L235-Y237 HydrophobicContact CD2-CE2 3.88Å; L235-Y237 VanDerWaalsContact CD2-OH 3.29Å; L235-Y237 WeakPolarHBondContact CD2-OH 3.25Å; L235-Y237 HydrophobicContact CG-CE2 4.21Å; Y237-L240 HydrophobicContact CD1-CD2 3.99Å; Y237-L240 HydrophobicContact CE1-CD2 3.53Å
238	P	51.6	Low	77.5	Confident	122 Å²	122	72.4 Å²	72.4	79%	0.792	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.9	-7.3	5	34.1	-35.1	0	0	0	115.2	L240	P238-L240 VanDerWaalsContact C-N 3.28Å; P238-L240 PolarHBondContact O-N 3.19Å
239	R	61.3	Low	79.2	Confident	163 Å²	163	68.5 Å²	68.5	62%	0.615	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	13.7	-171.5	-73.4	-174.3	172.4	165.7	-3.5	115.5	E211 L241	E211-R239 IonicContact OE1-CZ 2.75Å; E211-R239 IonicContact OE1-NE 3.87Å; E211-R239 IonicContact OE1-NH2 2.9Å; E211-R239 PolarHBondContact OE1-NH2 3.08Å; E211-R239 IonicContact OE2-CZ 3.78Å; E211-R239 IonicContact OE2-NH2 3.27Å; E211-R239 PolarHBondContact OE2-NH2 3.12Å; R239-L241 PolarHBondContact O-N 2.92Å; R239-L241 VanDerWaalsContact O-N 3.12Å
240	L	81.7	Confident	80.7	Confident	42 Å²	42	73 Å²	73	22%	0.22	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	42.5	48.1	-176.6	-62.3	176.5	0	0	0	112.1	L235 K236 Y237 P238 E259 V261	L235-L240 HydrophobicContact CD2-CD2 4.4Å; K236-L240 PolarHBondContact O-N 3.15Å; Y237-L240 HydrophobicContact CD1-CD2 3.99Å; Y237-L240 HydrophobicContact CE1-CD2 3.53Å; P238-L240 VanDerWaalsContact C-N 3.28Å; P238-L240 PolarHBondContact O-N 3.19Å; L240-E259 HydrophobicContact CD1-CB 4Å; L240-E259 VanDerWaalsContact CD1-O 3.25Å; L240-E259 WeakPolarHBondContact CD1-O 3.41Å; L240-V261 PolarHBondContact O-N 3.17Å
241	L	85.3	Confident	82	Confident	53 Å²	53	74.6 Å²	74.6	28%	0.277	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	117.8	179.4	174	68.9	0	0	0	108.3	K236 R239 G262	K236-L241 HydrophobicContact CB-CB 4.26Å; K236-L241 HydrophobicContact CD-CD2 4.33Å; K236-L241 PolarHBondContact N-O 3.22Å; K236-L241 PolarHBondContact O-N 3.43Å; K236-L241 VanDerWaalsContact O-N 3.1Å; R239-L241 PolarHBondContact O-N 2.92Å; R239-L241 VanDerWaalsContact O-N 3.12Å; L241-G262 WeakPolarHBondContact CA-O 3.45Å; L241-G262 VanDerWaalsContact CD1-C 3.48Å
242	L	90.2	Very high	83.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	108.9	176.4	-170.2	67.2	0	0	0	109.5	C233 L235 L256 I260 G262 M263 D264	C233-L242 HydrophobicContact CB-CD1 3.62Å; C233-L242 HydrophobicContact CB-CD2 4.46Å; C233-L242 HydrophobicContact CB-CG 3.87Å; L235-L242 HydrophobicContact CD1-CD1 4.12Å; L242-L256 HydrophobicContact CD2-CD2 4.39Å; L242-I260 HydrophobicContact CB-CG2 4.2Å; L242-I260 HydrophobicContact CD2-CD1 4.37Å; L242-G262 PolarHBondContact N-O 2.7Å; L242-M263 HydrophobicContact CB-CG 4.45Å; L242-M263 HydrophobicContact CD2-CE 4.3Å; L242-M263 HydrophobicContact CD2-SD 4.39Å; L242-M263 WeakPolarHBondContact O-CA 3.47Å; L242-D264 PolarHBondContact O-N 3.43Å
243	D	90.1	Very high	83.5	Confident	25 Å²	25	66.8 Å²	66.8	13%	0.134	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	106.8	177.8	-175.5	-0	0	0	0	110.5	C233 H234 K236 S245	C233-D243 WeakPolarHBondContact CA-O 3.39Å; C233-D243 WeakPolarHBondContact CB-O 3.34Å; H234-D243 PolarHBondContact N-O 2.92Å; H234-D243 PolarHBondContact O-N 3.49Å; K236-D243 HydrophobicContact CD-CB 4.33Å; K236-D243 WeakPolarHBondContact CE-OD2 3.31Å; K236-D243 IonicContact NZ-OD2 2.88Å; K236-D243 PolarHBondContact NZ-OD2 3.1Å; D243-S245 WeakPolarHBondContact OD1-CB 3.38Å; D243-S245 PolarHBondContact OD1-N 3.39Å; D243-S245 PolarHBondContact OD1-OG 3.33Å
244	C	91.1	Very high	82.9	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.348	C	S	.	.			trans	-113.6	16.6	175.6	-58.4	0	0	0	0	111.5	C233 K247 L249 D264 M265 N268	C233-C244 HydrophobicContact CB-CB 3.97Å; C233-C244 WeakPolarHBondContact CB-SG 3.5Å; C233-C244 WeakPolarHBondContact SG-CB 3.41Å; C233-C244 CovalentContact SG-SG 2.02Å; C233-C244 PolarHBondContact SG-SG 3.5Å; C244-K247 WeakPolarHBondContact O-CG 3.47Å; C244-L249 HydrophobicContact CB-CD1 3.98Å; C244-D264 CarbonylContact C-O 3.08Å; C244-D264 WeakPolarHBondContact CA-O 3.17Å; C244-D264 WeakPolarHBondContact CB-O 3.28Å; C244-D264 PolarHBondContact N-O 3.29Å; C244-M265 HydrophobicContact CB-CE 4.28Å; C244-M265 HydrophobicContact CB-SD 3.21Å; C244-M265 WeakPolarHBondContact CB-SD 3.26Å; C244-M265 PolarHBondContact SG-SD 2.9Å; C244-N268 PolarHBondContact O-ND2 3.09Å
245	S	93.3	Very high	82.3	Confident	22 Å²	22	71.2 Å²	71.2	15%	0.154	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	148.7	-176.1	65.4	0	0	0	0	111.9	D243 K247 D264 S266	D243-S245 WeakPolarHBondContact OD1-CB 3.38Å; D243-S245 PolarHBondContact OD1-N 3.39Å; D243-S245 PolarHBondContact OD1-OG 3.33Å; S245-K247 WeakPolarHBondContact O-CG 3.24Å; S245-K247 PolarHBondContact O-N 3.4Å; S245-D264 PolarHBondContact N-O 2.73Å; S245-S266 WeakPolarHBondContact CA-O 3.39Å; S245-S266 WeakPolarHBondContact CB-O 3.1Å
246	H	93.4	Very high	82.3	Confident	128 Å²	128	70.7 Å²	70.7	59%	0.593	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	44.3	177.5	-56.1	-87.8	0	0	0	114	S266 N267	H246-S266 PolarHBondContact N-O 3.19Å; H246-N267 VanDerWaalsContact CA-O 3.3Å; H246-N267 WeakPolarHBondContact CA-O 3.16Å; H246-N267 WeakPolarHBondContact CE1-CB 3.46Å; H246-N267 PolarHBondContact N-O 2.92Å; H246-N267 WeakPolarHBondContact ND1-CB 3.38Å; H246-N267 PolarHBondContact NE2-ND2 2.81Å
247	K	90.4	Very high	82.2	Confident	109 Å²	109	67.5 Å²	67.5	47%	0.474	34%	0.337	S	S	.	.	S	Bend	trans	-116	10.3	-177.7	-67.2	-59.1	-177.3	-174.2	0	113.7	C244 S245 L249 N268	C244-K247 WeakPolarHBondContact O-CG 3.47Å; S245-K247 WeakPolarHBondContact O-CG 3.24Å; S245-K247 PolarHBondContact O-N 3.4Å; K247-L249 HydrophobicContact CB-CD1 3.99Å; K247-L249 HydrophobicContact CB-CD2 4.26Å; K247-L249 HydrophobicContact CB-CG 3.71Å; K247-L249 PolarHBondContact O-N 2.96Å; K247-L249 VanDerWaalsContact O-N 3.14Å; K247-N268 WeakPolarHBondContact CA-OD1 3.21Å; K247-N268 PolarHBondContact N-OD1 2.99Å
248	D	91.5	Very high	82.7	Confident	128 Å²	128	65.9 Å²	65.9	68%	0.684	34%	0.337	S	S	*	.			trans	52.4	32.2	-177	-59.2	-47.9	0	0	0	113.2	N250 N268 I269	D248-N250 PolarHBondContact O-N 2.05Å; D248-N268 PolarHBondContact N-OD1 2.88Å; D248-N268 VanDerWaalsContact N-OD1 3.12Å; D248-I269 WeakPolarHBondContact O-CD1 3.48Å; D248-I269 WeakPolarHBondContact O-CG1 3.35Å
249	L	90.5	Very high	83.8	Confident	24 Å²	24	66.5 Å²	66.5	13%	0.126	33%	0.329	C	S	.	.			trans	-72.9	130	-178.2	-61	173.4	0	0	0	110.3	I232 C244 K247 P253 M265 N268 I269 I270	I232-L249 HydrophobicContact CG2-CD2 3.94Å; C244-L249 HydrophobicContact CB-CD1 3.98Å; K247-L249 HydrophobicContact CB-CD1 3.99Å; K247-L249 HydrophobicContact CB-CD2 4.26Å; K247-L249 HydrophobicContact CB-CG 3.71Å; K247-L249 PolarHBondContact O-N 2.96Å; K247-L249 VanDerWaalsContact O-N 3.14Å; L249-P253 HydrophobicContact CD1-CG 4.38Å; L249-M265 HydrophobicContact CB-CE 4.48Å; L249-M265 HydrophobicContact CD1-CE 3.61Å; L249-M265 HydrophobicContact CD1-SD 4.36Å; L249-N268 HydrophobicContact CB-CB 4.18Å; L249-N268 PolarHBondContact N-OD1 2.82Å; L249-I269 CarbonylContact O-C 3.46Å; L249-I269 VanDerWaalsContact O-C 3.31Å; L249-I269 WeakPolarHBondContact O-CA 3.38Å; L249-I269 VanDerWaalsContact O-CG1 3.25Å; L249-I269 WeakPolarHBondContact O-CG1 3.41Å; L249-I269 PolarHBondContact O-N 3.26Å; L249-I270 WeakPolarHBondContact O-CG1 3.14Å; L249-I270 PolarHBondContact O-N 3.17Å
250	N	90.3	Very high	85	Confident	95 Å²	95	58.8 Å²	58.8	51%	0.508	30%	0.301	S	S	.	.	S	Bend	trans	-93.5	-12.2	175.2	63.5	8.5	0	0	0	113.3	D248 I269	D248-N250 PolarHBondContact O-N 2.05Å; N250-I269 HydrophobicContact CB-CD1 4.19Å; N250-I269 HydrophobicContact CB-CG1 4.06Å
251	Q	88.8	Confident	85.2	Confident	83 Å²	83	59.1 Å²	59.1	39%	0.388	30%	0.304	S	S	.	.	S	Bend	trans	-150.7	161.5	-178.9	-61.9	-178.6	35.5	0	0	109.5
252	I	88.2	Confident	85.5	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.036	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-69.4	131.9	171	-59.9	160.1	0	0	0	108.8	L256 M263 I270 L273 Q277 F278	I252-L256 HydrophobicContact CG2-CD1 4.04Å; I252-L256 HydrophobicContact CG2-CD2 4.14Å; I252-L256 HydrophobicContact CG2-CG 4.42Å; I252-M263 HydrophobicContact CG2-CE 4.05Å; I252-I270 HydrophobicContact CG1-CD1 4.47Å; I252-L273 HydrophobicContact CD1-CD2 3.57Å; I252-L273 HydrophobicContact CG1-CD2 4.3Å; I252-Q277 HydrophobicContact CB-CG 4.29Å; I252-Q277 HydrophobicContact CD1-CG 4.13Å; I252-F278 HydrophobicContact CD1-CE1 3.96Å; I252-F278 HydrophobicContact CD1-CE2 3.66Å; I252-F278 HydrophobicContact CD1-CZ 3.24Å; I252-F278 HydrophobicContact CG1-CZ 4.27Å; I252-F278 HydrophobicContact CG2-CE1 4.43Å
253	P	83.8	Confident	85.6	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.052	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-54.6	139.2	176.1	-26.6	34	0	0	0	112.3	A229 L249	A229-P253 HydrophobicContact CB-CB 3.99Å; L249-P253 HydrophobicContact CD1-CG 4.38Å
254	P	70.6	Confident	85.8	Confident	91 Å²	91	57.5 Å²	57.5	59%	0.591	30%	0.297	S	S	*	.	S	Bend	trans	-65.3	149.2	170.9	29.5	-33.3	0	0	0	110.1
255	E	70.8	Confident	86	Confident	136 Å²	136	57.5 Å²	57.5	64%	0.636	30%	0.297	S	S	*	.	S	Bend	trans	61.6	66.4	174.1	-56.7	-177.7	-176.5	0	0	114.5	T227	T227-E255 VanDerWaalsContact CB-O 3.28Å; T227-E255 WeakPolarHBondContact CB-O 3.41Å; T227-E255 PolarHBondContact OG1-O 3.46Å
256	L	80	Confident	86.2	Confident	15 Å²	15	56.8 Å²	56.8	8%	0.079	29%	0.292	C	S	.	.			trans	-65.9	144.3	170.5	-57.1	179.5	0	0	0	110.9	A229 L242 I252 L258 I260 M263 F278 S281	A229-L256 HydrophobicContact CB-CD2 4.24Å; L242-L256 HydrophobicContact CD2-CD2 4.39Å; I252-L256 HydrophobicContact CG2-CD1 4.04Å; I252-L256 HydrophobicContact CG2-CD2 4.14Å; I252-L256 HydrophobicContact CG2-CG 4.42Å; L256-L258 PolarHBondContact O-N 3.19Å; L256-I260 HydrophobicContact CB-CD1 4.23Å; L256-M263 HydrophobicContact CD1-CE 3.98Å; L256-M263 HydrophobicContact CD1-SD 3.79Å; L256-M263 HydrophobicContact CD2-CE 3.57Å; L256-M263 HydrophobicContact CD2-SD 4.17Å; L256-M263 HydrophobicContact CG-CE 4.43Å; L256-F278 HydrophobicContact CD1-CD1 3.78Å; L256-F278 HydrophobicContact CD1-CE1 4.04Å; L256-S281 WeakPolarHBondContact CB-OG 3.29Å
257	P	77.5	Confident	86.3	Confident	24 Å²	24	53.6 Å²	53.6	16%	0.156	28%	0.28	C	S	.	.			trans	-63.6	138.6	176.7	-10	22.1	0	0	0	110.9	V230 E259 I260	V230-P257 HydrophobicContact CG2-CG 3.86Å; P257-E259 PolarHBondContact O-N 3.48Å; P257-I260 HydrophobicContact CB-CG2 3.79Å; P257-I260 HydrophobicContact CG-CG2 3.78Å; P257-I260 WeakPolarHBondContact O-CG1 3.24Å
258	L	76.4	Confident	86.6	Confident	109 Å²	109	48.8 Å²	48.8	57%	0.571	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-24.7	-173.7	-60.3	174.3	0	0	0	113.7	L256 L280	L256-L258 PolarHBondContact O-N 3.19Å; L258-L280 HydrophobicContact CD2-CB 3.59Å; L258-L280 HydrophobicContact CD2-CD1 4.41Å; L258-L280 WeakPolarHBondContact CD2-O 3.37Å
259	E	75.7	Confident	86.8	Confident	134 Å²	134	46.3 Å²	46.3	63%	0.626	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	6.9	-170.9	-59.1	177.7	-174.3	0	0	113.2	L240 P257 V261	L240-E259 HydrophobicContact CD1-CB 4Å; L240-E259 VanDerWaalsContact CD1-O 3.25Å; L240-E259 WeakPolarHBondContact CD1-O 3.41Å; P257-E259 PolarHBondContact O-N 3.48Å; E259-V261 PolarHBondContact O-N 2.88Å
260	I	85	Confident	87.1	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.239	C	C	.	.			trans	-68	131.9	-179.2	64.2	-179.7	0	0	0	111	L242 L256 P257 M263 E283 L284	L242-I260 HydrophobicContact CB-CG2 4.2Å; L242-I260 HydrophobicContact CD2-CD1 4.37Å; L256-I260 HydrophobicContact CB-CD1 4.23Å; P257-I260 HydrophobicContact CB-CG2 3.79Å; P257-I260 HydrophobicContact CG-CG2 3.78Å; P257-I260 WeakPolarHBondContact O-CG1 3.24Å; I260-M263 HydrophobicContact CD1-CB 4.36Å; I260-M263 HydrophobicContact CD1-SD 3.91Å; I260-E283 CarbonylContact O-C 3.46Å; I260-L284 HydrophobicContact CD1-CD1 4.09Å; I260-L284 HydrophobicContact CG1-CD1 3.94Å; I260-L284 PolarHBondContact O-N 3.48Å
261	V	86.7	Confident	87.2	Confident	49 Å²	49	43.9 Å²	43.9	30%	0.297	24%	0.235	S	C	.	.	S	Bend	trans	-99.6	-28.6	179.4	179.8	0	0	0	0	111.1	L240 E259 K285 L286	L240-V261 PolarHBondContact O-N 3.17Å; E259-V261 PolarHBondContact O-N 2.88Å; V261-K285 HydrophobicContact CG1-CB 4.29Å; V261-K285 HydrophobicContact CG1-CD 3.94Å; V261-K285 HydrophobicContact CG1-CG 4.27Å; V261-K285 PolarHBondContact O-N 3.05Å; V261-L286 PolarHBondContact O-N 2.96Å
262	G	91.5	Very high	87.4	Confident	6 Å²	6	42.8 Å²	42.8	6%	0.062	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.1	175.1	0	0	0	0	0	110.7	L241 L242 L286	L241-G262 WeakPolarHBondContact CA-O 3.45Å; L241-G262 VanDerWaalsContact CD1-C 3.48Å; L242-G262 PolarHBondContact N-O 2.7Å; G262-L286 CarbonylContact C-O 3.51Å; G262-L286 VanDerWaalsContact CA-O 3.32Å; G262-L286 WeakPolarHBondContact CA-O 3.15Å
263	M	92.6	Very high	87.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	121.3	177.8	-174.4	167.7	176.8	0	0	109.5	L242 I252 L256 I260 M265 F278 L284 L286 L287 N288	L242-M263 HydrophobicContact CB-CG 4.45Å; L242-M263 HydrophobicContact CD2-CE 4.3Å; L242-M263 HydrophobicContact CD2-SD 4.39Å; L242-M263 WeakPolarHBondContact O-CA 3.47Å; I252-M263 HydrophobicContact CG2-CE 4.05Å; L256-M263 HydrophobicContact CD1-CE 3.98Å; L256-M263 HydrophobicContact CD1-SD 3.79Å; L256-M263 HydrophobicContact CD2-CE 3.57Å; L256-M263 HydrophobicContact CD2-SD 4.17Å; L256-M263 HydrophobicContact CG-CE 4.43Å; I260-M263 HydrophobicContact CD1-CB 4.36Å; I260-M263 HydrophobicContact CD1-SD 3.91Å; M263-M265 HydrophobicContact CE-CE 4.39Å; M263-M265 HydrophobicContact CE-CG 3.51Å; M263-M265 HydrophobicContact CE-SD 3.23Å; M263-M265 WeakPolarHBondContact CE-SD 3.09Å; M263-M265 HydrophobicContact CG-CG 3.92Å; M263-M265 HydrophobicContact CG-SD 4.45Å; M263-M265 HydrophobicContact SD-CG 4.37Å; M263-F278 HydrophobicContact SD-CE1 4.28Å; M263-L284 HydrophobicContact CB-CD1 3.69Å; M263-L284 HydrophobicContact CB-CD2 4.46Å; M263-L286 PolarHBondContact N-O 3.27Å; M263-L287 HydrophobicContact CB-CD1 4.21Å; M263-L287 HydrophobicContact CG-CD1 4.4Å; M263-N288 PolarHBondContact O-N 3.39Å
264	D	94.4	Very high	87.8	Confident	38 Å²	38	48.1 Å²	48.1	20%	0.203	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	108.5	174.8	-166.7	-16.2	0	0	0	109.6	L242 C244 S245 S266 N288	L242-D264 PolarHBondContact O-N 3.43Å; C244-D264 CarbonylContact C-O 3.08Å; C244-D264 WeakPolarHBondContact CA-O 3.17Å; C244-D264 WeakPolarHBondContact CB-O 3.28Å; C244-D264 PolarHBondContact N-O 3.29Å; S245-D264 PolarHBondContact N-O 2.73Å; D264-S266 WeakPolarHBondContact OD1-CB 3.37Å; D264-S266 PolarHBondContact OD1-N 3.42Å; D264-S266 PolarHBondContact OD1-OG 3.05Å; D264-N288 PolarHBondContact OD1-ND2 3.24Å
265	M	94.2	Very high	88.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.			trans	-111.8	16.3	176.5	-66.6	-68.7	-60.1	0	0	111.2	C244 L249 M263 N268 I270 N288 L289 N292	C244-M265 HydrophobicContact CB-CE 4.28Å; C244-M265 HydrophobicContact CB-SD 3.21Å; C244-M265 WeakPolarHBondContact CB-SD 3.26Å; C244-M265 PolarHBondContact SG-SD 2.9Å; L249-M265 HydrophobicContact CB-CE 4.48Å; L249-M265 HydrophobicContact CD1-CE 3.61Å; L249-M265 HydrophobicContact CD1-SD 4.36Å; M263-M265 HydrophobicContact CE-CE 4.39Å; M263-M265 HydrophobicContact CE-CG 3.51Å; M263-M265 HydrophobicContact CE-SD 3.23Å; M263-M265 WeakPolarHBondContact CE-SD 3.09Å; M263-M265 HydrophobicContact CG-CG 3.92Å; M263-M265 HydrophobicContact CG-SD 4.45Å; M263-M265 HydrophobicContact SD-CG 4.37Å; M265-N268 PolarHBondContact O-ND2 3.25Å; M265-I270 HydrophobicContact CB-CD1 4.43Å; M265-I270 HydrophobicContact CE-CD1 3.62Å; M265-N288 CarbonylContact C-O 3.36Å; M265-N288 WeakPolarHBondContact CA-O 3.4Å; M265-N288 WeakPolarHBondContact CB-O 3.24Å; M265-N288 PolarHBondContact N-O 2.64Å; M265-L289 HydrophobicContact CB-CD2 3.77Å; M265-L289 HydrophobicContact CG-CD2 4.37Å; M265-N292 PolarHBondContact O-ND2 3.16Å
266	S	97.1	Very high	88.7	Confident	7 Å²	7	47 Å²	47	5%	0.049	24%	0.238	C	C	.	.			trans	-66.5	158.8	-176.1	65.1	0	0	0	0	112.8	S245 H246 D264 N268 N288 S290	S245-S266 WeakPolarHBondContact CA-O 3.39Å; S245-S266 WeakPolarHBondContact CB-O 3.1Å; H246-S266 PolarHBondContact N-O 3.19Å; D264-S266 WeakPolarHBondContact OD1-CB 3.37Å; D264-S266 PolarHBondContact OD1-N 3.42Å; D264-S266 PolarHBondContact OD1-OG 3.05Å; S266-N268 PolarHBondContact O-N 2.93Å; S266-N268 PolarHBondContact O-ND2 2.93Å; S266-N288 PolarHBondContact N-O 3.1Å; S266-S290 WeakPolarHBondContact CA-O 3.32Å; S266-S290 WeakPolarHBondContact CB-O 3.19Å; S266-S290 WeakPolarHBondContact CB-OG 3.39Å
267	N	97.1	Very high	88.7	Confident	61 Å²	61	48.7 Å²	48.7	33%	0.326	25%	0.246	S	C	.	.	S	Bend	trans	57.3	49.4	175.6	-55.1	-84.1	0	0	0	112.4	H246 S290 S291	H246-N267 VanDerWaalsContact CA-O 3.3Å; H246-N267 WeakPolarHBondContact CA-O 3.16Å; H246-N267 WeakPolarHBondContact CE1-CB 3.46Å; H246-N267 PolarHBondContact N-O 2.92Å; H246-N267 WeakPolarHBondContact ND1-CB 3.38Å; H246-N267 PolarHBondContact NE2-ND2 2.81Å; N267-S290 PolarHBondContact N-O 2.75Å; N267-S290 VanDerWaalsContact N-O 3.1Å; N267-S291 VanDerWaalsContact CA-O 3.23Å; N267-S291 WeakPolarHBondContact CA-O 3.33Å; N267-S291 PolarHBondContact N-O 3.17Å; N267-S291 WeakPolarHBondContact OD1-CB 3.37Å
268	N	96.1	Very high	89.2	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.043	24%	0.238	C	C	.	.	S	Bend	trans	-123.7	-171.7	173.9	-78.7	-63	0	0	0	109.1	C244 K247 D248 L249 M265 S266 I270 N292	C244-N268 PolarHBondContact O-ND2 3.09Å; K247-N268 WeakPolarHBondContact CA-OD1 3.21Å; K247-N268 PolarHBondContact N-OD1 2.99Å; D248-N268 PolarHBondContact N-OD1 2.88Å; D248-N268 VanDerWaalsContact N-OD1 3.12Å; L249-N268 HydrophobicContact CB-CB 4.18Å; L249-N268 PolarHBondContact N-OD1 2.82Å; M265-N268 PolarHBondContact O-ND2 3.25Å; S266-N268 PolarHBondContact O-N 2.93Å; S266-N268 PolarHBondContact O-ND2 2.93Å; N268-I270 HydrophobicContact CB-CD1 4.44Å; N268-I270 HydrophobicContact CB-CG1 4.2Å; N268-N292 WeakPolarHBondContact CA-OD1 3.5Å; N268-N292 WeakPolarHBondContact CB-OD1 3.34Å; N268-N292 PolarHBondContact O-OD1 3.3Å
269	I	96.1	Very high	89.4	Confident	76 Å²	76	46 Å²	46	39%	0.39	23%	0.23	S	C	.	.			trans	-115.6	31.7	-177.6	58.1	170.9	0	0	0	111.8	D248 L249 N250 T271	D248-I269 WeakPolarHBondContact O-CD1 3.48Å; D248-I269 WeakPolarHBondContact O-CG1 3.35Å; L249-I269 CarbonylContact O-C 3.46Å; L249-I269 VanDerWaalsContact O-C 3.31Å; L249-I269 WeakPolarHBondContact O-CA 3.38Å; L249-I269 VanDerWaalsContact O-CG1 3.25Å; L249-I269 WeakPolarHBondContact O-CG1 3.41Å; L249-I269 PolarHBondContact O-N 3.26Å; N250-I269 HydrophobicContact CB-CD1 4.19Å; N250-I269 HydrophobicContact CB-CG1 4.06Å; I269-T271 PolarHBondContact O-N 2.99Å
270	I	95.4	Very high	89.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.23	C	C	.	.			trans	-70.9	129	-178.3	-53.5	171.9	0	0	0	109.3	L249 I252 M265 N268 L273 L289 N292 N293 L294	L249-I270 WeakPolarHBondContact O-CG1 3.14Å; L249-I270 PolarHBondContact O-N 3.17Å; I252-I270 HydrophobicContact CG1-CD1 4.47Å; M265-I270 HydrophobicContact CB-CD1 4.43Å; M265-I270 HydrophobicContact CE-CD1 3.62Å; N268-I270 HydrophobicContact CB-CD1 4.44Å; N268-I270 HydrophobicContact CB-CG1 4.2Å; I270-L273 HydrophobicContact CG2-CD2 4.18Å; I270-L289 HydrophobicContact CD1-CD2 4.24Å; I270-N292 HydrophobicContact CB-CB 4.43Å; I270-N292 WeakPolarHBondContact CB-OD1 3.23Å; I270-N292 WeakPolarHBondContact CG1-OD1 3.44Å; I270-N292 PolarHBondContact N-OD1 3.11Å; I270-N292 VanDerWaalsContact N-OD1 3.1Å; I270-N293 CarbonylContact O-C 3.57Å; I270-N293 VanDerWaalsContact O-CA 3.32Å; I270-N293 WeakPolarHBondContact O-CA 3.37Å; I270-N293 PolarHBondContact O-N 2.81Å; I270-L294 HydrophobicContact CB-CD2 4.31Å; I270-L294 HydrophobicContact CG2-CD2 3.71Å; I270-L294 PolarHBondContact O-N 2.95Å; I270-L294 VanDerWaalsContact O-N 3.11Å
271	T	93.5	Very high	89.4	Confident	68 Å²	68	45.2 Å²	45.2	42%	0.417	23%	0.23	S	C	.	.			trans	-106.9	-24	-177.4	54.5	0	0	0	0	114.2	I269 N293 L294 Q295	I269-T271 PolarHBondContact O-N 2.99Å; T271-N293 WeakPolarHBondContact CA-O 3.45Å; T271-N293 HydrophobicContact CG2-CB 3.99Å; T271-L294 WeakPolarHBondContact O-CA 3.19Å; T271-Q295 PolarHBondContact O-N 3.44Å
272	H	92.2	Very high	89.2	Confident	59 Å²	59	46 Å²	46	27%	0.273	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	139.1	-170.4	-171.8	69	0	0	0	112	H296 D298	H272-H296 PolarHBondContact ND1-O 3.01Å; H272-D298 IonicContact CD2-OD2 3.47Å; H272-D298 IonicContact CE1-OD1 3.9Å; H272-D298 PolarHBondContact CE1-OD1 3.28Å; H272-D298 IonicContact CE1-OD2 2.7Å; H272-D298 PolarHBondContact CE1-OD2 3.1Å; H272-D298 IonicContact NE2-OD1 2.84Å; H272-D298 PolarHBondContact NE2-OD1 3.3Å; H272-D298 IonicContact NE2-OD2 3.31Å; H272-D298 PolarHBondContact NE2-OD2 3.24Å
273	L	93.2	Very high	88.8	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.7	171.5	-58.3	-175.1	0	0	0	110	I252 I270 L289 L294 I297 D298 A301 F302	I252-L273 HydrophobicContact CD1-CD2 3.57Å; I252-L273 HydrophobicContact CG1-CD2 4.3Å; I270-L273 HydrophobicContact CG2-CD2 4.18Å; L273-L289 HydrophobicContact CD1-CD1 3.82Å; L273-L294 HydrophobicContact CD1-CD1 4.37Å; L273-L294 HydrophobicContact CD2-CD2 3.96Å; L273-L294 HydrophobicContact CG-CD1 4.44Å; L273-L294 HydrophobicContact CG-CD2 3.83Å; L273-I297 HydrophobicContact CB-CG2 4.2Å; L273-I297 HydrophobicContact CD1-CD1 4.2Å; L273-I297 HydrophobicContact CD1-CG1 4.05Å; L273-I297 HydrophobicContact CD1-CG2 4.17Å; L273-I297 HydrophobicContact CG-CG1 4.34Å; L273-D298 WeakPolarHBondContact O-CB 3.5Å; L273-D298 PolarHBondContact O-N 2.91Å; L273-D298 VanDerWaalsContact O-N 3.11Å; L273-A301 HydrophobicContact CB-CB 3.9Å; L273-F302 HydrophobicContact CD1-CE1 3.71Å; L273-F302 HydrophobicContact CD1-CZ 3.73Å
274	R	87.6	Confident	88.6	Confident	127 Å²	127	48.9 Å²	48.9	48%	0.479	24%	0.241	S	C	.	.			trans	-90.3	160.4	-179.2	-49.3	-176	-163.3	-176.8	5.4	111.2	Q277 A301	R274-Q277 WeakPolarHBondContact O-CB 2.99Å; R274-Q277 PolarHBondContact O-OE1 2.86Å; R274-A301 WeakPolarHBondContact O-CA 3.3Å
275	P	83.9	Confident	88.5	Confident	63 Å²	63	49.1 Å²	49.1	41%	0.409	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	147.9	176.6	-22.1	33.8	0	0	0	112.7	Q277 D298	P275-Q277 PolarHBondContact O-N 2.98Å; P275-Q277 VanDerWaalsContact O-N 3.09Å; P275-D298 WeakPolarHBondContact CD-OD2 3.37Å; P275-D298 HydrophobicContact CG-CB 3.88Å
276	K	76.8	Confident	88.5	Confident	141 Å²	141	52.3 Å²	52.3	61%	0.613	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	14.7	172.2	-56.1	179.5	178.4	-175	0	115.4	F278 L279 A300	K276-F278 PolarHBondContact O-N 3.04Å; K276-L279 HydrophobicContact CB-CB 4.12Å; K276-L279 HydrophobicContact CB-CD2 4.25Å; K276-L279 HydrophobicContact CD-CD2 4.32Å; K276-L279 HydrophobicContact CG-CD2 4.44Å; K276-L279 VanDerWaalsContact O-CB 3.26Å; K276-L279 WeakPolarHBondContact O-CB 3.46Å; K276-L279 PolarHBondContact O-N 3.06Å; K276-A300 PolarHBondContact N-O 3.37Å
277	Q	79.9	Confident	88.4	Confident	50 Å²	50	52 Å²	52	23%	0.234	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.5	-174.9	-150.2	153.1	-5.4	0	0	112.6	I252 R274 P275	I252-Q277 HydrophobicContact CB-CG 4.29Å; I252-Q277 HydrophobicContact CD1-CG 4.13Å; R274-Q277 WeakPolarHBondContact O-CB 2.99Å; R274-Q277 PolarHBondContact O-OE1 2.86Å; P275-Q277 PolarHBondContact O-N 2.98Å; P275-Q277 VanDerWaalsContact O-N 3.09Å
278	F	87.1	Confident	88.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	10.8	175.3	-58.5	-76	0	0	0	114.1	I252 L256 M263 K276 L280 S281 L287 A301 F302 L305	I252-F278 HydrophobicContact CD1-CE1 3.96Å; I252-F278 HydrophobicContact CD1-CE2 3.66Å; I252-F278 HydrophobicContact CD1-CZ 3.24Å; I252-F278 HydrophobicContact CG1-CZ 4.27Å; I252-F278 HydrophobicContact CG2-CE1 4.43Å; L256-F278 HydrophobicContact CD1-CD1 3.78Å; L256-F278 HydrophobicContact CD1-CE1 4.04Å; M263-F278 HydrophobicContact SD-CE1 4.28Å; K276-F278 PolarHBondContact O-N 3.04Å; F278-L280 PolarHBondContact O-N 3.47Å; F278-S281 PolarHBondContact O-N 3.19Å; F278-L287 HydrophobicContact CE1-CD1 4.13Å; F278-L287 HydrophobicContact CE1-CD2 4.14Å; F278-L287 HydrophobicContact CE2-CD2 4.03Å; F278-L287 HydrophobicContact CZ-CD1 4.15Å; F278-L287 HydrophobicContact CZ-CD2 3.72Å; F278-A301 WeakPolarHBondContact CD2-O 3.35Å; F278-F302 HydrophobicContact CD2-CD1 4.28Å; F278-F302 HydrophobicContact CE2-CD1 4.17Å; F278-F302 HydrophobicContact CE2-CE1 4.32Å; F278-L305 HydrophobicContact CB-CD1 3.94Å; F278-L305 HydrophobicContact CB-CD2 3.62Å; F278-L305 HydrophobicContact CB-CG 3.68Å; F278-L305 HydrophobicContact CD2-CD1 3.95Å; F278-L305 HydrophobicContact CG-CD1 3.92Å; F278-L305 HydrophobicContact CG-CD2 4.24Å; F278-L305 HydrophobicContact CG-CG 4.24Å
279	L	82.1	Confident	88.5	Confident	75 Å²	75	50 Å²	50	39%	0.393	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-32.4	-169.2	-174.1	68	0	0	0	113.8	K276 A303	K276-L279 HydrophobicContact CB-CB 4.12Å; K276-L279 HydrophobicContact CB-CD2 4.25Å; K276-L279 HydrophobicContact CD-CD2 4.32Å; K276-L279 HydrophobicContact CG-CD2 4.44Å; K276-L279 VanDerWaalsContact O-CB 3.26Å; K276-L279 WeakPolarHBondContact O-CB 3.46Å; K276-L279 PolarHBondContact O-N 3.06Å; L279-A303 WeakPolarHBondContact CA-O 3.47Å
280	L	77.3	Confident	88.6	Confident	119 Å²	119	47 Å²	47	62%	0.623	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-15.8	-178	-58.6	-178.4	0	0	0	113.6	L258 F278 K282	L258-L280 HydrophobicContact CD2-CB 3.59Å; L258-L280 HydrophobicContact CD2-CD1 4.41Å; L258-L280 WeakPolarHBondContact CD2-O 3.37Å; F278-L280 PolarHBondContact O-N 3.47Å; L280-K282 PolarHBondContact O-N 3.15Å; L280-K282 VanDerWaalsContact O-N 3.09Å
281	S	82.8	Confident	88.7	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.014	24%	0.241	C	C	.	.			trans	-88.3	51.1	-178.4	-59.9	0	0	0	0	111.3	L256 F278 E283 L284	L256-S281 WeakPolarHBondContact CB-OG 3.29Å; F278-S281 PolarHBondContact O-N 3.19Å; S281-E283 PolarHBondContact O-N 3.17Å; S281-E283 VanDerWaalsContact O-N 3.17Å; S281-L284 VanDerWaalsContact O-CB 3.26Å; S281-L284 WeakPolarHBondContact O-CB 3.48Å; S281-L284 PolarHBondContact O-N 2.94Å; S281-L284 VanDerWaalsContact O-N 3.13Å
282	K	81.6	Confident	88.9	Confident	66 Å²	66	45.6 Å²	45.6	29%	0.287	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-29.6	-173.6	-61.6	-171.6	-178.7	-171.7	0	112.7	D119 E144 L280 L284 Y307	D119-K282 IonicContact OD2-NZ 3.19Å; D119-K282 PolarHBondContact OD2-NZ 3.31Å; E144-K282 IonicContact OE1-NZ 3.18Å; L280-K282 PolarHBondContact O-N 3.15Å; L280-K282 VanDerWaalsContact O-N 3.09Å; K282-L284 VanDerWaalsContact C-N 3.25Å; K282-L284 PolarHBondContact O-N 3.18Å; K282-Y307 VanDerWaalsContact O-CD2 3.31Å; K282-Y307 WeakPolarHBondContact O-CD2 3.32Å
283	E	83.4	Confident	89.2	Confident	66 Å²	66	46.4 Å²	46.4	31%	0.308	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-2.1	-178	-64.7	-63.3	150.8	0	0	114.5	I260 S281 K285	I260-E283 CarbonylContact O-C 3.46Å; S281-E283 PolarHBondContact O-N 3.17Å; S281-E283 VanDerWaalsContact O-N 3.17Å; E283-K285 PolarHBondContact O-N 2.93Å
284	L	89.8	Confident	89.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.228	C	C	.	.			trans	-69.4	122.4	-175.1	-168.3	75.2	0	0	0	111.3	I260 M263 S281 K282 L287 L305 Y307 L308	I260-L284 HydrophobicContact CD1-CD1 4.09Å; I260-L284 HydrophobicContact CG1-CD1 3.94Å; I260-L284 PolarHBondContact O-N 3.48Å; M263-L284 HydrophobicContact CB-CD1 3.69Å; M263-L284 HydrophobicContact CB-CD2 4.46Å; S281-L284 VanDerWaalsContact O-CB 3.26Å; S281-L284 WeakPolarHBondContact O-CB 3.48Å; S281-L284 PolarHBondContact O-N 2.94Å; S281-L284 VanDerWaalsContact O-N 3.13Å; K282-L284 VanDerWaalsContact C-N 3.25Å; K282-L284 PolarHBondContact O-N 3.18Å; L284-L287 HydrophobicContact CD2-CB 4.01Å; L284-L287 HydrophobicContact CD2-CD1 4.25Å; L284-L287 HydrophobicContact CD2-CD2 4.39Å; L284-L287 HydrophobicContact CD2-CG 4.44Å; L284-L305 HydrophobicContact CB-CD2 3.86Å; L284-L305 HydrophobicContact CD2-CD1 4.44Å; L284-L305 HydrophobicContact CD2-CD2 3.73Å; L284-L305 HydrophobicContact CG-CD2 4.38Å; L284-Y307 CarbonylContact O-C 3.47Å; L284-L308 HydrophobicContact CD2-CD1 4.27Å; L284-L308 HydrophobicContact CG-CD1 4.23Å; L284-L308 WeakPolarHBondContact O-CA 3.49Å; L284-L308 PolarHBondContact O-N 3.22Å
285	K	90.7	Very high	89.6	Confident	42 Å²	42	44.9 Å²	44.9	18%	0.183	23%	0.227	C	C	.	.			trans	-109.7	-27.4	-179.4	-65.7	175.9	-168.8	165.2	0	112.9	C166 V261 E283 R309 D310	C166-K285 PolarHBondContact SG-NZ 3.28Å; C166-K285 VanDerWaalsContact SG-NZ 3.37Å; V261-K285 HydrophobicContact CG1-CB 4.29Å; V261-K285 HydrophobicContact CG1-CD 3.94Å; V261-K285 HydrophobicContact CG1-CG 4.27Å; V261-K285 PolarHBondContact O-N 3.05Å; E283-K285 PolarHBondContact O-N 2.93Å; K285-R309 HydrophobicContact CB-CG 4.48Å; K285-R309 PolarHBondContact O-N 3.26Å; K285-D310 PolarHBondContact O-N 2.99Å
286	L	94.1	Very high	89.8	Confident	67 Å²	67	46 Å²	46	35%	0.351	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.7	179.6	-176.1	151.7	0	0	0	109.4	V261 G262 M263 N288 D310	V261-L286 PolarHBondContact O-N 2.96Å; G262-L286 CarbonylContact C-O 3.51Å; G262-L286 VanDerWaalsContact CA-O 3.32Å; G262-L286 WeakPolarHBondContact CA-O 3.15Å; M263-L286 PolarHBondContact N-O 3.27Å; L286-N288 HydrophobicContact CD2-CB 4.4Å; L286-D310 WeakPolarHBondContact CA-O 3.47Å; L286-D310 HydrophobicContact CD1-CB 4.48Å; L286-D310 HydrophobicContact CG-CB 4.29Å
287	L	96.5	Very high	90.7	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.4	174.1	179	56.5	0	0	0	108.8	M263 F278 L284 L289 F302 L305 L308 D310 L311 D312	M263-L287 HydrophobicContact CB-CD1 4.21Å; M263-L287 HydrophobicContact CG-CD1 4.4Å; F278-L287 HydrophobicContact CE1-CD1 4.13Å; F278-L287 HydrophobicContact CE1-CD2 4.14Å; F278-L287 HydrophobicContact CE2-CD2 4.03Å; F278-L287 HydrophobicContact CZ-CD1 4.15Å; F278-L287 HydrophobicContact CZ-CD2 3.72Å; L284-L287 HydrophobicContact CD2-CB 4.01Å; L284-L287 HydrophobicContact CD2-CD1 4.25Å; L284-L287 HydrophobicContact CD2-CD2 4.39Å; L284-L287 HydrophobicContact CD2-CG 4.44Å; L287-L289 HydrophobicContact CD1-CD1 4.22Å; L287-L289 HydrophobicContact CD1-CG 4.06Å; L287-L289 HydrophobicContact CD2-CD1 3.79Å; L287-L289 HydrophobicContact CD2-CG 4.5Å; L287-L289 HydrophobicContact CG-CD1 3.87Å; L287-L289 HydrophobicContact CG-CG 4.07Å; L287-F302 HydrophobicContact CD2-CD1 4.27Å; L287-F302 HydrophobicContact CD2-CE1 4.01Å; L287-L305 HydrophobicContact CD2-CD1 3.92Å; L287-L308 HydrophobicContact CB-CD1 3.71Å; L287-L308 HydrophobicContact CB-CD2 4.38Å; L287-D310 PolarHBondContact N-O 3.35Å; L287-L311 HydrophobicContact CB-CD1 4.18Å; L287-L311 HydrophobicContact CD2-CD1 4.08Å; L287-L311 HydrophobicContact CG-CD1 4.11Å; L287-L311 WeakPolarHBondContact O-CA 3.22Å; L287-D312 PolarHBondContact O-N 3.14Å
288	N	97.5	Very high	91.2	Very high	28 Å²	28	39.6 Å²	39.6	15%	0.15	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	114.3	173.5	-173.3	1.3	0	0	0	109.8	M263 D264 M265 S266 L286 S290	M263-N288 PolarHBondContact O-N 3.39Å; D264-N288 PolarHBondContact OD1-ND2 3.24Å; M265-N288 CarbonylContact C-O 3.36Å; M265-N288 WeakPolarHBondContact CA-O 3.4Å; M265-N288 WeakPolarHBondContact CB-O 3.24Å; M265-N288 PolarHBondContact N-O 2.64Å; S266-N288 PolarHBondContact N-O 3.1Å; L286-N288 HydrophobicContact CD2-CB 4.4Å; N288-S290 WeakPolarHBondContact OD1-CB 3.24Å; N288-S290 PolarHBondContact OD1-N 3.38Å; N288-S290 PolarHBondContact OD1-OG 3.36Å; N288-S290 VanDerWaalsContact OD1-OG 3.04Å
289	L	97.6	Very high	91.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.22	C	C	.	.			trans	-118.8	18.4	175	-75.9	162.5	0	0	0	111	M265 I270 L273 L287 N292 L294 F302 D312 L313 N316	M265-L289 HydrophobicContact CB-CD2 3.77Å; M265-L289 HydrophobicContact CG-CD2 4.37Å; I270-L289 HydrophobicContact CD1-CD2 4.24Å; L273-L289 HydrophobicContact CD1-CD1 3.82Å; L287-L289 HydrophobicContact CD1-CD1 4.22Å; L287-L289 HydrophobicContact CD1-CG 4.06Å; L287-L289 HydrophobicContact CD2-CD1 3.79Å; L287-L289 HydrophobicContact CD2-CG 4.5Å; L287-L289 HydrophobicContact CG-CD1 3.87Å; L287-L289 HydrophobicContact CG-CG 4.07Å; L289-N292 PolarHBondContact O-ND2 3.46Å; L289-N292 VanDerWaalsContact O-ND2 3.11Å; L289-L294 HydrophobicContact CB-CD1 4.22Å; L289-F302 HydrophobicContact CD1-CE1 4.18Å; L289-D312 CarbonylContact C-O 3.07Å; L289-D312 WeakPolarHBondContact CA-O 3.49Å; L289-D312 PolarHBondContact N-O 2.97Å; L289-L313 HydrophobicContact CB-CD2 3.93Å; L289-L313 HydrophobicContact CD1-CD2 4.05Å; L289-N316 PolarHBondContact O-ND2 2.96Å
290	S	98.3	Very high	91.3	Very high	11 Å²	11	41 Å²	41	8%	0.077	22%	0.216	C	C	.	.			trans	-64.4	157.8	-177	79.5	0	0	0	0	112.2	S266 N267 N288 N292 D312 S314	S266-S290 WeakPolarHBondContact CA-O 3.32Å; S266-S290 WeakPolarHBondContact CB-O 3.19Å; S266-S290 WeakPolarHBondContact CB-OG 3.39Å; N267-S290 PolarHBondContact N-O 2.75Å; N267-S290 VanDerWaalsContact N-O 3.1Å; N288-S290 WeakPolarHBondContact OD1-CB 3.24Å; N288-S290 PolarHBondContact OD1-N 3.38Å; N288-S290 PolarHBondContact OD1-OG 3.36Å; N288-S290 VanDerWaalsContact OD1-OG 3.04Å; S290-N292 VanDerWaalsContact C-N 3.29Å; S290-N292 PolarHBondContact O-N 2.91Å; S290-N292 PolarHBondContact O-ND2 3.05Å; S290-D312 PolarHBondContact N-O 2.89Å; S290-S314 CarbonylContact C-O 3.48Å; S290-S314 WeakPolarHBondContact CA-O 3.22Å; S290-S314 WeakPolarHBondContact CB-OG 2.74Å
291	S	98.1	Very high	91.9	Very high	35 Å²	35	35.3 Å²	35.3	25%	0.245	19%	0.187	C	C	.	.	S	Bend	trans	55	46.4	174.3	-53.8	0	0	0	0	112.1	N267 S314 N315	N267-S291 VanDerWaalsContact CA-O 3.23Å; N267-S291 WeakPolarHBondContact CA-O 3.33Å; N267-S291 PolarHBondContact N-O 3.17Å; N267-S291 WeakPolarHBondContact OD1-CB 3.37Å; S291-S314 PolarHBondContact N-O 3.37Å; S291-N315 VanDerWaalsContact CA-O 3.24Å; S291-N315 WeakPolarHBondContact CA-O 3.12Å; S291-N315 PolarHBondContact N-O 3.23Å; S291-N315 PolarHBondContact OG-ND2 2.92Å
292	N	97.7	Very high	92.4	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.027	19%	0.187	C	C	.	.	S	Bend	trans	-116.3	-172.4	172.1	-86.6	-84.5	0	0	0	109.1	M265 N268 I270 L289 S290 L294 N315 N316	M265-N292 PolarHBondContact O-ND2 3.16Å; N268-N292 WeakPolarHBondContact CA-OD1 3.5Å; N268-N292 WeakPolarHBondContact CB-OD1 3.34Å; N268-N292 PolarHBondContact O-OD1 3.3Å; I270-N292 HydrophobicContact CB-CB 4.43Å; I270-N292 WeakPolarHBondContact CB-OD1 3.23Å; I270-N292 WeakPolarHBondContact CG1-OD1 3.44Å; I270-N292 PolarHBondContact N-OD1 3.11Å; I270-N292 VanDerWaalsContact N-OD1 3.1Å; L289-N292 PolarHBondContact O-ND2 3.46Å; L289-N292 VanDerWaalsContact O-ND2 3.11Å; S290-N292 VanDerWaalsContact C-N 3.29Å; S290-N292 PolarHBondContact O-N 2.91Å; S290-N292 PolarHBondContact O-ND2 3.05Å; N292-L294 HydrophobicContact CB-CG 4.27Å; N292-N315 PolarHBondContact N-O 3.41Å; N292-N316 WeakPolarHBondContact CA-OD1 3.34Å; N292-N316 WeakPolarHBondContact CB-OD1 3.47Å; N292-N316 PolarHBondContact N-OD1 3.46Å; N292-N316 PolarHBondContact O-OD1 3.11Å; N292-N316 VanDerWaalsContact O-OD1 3.14Å
293	N	96.6	Very high	92.5	Very high	75 Å²	75	32.7 Å²	32.7	40%	0.401	18%	0.177	S	C	.	.			trans	-108.9	30.1	178.2	-67.9	-36.5	0	0	0	111.8	I270 T271 Q295	I270-N293 CarbonylContact O-C 3.57Å; I270-N293 VanDerWaalsContact O-CA 3.32Å; I270-N293 WeakPolarHBondContact O-CA 3.37Å; I270-N293 PolarHBondContact O-N 2.81Å; T271-N293 WeakPolarHBondContact CA-O 3.45Å; T271-N293 HydrophobicContact CG2-CB 3.99Å; N293-Q295 PolarHBondContact O-N 2.99Å; N293-Q295 VanDerWaalsContact O-N 3.16Å
294	L	96.9	Very high	92.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.			trans	-62.8	119.2	-174.6	-67.1	173	0	0	0	110.2	I270 T271 L273 L289 N292 L313 N316 S317 L318	I270-L294 HydrophobicContact CB-CD2 4.31Å; I270-L294 HydrophobicContact CG2-CD2 3.71Å; I270-L294 PolarHBondContact O-N 2.95Å; I270-L294 VanDerWaalsContact O-N 3.11Å; T271-L294 WeakPolarHBondContact O-CA 3.19Å; L273-L294 HydrophobicContact CD1-CD1 4.37Å; L273-L294 HydrophobicContact CD2-CD2 3.96Å; L273-L294 HydrophobicContact CG-CD1 4.44Å; L273-L294 HydrophobicContact CG-CD2 3.83Å; L289-L294 HydrophobicContact CB-CD1 4.22Å; N292-L294 HydrophobicContact CB-CG 4.27Å; L294-L313 HydrophobicContact CD1-CD2 3.9Å; L294-N316 HydrophobicContact CB-CB 4.08Å; L294-N316 VanDerWaalsContact CB-OD1 3.22Å; L294-N316 WeakPolarHBondContact CB-OD1 3.26Å; L294-N316 WeakPolarHBondContact CG-OD1 3.44Å; L294-N316 PolarHBondContact N-OD1 2.92Å; L294-S317 CarbonylContact O-C 3.58Å; L294-S317 WeakPolarHBondContact O-CA 3.43Å; L294-S317 WeakPolarHBondContact O-CB 3.48Å; L294-S317 PolarHBondContact O-N 3.01Å; L294-L318 HydrophobicContact CB-CD2 4.09Å; L294-L318 HydrophobicContact CB-CG 4.35Å; L294-L318 PolarHBondContact O-N 2.99Å
295	Q	93.6	Very high	92	Very high	96 Å²	96	30 Å²	30	45%	0.449	17%	0.168	S	C	.	.			trans	-103.2	-35.8	175.9	-67	174.3	35.3	0	0	111.2	T271 N293	T271-Q295 PolarHBondContact O-N 3.44Å; N293-Q295 PolarHBondContact O-N 2.99Å; N293-Q295 VanDerWaalsContact O-N 3.16Å
296	H	87.7	Confident	91.5	Very high	86 Å²	86	29 Å²	29	40%	0.398	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.7	-176.8	-59	-60.2	0	0	0	110.5	H272	H272-H296 PolarHBondContact ND1-O 3.01Å
297	I	94.8	Very high	91.1	Very high	9 Å²	9	26.7 Å²	26.7	5%	0.046	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	118.4	172.4	-61	176.3	0	0	0	105.2	L273 A301 F302 L313 L318 F321 V325	L273-I297 HydrophobicContact CB-CG2 4.2Å; L273-I297 HydrophobicContact CD1-CD1 4.2Å; L273-I297 HydrophobicContact CD1-CG1 4.05Å; L273-I297 HydrophobicContact CD1-CG2 4.17Å; L273-I297 HydrophobicContact CG-CG1 4.34Å; I297-A301 HydrophobicContact CG2-CB 3.59Å; I297-F302 HydrophobicContact CD1-CE2 4.11Å; I297-F302 HydrophobicContact CD1-CZ 4.01Å; I297-F302 HydrophobicContact CG2-CD2 4.46Å; I297-F302 HydrophobicContact CG2-CE2 3.89Å; I297-F302 HydrophobicContact CG2-CZ 4.23Å; I297-L313 HydrophobicContact CD1-CD1 4.07Å; I297-L313 HydrophobicContact CD1-CD2 4.12Å; I297-L318 HydrophobicContact CD1-CD1 4.24Å; I297-L318 HydrophobicContact CD1-CD2 3.93Å; I297-L318 HydrophobicContact CG1-CD2 3.89Å; I297-F321 HydrophobicContact CD1-CE1 3.91Å; I297-V325 HydrophobicContact CB-CG1 4.18Å; I297-V325 HydrophobicContact CG2-CG1 3.61Å; I297-V325 HydrophobicContact CG2-CG2 4.45Å; I297-V325 WeakPolarHBondContact O-CG2 3.45Å
298	D	91.1	Very high	90.9	Very high	49 Å²	49	26.6 Å²	26.6	26%	0.262	15%	0.15	S	C	.	.			trans	-67	155.9	178.9	-77	-23.2	0	0	0	111.3	H272 L273 P275 A300 A301	H272-D298 IonicContact CD2-OD2 3.47Å; H272-D298 IonicContact CE1-OD1 3.9Å; H272-D298 PolarHBondContact CE1-OD1 3.28Å; H272-D298 IonicContact CE1-OD2 2.7Å; H272-D298 PolarHBondContact CE1-OD2 3.1Å; H272-D298 IonicContact NE2-OD1 2.84Å; H272-D298 PolarHBondContact NE2-OD1 3.3Å; H272-D298 IonicContact NE2-OD2 3.31Å; H272-D298 PolarHBondContact NE2-OD2 3.24Å; L273-D298 WeakPolarHBondContact O-CB 3.5Å; L273-D298 PolarHBondContact O-N 2.91Å; L273-D298 VanDerWaalsContact O-N 3.11Å; P275-D298 WeakPolarHBondContact CD-OD2 3.37Å; P275-D298 HydrophobicContact CG-CB 3.88Å; D298-A300 PolarHBondContact O-N 3.36Å; D298-A301 WeakPolarHBondContact O-CB 3.46Å; D298-A301 PolarHBondContact O-N 3.16Å; D298-A301 VanDerWaalsContact O-N 3.1Å
299	T	87.8	Confident	90.6	Very high	65 Å²	65	27.6 Å²	27.6	40%	0.399	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	139.2	167.7	34.6	0	0	0	0	111.2	A301 Q322 Y323	T299-A301 PolarHBondContact O-N 3.05Å; T299-Q322 HydrophobicContact CG2-CB 4.39Å; T299-Y323 WeakPolarHBondContact CG2-O 3.29Å
300	A	84.6	Confident	90.5	Very high	39 Å²	39	29.3 Å²	29.3	32%	0.322	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	18.7	-175	0	0	0	0	0	115.2	K276 D298 F302 A303	K276-A300 PolarHBondContact N-O 3.37Å; D298-A300 PolarHBondContact O-N 3.36Å; A300-F302 VanDerWaalsContact C-N 3.28Å; A300-F302 PolarHBondContact O-N 3.44Å; A300-A303 HydrophobicContact CB-CB 3.89Å; A300-A303 WeakPolarHBondContact O-CB 3.4Å; A300-A303 PolarHBondContact O-N 3.3Å; A300-A303 VanDerWaalsContact O-N 3.15Å
301	A	89.9	Confident	90.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-40.4	172	0	0	0	0	0	112.1	L273 R274 F278 I297 D298 T299 A303	L273-A301 HydrophobicContact CB-CB 3.9Å; R274-A301 WeakPolarHBondContact O-CA 3.3Å; F278-A301 WeakPolarHBondContact CD2-O 3.35Å; I297-A301 HydrophobicContact CG2-CB 3.59Å; D298-A301 WeakPolarHBondContact O-CB 3.46Å; D298-A301 PolarHBondContact O-N 3.16Å; D298-A301 VanDerWaalsContact O-N 3.1Å; T299-A301 PolarHBondContact O-N 3.05Å; A301-A303 VanDerWaalsContact C-N 3.3Å; A301-A303 PolarHBondContact O-N 3.49Å
302	F	92.5	Very high	90.5	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	12.6	176.1	-58.6	-54.5	0	0	0	113.9	L273 F278 L287 L289 I297 A300 G304 L305 L311 L313 V325 L326 L329	L273-F302 HydrophobicContact CD1-CE1 3.71Å; L273-F302 HydrophobicContact CD1-CZ 3.73Å; F278-F302 HydrophobicContact CD2-CD1 4.28Å; F278-F302 HydrophobicContact CE2-CD1 4.17Å; F278-F302 HydrophobicContact CE2-CE1 4.32Å; L287-F302 HydrophobicContact CD2-CD1 4.27Å; L287-F302 HydrophobicContact CD2-CE1 4.01Å; L289-F302 HydrophobicContact CD1-CE1 4.18Å; I297-F302 HydrophobicContact CD1-CE2 4.11Å; I297-F302 HydrophobicContact CD1-CZ 4.01Å; I297-F302 HydrophobicContact CG2-CD2 4.46Å; I297-F302 HydrophobicContact CG2-CE2 3.89Å; I297-F302 HydrophobicContact CG2-CZ 4.23Å; A300-F302 VanDerWaalsContact C-N 3.28Å; A300-F302 PolarHBondContact O-N 3.44Å; F302-G304 PolarHBondContact O-N 3.24Å; F302-L305 HydrophobicContact CB-CD1 4.13Å; F302-L305 HydrophobicContact CD1-CD1 3.86Å; F302-L305 HydrophobicContact CG-CD1 4.44Å; F302-L305 VanDerWaalsContact O-CB 3.28Å; F302-L305 WeakPolarHBondContact O-CB 3.1Å; F302-L305 PolarHBondContact O-N 3.26Å; F302-L305 VanDerWaalsContact O-N 3.11Å; F302-L311 HydrophobicContact CE1-CD1 4.34Å; F302-L311 HydrophobicContact CE2-CD2 4.1Å; F302-L311 HydrophobicContact CZ-CD1 4.36Å; F302-L311 HydrophobicContact CZ-CD2 4.05Å; F302-L313 HydrophobicContact CZ-CD1 4.35Å; F302-L313 HydrophobicContact CZ-CD2 4.4Å; F302-V325 HydrophobicContact CD2-CG1 4.13Å; F302-V325 WeakPolarHBondContact CD2-O 3.49Å; F302-V325 HydrophobicContact CE2-CG1 4.03Å; F302-L326 HydrophobicContact CD2-CD2 4.45Å; F302-L326 HydrophobicContact CE2-CD2 4.43Å; F302-L329 HydrophobicContact CB-CD1 4.39Å; F302-L329 HydrophobicContact CB-CD2 4.04Å; F302-L329 HydrophobicContact CB-CG 4.35Å; F302-L329 HydrophobicContact CD2-CD1 4.09Å; F302-L329 HydrophobicContact CG-CD1 4.37Å
303	A	84.5	Confident	90.5	Very high	10 Å²	10	28.9 Å²	28.9	8%	0.083	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	136	-178.4	0	0	0	0	0	111.8	L279 A300 A301 L305 D328	L279-A303 WeakPolarHBondContact CA-O 3.47Å; A300-A303 HydrophobicContact CB-CB 3.89Å; A300-A303 WeakPolarHBondContact O-CB 3.4Å; A300-A303 PolarHBondContact O-N 3.3Å; A300-A303 VanDerWaalsContact O-N 3.15Å; A301-A303 VanDerWaalsContact C-N 3.3Å; A301-A303 PolarHBondContact O-N 3.49Å; A303-L305 VanDerWaalsContact C-N 3.35Å; A303-D328 VanDerWaalsContact CA-OD2 3.24Å; A303-D328 WeakPolarHBondContact CA-OD2 3.45Å; A303-D328 WeakPolarHBondContact CB-OD2 3.24Å
304	G	75.4	Confident	90.6	Very high	11 Å²	11	25.9 Å²	25.9	11%	0.113	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-8.2	-175.3	0	0	0	0	0	115.1	F302 L306	F302-G304 PolarHBondContact O-N 3.24Å; G304-L306 PolarHBondContact O-N 3.4Å
305	L	87.4	Confident	90.7	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.			trans	-82	48.4	175.7	-64.6	-175	0	0	0	112.8	F278 L284 L287 F302 A303 Y307 L308 L329	F278-L305 HydrophobicContact CB-CD1 3.94Å; F278-L305 HydrophobicContact CB-CD2 3.62Å; F278-L305 HydrophobicContact CB-CG 3.68Å; F278-L305 HydrophobicContact CD2-CD1 3.95Å; F278-L305 HydrophobicContact CG-CD1 3.92Å; F278-L305 HydrophobicContact CG-CD2 4.24Å; F278-L305 HydrophobicContact CG-CG 4.24Å; L284-L305 HydrophobicContact CB-CD2 3.86Å; L284-L305 HydrophobicContact CD2-CD1 4.44Å; L284-L305 HydrophobicContact CD2-CD2 3.73Å; L284-L305 HydrophobicContact CG-CD2 4.38Å; L287-L305 HydrophobicContact CD2-CD1 3.92Å; F302-L305 HydrophobicContact CB-CD1 4.13Å; F302-L305 HydrophobicContact CD1-CD1 3.86Å; F302-L305 HydrophobicContact CG-CD1 4.44Å; F302-L305 VanDerWaalsContact O-CB 3.28Å; F302-L305 WeakPolarHBondContact O-CB 3.1Å; F302-L305 PolarHBondContact O-N 3.26Å; F302-L305 VanDerWaalsContact O-N 3.11Å; A303-L305 VanDerWaalsContact C-N 3.35Å; L305-Y307 PolarHBondContact O-N 3.29Å; L305-L308 HydrophobicContact CB-CB 4.13Å; L305-L308 HydrophobicContact CD1-CD2 4.12Å; L305-L308 WeakPolarHBondContact O-CB 3.27Å; L305-L308 PolarHBondContact O-N 3.18Å; L305-L308 VanDerWaalsContact O-N 3.15Å; L305-L329 HydrophobicContact CB-CD2 3.98Å
306	L	80	Confident	90.9	Very high	20 Å²	20	24.9 Å²	24.9	11%	0.105	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.2	-171.5	-58.7	176.7	0	0	0	112.6	E144 G304 D328 F331	E144-L306 WeakPolarHBondContact OE1-CD1 3.39Å; G304-L306 PolarHBondContact O-N 3.4Å; L306-D328 HydrophobicContact CD2-CB 4.18Å; L306-F331 WeakPolarHBondContact O-CD2 3.46Å
307	Y	84.2	Confident	91.4	Very high	18 Å²	18	23 Å²	23	7%	0.071	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	10.3	-177.1	-57	-76.9	0	0	0	114.4	D169 S170 K282 L284 L305 R309 F331	D169-Y307 HydrophobicContact CB-CE1 4.29Å; S170-Y307 WeakPolarHBondContact CB-OH 3.46Å; S170-Y307 PolarHBondContact OG-OH 3.01Å; S170-Y307 VanDerWaalsContact OG-OH 3.13Å; K282-Y307 VanDerWaalsContact O-CD2 3.31Å; K282-Y307 WeakPolarHBondContact O-CD2 3.32Å; L284-Y307 CarbonylContact O-C 3.47Å; L305-Y307 PolarHBondContact O-N 3.29Å; Y307-R309 PolarHBondContact O-N 2.77Å; Y307-F331 HydrophobicContact CD1-CD2 4.17Å; Y307-F331 HydrophobicContact CD1-CE2 4.43Å; Y307-F331 HydrophobicContact CE1-CE2 4.48Å
308	L	92.8	Very high	91.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.132	C	C	.	.			trans	-62.9	127.4	-179.7	-163.4	72.1	0	0	0	110.3	L284 L287 L305 L311 L329 F331 L332	L284-L308 HydrophobicContact CD2-CD1 4.27Å; L284-L308 HydrophobicContact CG-CD1 4.23Å; L284-L308 WeakPolarHBondContact O-CA 3.49Å; L284-L308 PolarHBondContact O-N 3.22Å; L287-L308 HydrophobicContact CB-CD1 3.71Å; L287-L308 HydrophobicContact CB-CD2 4.38Å; L305-L308 HydrophobicContact CB-CB 4.13Å; L305-L308 HydrophobicContact CD1-CD2 4.12Å; L305-L308 WeakPolarHBondContact O-CB 3.27Å; L305-L308 PolarHBondContact O-N 3.18Å; L305-L308 VanDerWaalsContact O-N 3.15Å; L308-L311 HydrophobicContact CD2-CB 3.93Å; L308-L311 HydrophobicContact CD2-CD1 4.28Å; L308-L311 HydrophobicContact CD2-CD2 4.28Å; L308-L311 HydrophobicContact CD2-CG 4.39Å; L308-L329 HydrophobicContact CB-CD2 4.07Å; L308-L329 HydrophobicContact CD2-CD1 4.48Å; L308-L329 HydrophobicContact CD2-CD2 3.86Å; L308-F331 CarbonylContact O-C 3.2Å; L308-L332 HydrophobicContact CB-CD1 4.5Å; L308-L332 HydrophobicContact CD2-CD1 4.13Å; L308-L332 HydrophobicContact CG-CD1 4.16Å; L308-L332 VanDerWaalsContact O-CA 3.3Å; L308-L332 WeakPolarHBondContact O-CA 2.96Å; L308-L332 PolarHBondContact O-N 3.01Å
309	R	90.7	Very high	91.7	Very high	49 Å²	49	26.2 Å²	26.2	19%	0.185	14%	0.142	C	C	.	.			trans	-107.3	-41.5	-178.9	-62.4	-177.4	179.5	-173.1	-6.5	111.5	C209 K285 Y307 R333 R334	C209-R309 PolarHBondContact SG-NH2 3.06Å; K285-R309 HydrophobicContact CB-CG 4.48Å; K285-R309 PolarHBondContact O-N 3.26Å; Y307-R309 PolarHBondContact O-N 2.77Å; R309-R333 HydrophobicContact CB-CG 4.44Å; R309-R333 WeakPolarHBondContact O-CA 3.46Å; R309-R333 PolarHBondContact O-N 3.1Å; R309-R334 PolarHBondContact O-N 2.73Å
310	D	96.1	Very high	92.1	Very high	35 Å²	35	26.3 Å²	26.3	19%	0.187	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	113.5	-172.8	-61.3	-35.7	0	0	0	108.8	K285 L286 L287 R334	K285-D310 PolarHBondContact O-N 2.99Å; L286-D310 WeakPolarHBondContact CA-O 3.47Å; L286-D310 HydrophobicContact CD1-CB 4.48Å; L286-D310 HydrophobicContact CG-CB 4.29Å; L287-D310 PolarHBondContact N-O 3.35Å; D310-R334 VanDerWaalsContact CG-CZ 3.49Å; D310-R334 WeakPolarHBondContact OD1-CB 3.45Å; D310-R334 IonicContact OD1-CZ 3.47Å; D310-R334 IonicContact OD1-NE 2.91Å; D310-R334 IonicContact OD1-NH1 3.73Å; D310-R334 PolarHBondContact OD1-NH1 3.09Å; D310-R334 IonicContact OD1-NH2 2.63Å; D310-R334 PolarHBondContact OD1-NH2 2.97Å; D310-R334 VanDerWaalsContact OD1-NH2 3.09Å; D310-R334 IonicContact OD2-CZ 3.18Å; D310-R334 IonicContact OD2-NH2 2.67Å; D310-R334 PolarHBondContact OD2-NH2 3.47Å
311	L	97.9	Very high	92.6	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	115.8	175.2	178.4	55.9	0	0	0	108.9	L287 F302 L308 L313 L329 L332 R334 L335 T336	L287-L311 HydrophobicContact CB-CD1 4.18Å; L287-L311 HydrophobicContact CD2-CD1 4.08Å; L287-L311 HydrophobicContact CG-CD1 4.11Å; L287-L311 WeakPolarHBondContact O-CA 3.22Å; F302-L311 HydrophobicContact CE1-CD1 4.34Å; F302-L311 HydrophobicContact CE2-CD2 4.1Å; F302-L311 HydrophobicContact CZ-CD1 4.36Å; F302-L311 HydrophobicContact CZ-CD2 4.05Å; L308-L311 HydrophobicContact CD2-CB 3.93Å; L308-L311 HydrophobicContact CD2-CD1 4.28Å; L308-L311 HydrophobicContact CD2-CD2 4.28Å; L308-L311 HydrophobicContact CD2-CG 4.39Å; L311-L313 HydrophobicContact CD1-CD1 4.4Å; L311-L313 HydrophobicContact CD1-CD2 4.35Å; L311-L313 HydrophobicContact CD1-CG 4.02Å; L311-L313 HydrophobicContact CD2-CD1 3.89Å; L311-L313 HydrophobicContact CD2-CG 4.37Å; L311-L313 HydrophobicContact CG-CD1 4.04Å; L311-L313 HydrophobicContact CG-CG 3.99Å; L311-L329 HydrophobicContact CD2-CD1 3.84Å; L311-L332 HydrophobicContact CB-CD1 3.7Å; L311-L332 HydrophobicContact CB-CD2 4.43Å; L311-R334 PolarHBondContact N-O 3.18Å; L311-L335 HydrophobicContact CB-CD1 4.19Å; L311-L335 HydrophobicContact CD2-CD1 4.05Å; L311-L335 HydrophobicContact CG-CD1 4.1Å; L311-L335 WeakPolarHBondContact O-CA 3.38Å; L311-T336 PolarHBondContact O-N 3.47Å
312	D	98.5	Very high	92.6	Very high	41 Å²	41	28.7 Å²	28.7	22%	0.219	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.8	174	-166.1	-19.1	0	0	0	109.9	L287 L289 S290 S314	L287-D312 PolarHBondContact O-N 3.14Å; L289-D312 CarbonylContact C-O 3.07Å; L289-D312 WeakPolarHBondContact CA-O 3.49Å; L289-D312 PolarHBondContact N-O 2.97Å; S290-D312 PolarHBondContact N-O 2.89Å; D312-S314 WeakPolarHBondContact OD1-CB 3.5Å; D312-S314 PolarHBondContact OD1-N 3.36Å; D312-S314 PolarHBondContact OD1-OG 2.75Å
313	L	98.1	Very high	92.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.17	C	C	.	.			trans	-119	15.9	176.3	-70.6	169.2	0	0	0	111.1	L289 L294 I297 F302 L311 N316 L318 F321 T336 L337 N340	L289-L313 HydrophobicContact CB-CD2 3.93Å; L289-L313 HydrophobicContact CD1-CD2 4.05Å; L294-L313 HydrophobicContact CD1-CD2 3.9Å; I297-L313 HydrophobicContact CD1-CD1 4.07Å; I297-L313 HydrophobicContact CD1-CD2 4.12Å; F302-L313 HydrophobicContact CZ-CD1 4.35Å; F302-L313 HydrophobicContact CZ-CD2 4.4Å; L311-L313 HydrophobicContact CD1-CD1 4.4Å; L311-L313 HydrophobicContact CD1-CD2 4.35Å; L311-L313 HydrophobicContact CD1-CG 4.02Å; L311-L313 HydrophobicContact CD2-CD1 3.89Å; L311-L313 HydrophobicContact CD2-CG 4.37Å; L311-L313 HydrophobicContact CG-CD1 4.04Å; L311-L313 HydrophobicContact CG-CG 3.99Å; L313-N316 PolarHBondContact O-ND2 2.62Å; L313-L318 HydrophobicContact CB-CD1 4.07Å; L313-L318 HydrophobicContact CD1-CD1 4.41Å; L313-L318 HydrophobicContact CD2-CD1 4.5Å; L313-F321 HydrophobicContact CD1-CE1 4.39Å; L313-F321 HydrophobicContact CD1-CZ 3.81Å; L313-T336 CarbonylContact C-O 3.22Å; L313-T336 PolarHBondContact N-O 2.89Å; L313-L337 HydrophobicContact CB-CD2 4Å; L313-L337 HydrophobicContact CD1-CD2 4.16Å; L313-N340 PolarHBondContact O-ND2 3.24Å
314	S	98.3	Very high	92.3	Very high	11 Å²	11	36.3 Å²	36.3	8%	0.077	17%	0.171	C	C	.	.			trans	-65.3	159.2	-178.6	63.7	0	0	0	0	112.8	S290 S291 D312 N316 T336 D338	S290-S314 CarbonylContact C-O 3.48Å; S290-S314 WeakPolarHBondContact CA-O 3.22Å; S290-S314 WeakPolarHBondContact CB-OG 2.74Å; S291-S314 PolarHBondContact N-O 3.37Å; D312-S314 WeakPolarHBondContact OD1-CB 3.5Å; D312-S314 PolarHBondContact OD1-N 3.36Å; D312-S314 PolarHBondContact OD1-OG 2.75Å; S314-N316 VanDerWaalsContact C-N 3.34Å; S314-N316 PolarHBondContact O-N 3.11Å; S314-N316 PolarHBondContact O-ND2 3.37Å; S314-N316 VanDerWaalsContact O-ND2 3.11Å; S314-T336 PolarHBondContact N-O 2.93Å; S314-D338 CarbonylContact C-O 3.54Å; S314-D338 WeakPolarHBondContact CA-O 3.24Å; S314-D338 WeakPolarHBondContact CB-O 3.16Å
315	N	98.1	Very high	93.1	Very high	66 Å²	66	36 Å²	36	35%	0.353	17%	0.166	S	C	.	.	S	Bend	trans	53.4	49.5	179.6	-51.5	-33	0	0	0	112.1	S291 N292 D338 N339	S291-N315 VanDerWaalsContact CA-O 3.24Å; S291-N315 WeakPolarHBondContact CA-O 3.12Å; S291-N315 PolarHBondContact N-O 3.23Å; S291-N315 PolarHBondContact OG-ND2 2.92Å; N292-N315 PolarHBondContact N-O 3.41Å; N315-D338 PolarHBondContact N-O 3.35Å; N315-N339 WeakPolarHBondContact OD1-CB 3.43Å; N315-N339 PolarHBondContact OD1-ND2 3.2Å
316	N	98.4	Very high	93.4	Very high	9 Å²	9	36 Å²	36	5%	0.048	17%	0.166	C	C	.	.	S	Bend	trans	-121	-169.3	174	-84.5	-77.8	0	0	0	109.6	L289 N292 L294 L313 S314 L318 N340	L289-N316 PolarHBondContact O-ND2 2.96Å; N292-N316 WeakPolarHBondContact CA-OD1 3.34Å; N292-N316 WeakPolarHBondContact CB-OD1 3.47Å; N292-N316 PolarHBondContact N-OD1 3.46Å; N292-N316 PolarHBondContact O-OD1 3.11Å; N292-N316 VanDerWaalsContact O-OD1 3.14Å; L294-N316 HydrophobicContact CB-CB 4.08Å; L294-N316 VanDerWaalsContact CB-OD1 3.22Å; L294-N316 WeakPolarHBondContact CB-OD1 3.26Å; L294-N316 WeakPolarHBondContact CG-OD1 3.44Å; L294-N316 PolarHBondContact N-OD1 2.92Å; L313-N316 PolarHBondContact O-ND2 2.62Å; S314-N316 VanDerWaalsContact C-N 3.34Å; S314-N316 PolarHBondContact O-N 3.11Å; S314-N316 PolarHBondContact O-ND2 3.37Å; S314-N316 VanDerWaalsContact O-ND2 3.11Å; N316-L318 HydrophobicContact CB-CD1 4.23Å; N316-L318 HydrophobicContact CB-CG 4.18Å; N316-N340 VanDerWaalsContact CA-OD1 3.29Å; N316-N340 WeakPolarHBondContact CA-OD1 3.48Å; N316-N340 WeakPolarHBondContact CB-OD1 3.44Å; N316-N340 PolarHBondContact N-OD1 2.89Å; N316-N340 PolarHBondContact O-OD1 3.3Å
317	S	97.5	Very high	93.5	Very high	48 Å²	48	39.6 Å²	39.6	34%	0.336	18%	0.183	S	C	.	.			trans	-114.3	29.5	179.2	-66.3	0	0	0	0	112.4	L294 N340	L294-S317 CarbonylContact O-C 3.58Å; L294-S317 WeakPolarHBondContact O-CA 3.43Å; L294-S317 WeakPolarHBondContact O-CB 3.48Å; L294-S317 PolarHBondContact O-N 3.01Å; S317-N340 PolarHBondContact N-OD1 3.34Å
318	L	97.1	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.191	C	C	.	.			trans	-72.8	135.6	-176.8	-61.8	163.5	0	0	0	110.8	L294 I297 L313 N316 F321 N340 P341 W342	L294-L318 HydrophobicContact CB-CD2 4.09Å; L294-L318 HydrophobicContact CB-CG 4.35Å; L294-L318 PolarHBondContact O-N 2.99Å; I297-L318 HydrophobicContact CD1-CD1 4.24Å; I297-L318 HydrophobicContact CD1-CD2 3.93Å; I297-L318 HydrophobicContact CG1-CD2 3.89Å; L313-L318 HydrophobicContact CB-CD1 4.07Å; L313-L318 HydrophobicContact CD1-CD1 4.41Å; L313-L318 HydrophobicContact CD2-CD1 4.5Å; N316-L318 HydrophobicContact CB-CD1 4.23Å; N316-L318 HydrophobicContact CB-CG 4.18Å; L318-F321 HydrophobicContact CD1-CE1 3.99Å; L318-F321 HydrophobicContact CD1-CZ 4.45Å; L318-F321 HydrophobicContact CD2-CE1 4.42Å; L318-N340 HydrophobicContact CB-CB 4.32Å; L318-N340 WeakPolarHBondContact CB-OD1 3.44Å; L318-N340 PolarHBondContact N-OD1 3.09Å; L318-P341 CarbonylContact O-C 3.46Å; L318-P341 VanDerWaalsContact O-CD 3.23Å; L318-P341 WeakPolarHBondContact O-CD 3.27Å; L318-W342 HydrophobicContact CB-CH2 3.59Å; L318-W342 HydrophobicContact CB-CZ2 4.28Å; L318-W342 HydrophobicContact CB-CZ3 3.86Å; L318-W342 HydrophobicContact CD1-CH2 4.16Å
319	R	96.1	Very high	93.2	Very high	125 Å²	125	41 Å²	41	47%	0.472	19%	0.192	S	C	.	.			trans	-105.3	-36.3	-177.7	-68.3	175.1	-179.4	-164	6.2	113	P341 W342 I343	R319-P341 HydrophobicContact CG-CG 4.43Å; R319-W342 WeakPolarHBondContact O-CA 3.45Å; R319-I343 HydrophobicContact CB-CD1 3.93Å; R319-I343 HydrophobicContact CB-CG1 3.9Å; R319-I343 HydrophobicContact CG-CD1 3.9Å; R319-I343 HydrophobicContact CG-CG1 4.09Å; R319-I343 PolarHBondContact O-N 3.37Å
320	Y	95.1	Very high	92.5	Very high	67 Å²	67	43.8 Å²	43.8	26%	0.263	20%	0.203	S	C	.	.			trans	-166.1	174.1	176.7	58.9	-89.5	0	0	0	108	Q322 N347	Y320-Q322 HydrophobicContact CE2-CG 4.06Å; Y320-N347 HydrophobicContact CD1-CB 4.2Å; Y320-N347 HydrophobicContact CD2-CB 3.61Å; Y320-N347 HydrophobicContact CE2-CB 4.06Å; Y320-N347 HydrophobicContact CG-CB 3.7Å
321	F	95.1	Very high	91.8	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.018	20%	0.2	C	C	.	.			trans	-109.1	136.5	168.1	-66.5	-29.6	0	0	0	111	I297 L313 L318 V325 L326 L337 W342 Y350 L351	I297-F321 HydrophobicContact CD1-CE1 3.91Å; L313-F321 HydrophobicContact CD1-CE1 4.39Å; L313-F321 HydrophobicContact CD1-CZ 3.81Å; L318-F321 HydrophobicContact CD1-CE1 3.99Å; L318-F321 HydrophobicContact CD1-CZ 4.45Å; L318-F321 HydrophobicContact CD2-CE1 4.42Å; F321-V325 HydrophobicContact CB-CB 4.32Å; F321-V325 HydrophobicContact CD1-CG1 4.4Å; F321-V325 HydrophobicContact CG-CG1 4.34Å; F321-L326 HydrophobicContact CD2-CD1 3.73Å; F321-L326 HydrophobicContact CD2-CD2 4.27Å; F321-L326 HydrophobicContact CD2-CG 4Å; F321-L326 HydrophobicContact CE2-CD1 3.9Å; F321-L326 HydrophobicContact CE2-CD2 4.09Å; F321-L326 HydrophobicContact CE2-CG 4.27Å; F321-L337 HydrophobicContact CE2-CD2 4.19Å; F321-L337 HydrophobicContact CZ-CD2 3.79Å; F321-W342 AromaticContact CE1-CH2 3.97Å; F321-W342 HydrophobicContact CE1-CH2 3.97Å; F321-W342 HydrophobicContact CE1-CZ3 4.32Å; F321-W342 AromaticContact CZ-CH2 3.9Å; F321-W342 HydrophobicContact CZ-CH2 3.9Å; F321-Y350 HydrophobicContact CB-CD1 3.85Å; F321-Y350 HydrophobicContact CB-CE1 3.95Å; F321-L351 HydrophobicContact CD2-CD1 3.78Å; F321-L351 HydrophobicContact CD2-CD2 4.05Å; F321-L351 HydrophobicContact CD2-CG 4.39Å; F321-L351 HydrophobicContact CE2-CD1 3.96Å; F321-L351 HydrophobicContact CE2-CD2 4.13Å
322	Q	91.3	Very high	91.6	Very high	85 Å²	85	43.5 Å²	43.5	40%	0.397	20%	0.2	S	C	.	.			trans	-68.3	153.2	168.6	-65.8	-172.9	7.6	0	0	110.1	T299 Y320 G324 V325 Y350	T299-Q322 HydrophobicContact CG2-CB 4.39Å; Y320-Q322 HydrophobicContact CE2-CG 4.06Å; Q322-G324 PolarHBondContact O-N 2.76Å; Q322-V325 HydrophobicContact CB-CG2 4.12Å; Q322-V325 WeakPolarHBondContact O-CB 3.12Å; Q322-V325 VanDerWaalsContact O-CG2 3.27Å; Q322-V325 WeakPolarHBondContact O-CG2 3.33Å; Q322-V325 PolarHBondContact O-N 3.28Å; Q322-Y350 WeakPolarHBondContact O-CD1 3.26Å; Q322-Y350 WeakPolarHBondContact O-CE1 3.49Å
323	Y	86.9	Confident	91.2	Very high	163 Å²	163	46.3 Å²	46.3	64%	0.639	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	130.3	174.7	-177.9	-87.8	0	0	0	110.5	T299 Y350	T299-Y323 WeakPolarHBondContact CG2-O 3.29Å; Y323-Y350 AromaticContact CD2-CD2 3.63Å; Y323-Y350 HydrophobicContact CD2-CD2 3.63Å; Y323-Y350 AromaticContact CD2-CE2 3.92Å; Y323-Y350 HydrophobicContact CD2-CE2 3.92Å; Y323-Y350 HydrophobicContact CE2-CD2 4.3Å; Y323-Y350 HydrophobicContact CE2-CE2 4.35Å; Y323-Y350 HydrophobicContact CG-CD2 4.29Å; Y323-Y350 HydrophobicContact CG-CE2 4.38Å
324	G	83.3	Confident	91.1	Very high	9 Å²	9	52.1 Å²	52.1	9%	0.093	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-5.1	177.8	0	0	0	0	0	115	Q322 L326 E327 Y350	Q322-G324 PolarHBondContact O-N 2.76Å; G324-L326 PolarHBondContact O-N 3.21Å; G324-E327 PolarHBondContact O-N 3.44Å; G324-Y350 PolarHBondContact N-OH 2.79Å
325	V	92.9	Very high	91.1	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.018	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-41.4	178.5	167.7	0	0	0	0	112.1	I297 F302 F321 Q322 Y350	I297-V325 HydrophobicContact CB-CG1 4.18Å; I297-V325 HydrophobicContact CG2-CG1 3.61Å; I297-V325 HydrophobicContact CG2-CG2 4.45Å; I297-V325 WeakPolarHBondContact O-CG2 3.45Å; F302-V325 HydrophobicContact CD2-CG1 4.13Å; F302-V325 WeakPolarHBondContact CD2-O 3.49Å; F302-V325 HydrophobicContact CE2-CG1 4.03Å; F321-V325 HydrophobicContact CB-CB 4.32Å; F321-V325 HydrophobicContact CD1-CG1 4.4Å; F321-V325 HydrophobicContact CG-CG1 4.34Å; Q322-V325 HydrophobicContact CB-CG2 4.12Å; Q322-V325 WeakPolarHBondContact O-CB 3.12Å; Q322-V325 VanDerWaalsContact O-CG2 3.27Å; Q322-V325 WeakPolarHBondContact O-CG2 3.33Å; Q322-V325 PolarHBondContact O-N 3.28Å; V325-Y350 PolarHBondContact N-OH 2.94Å
326	L	93.1	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	10.1	-177.7	-54.4	177.4	0	0	0	113.1	F302 F321 G324 D328 L329 L335 Y350 L351 W354	F302-L326 HydrophobicContact CD2-CD2 4.45Å; F302-L326 HydrophobicContact CE2-CD2 4.43Å; F321-L326 HydrophobicContact CD2-CD1 3.73Å; F321-L326 HydrophobicContact CD2-CD2 4.27Å; F321-L326 HydrophobicContact CD2-CG 4Å; F321-L326 HydrophobicContact CE2-CD1 3.9Å; F321-L326 HydrophobicContact CE2-CD2 4.09Å; F321-L326 HydrophobicContact CE2-CG 4.27Å; G324-L326 PolarHBondContact O-N 3.21Å; L326-D328 VanDerWaalsContact C-N 3.33Å; L326-D328 PolarHBondContact O-N 3.14Å; L326-L329 HydrophobicContact CB-CD1 4.44Å; L326-L329 HydrophobicContact CD2-CD1 3.69Å; L326-L329 PolarHBondContact O-N 3.42Å; L326-L329 VanDerWaalsContact O-N 3.16Å; L326-L335 HydrophobicContact CD1-CD2 4.41Å; L326-Y350 HydrophobicContact CG-CE1 4.49Å; L326-Y350 PolarHBondContact N-OH 3.18Å; L326-L351 HydrophobicContact CD1-CD1 3.69Å; L326-W354 HydrophobicContact CB-CD2 3.99Å; L326-W354 HydrophobicContact CB-CG 4.17Å; L326-W354 HydrophobicContact CB-CZ2 4.11Å; L326-W354 HydrophobicContact CD1-CD2 3.88Å; L326-W354 HydrophobicContact CD1-CE3 3.88Å; L326-W354 HydrophobicContact CD1-CG 4.27Å; L326-W354 HydrophobicContact CD1-CZ3 4.31Å; L326-W354 PolarHBondContact O-NE1 2.57Å
327	E	82.6	Confident	91.1	Very high	96 Å²	96	49.1 Å²	49.1	45%	0.449	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-42.9	-169	-169.6	166.6	-176.6	0	0	113.1	G324 L329 Y330	G324-E327 PolarHBondContact O-N 3.44Å; E327-L329 VanDerWaalsContact C-N 3.34Å; E327-L329 PolarHBondContact O-N 2.98Å; E327-Y330 WeakPolarHBondContact O-CE1 3.22Å; E327-Y330 PolarHBondContact O-OH 3.04Å
328	D	79.9	Confident	91.1	Very high	48 Å²	48	49.4 Å²	49.4	26%	0.257	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-4	-176.9	-69.5	-13.9	0	0	0	114.1	A303 L306 L326 Y330	A303-D328 VanDerWaalsContact CA-OD2 3.24Å; A303-D328 WeakPolarHBondContact CA-OD2 3.45Å; A303-D328 WeakPolarHBondContact CB-OD2 3.24Å; L306-D328 HydrophobicContact CD2-CB 4.18Å; L326-D328 VanDerWaalsContact C-N 3.33Å; L326-D328 PolarHBondContact O-N 3.14Å; D328-Y330 WeakPolarHBondContact O-CD2 3.23Å; D328-Y330 PolarHBondContact O-N 2.99Å
329	L	89.3	Confident	91.1	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	24%	0.242	C	C	.	.			trans	-87.5	47.1	-172.5	-60.5	-174.5	0	0	0	113.1	F302 L305 L308 L311 L326 E327 F331 L332 W354	F302-L329 HydrophobicContact CB-CD1 4.39Å; F302-L329 HydrophobicContact CB-CD2 4.04Å; F302-L329 HydrophobicContact CB-CG 4.35Å; F302-L329 HydrophobicContact CD2-CD1 4.09Å; F302-L329 HydrophobicContact CG-CD1 4.37Å; L305-L329 HydrophobicContact CB-CD2 3.98Å; L308-L329 HydrophobicContact CB-CD2 4.07Å; L308-L329 HydrophobicContact CD2-CD1 4.48Å; L308-L329 HydrophobicContact CD2-CD2 3.86Å; L311-L329 HydrophobicContact CD2-CD1 3.84Å; L326-L329 HydrophobicContact CB-CD1 4.44Å; L326-L329 HydrophobicContact CD2-CD1 3.69Å; L326-L329 PolarHBondContact O-N 3.42Å; L326-L329 VanDerWaalsContact O-N 3.16Å; E327-L329 VanDerWaalsContact C-N 3.34Å; E327-L329 PolarHBondContact O-N 2.98Å; L329-F331 VanDerWaalsContact C-N 3.26Å; L329-F331 PolarHBondContact O-N 2.91Å; L329-L332 HydrophobicContact CB-CB 4.37Å; L329-L332 HydrophobicContact CD1-CD2 4.42Å; L329-L332 WeakPolarHBondContact O-CB 3.22Å; L329-L332 PolarHBondContact O-N 2.83Å; L329-W354 HydrophobicContact CB-CZ2 4.15Å
330	Y	77.2	Confident	91.2	Very high	106 Å²	106	49.6 Å²	49.6	42%	0.416	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.7	-172.3	-56.6	-70.9	0	0	0	114.5	E327 D328 H358	E327-Y330 WeakPolarHBondContact O-CE1 3.22Å; E327-Y330 PolarHBondContact O-OH 3.04Å; D328-Y330 WeakPolarHBondContact O-CD2 3.23Å; D328-Y330 PolarHBondContact O-N 2.99Å; Y330-H358 AromaticContact CD1-NE2 3.95Å
331	F	81.6	Confident	91.3	Very high	31 Å²	31	48.5 Å²	48.5	14%	0.136	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	13.7	-177.3	-54.1	-40.9	0	0	0	114.4	R173 L306 Y307 L308 L329 R333	R173-F331 VanDerWaalsContact NH1-CD1 3.31Å; L306-F331 WeakPolarHBondContact O-CD2 3.46Å; Y307-F331 HydrophobicContact CD1-CD2 4.17Å; Y307-F331 HydrophobicContact CD1-CE2 4.43Å; Y307-F331 HydrophobicContact CE1-CE2 4.48Å; L308-F331 CarbonylContact O-C 3.2Å; L329-F331 VanDerWaalsContact C-N 3.26Å; L329-F331 PolarHBondContact O-N 2.91Å; F331-R333 PolarHBondContact O-N 3.03Å
332	L	92.7	Very high	91.4	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	22%	0.222	C	C	.	.			trans	-59.3	133.9	175	-157.8	70.2	0	0	0	109.7	L308 L311 L329 L335 W354 V361	L308-L332 HydrophobicContact CB-CD1 4.5Å; L308-L332 HydrophobicContact CD2-CD1 4.13Å; L308-L332 HydrophobicContact CG-CD1 4.16Å; L308-L332 VanDerWaalsContact O-CA 3.3Å; L308-L332 WeakPolarHBondContact O-CA 2.96Å; L308-L332 PolarHBondContact O-N 3.01Å; L311-L332 HydrophobicContact CB-CD1 3.7Å; L311-L332 HydrophobicContact CB-CD2 4.43Å; L329-L332 HydrophobicContact CB-CB 4.37Å; L329-L332 HydrophobicContact CD1-CD2 4.42Å; L329-L332 WeakPolarHBondContact O-CB 3.22Å; L329-L332 PolarHBondContact O-N 2.83Å; L332-L335 HydrophobicContact CD2-CB 3.81Å; L332-L335 HydrophobicContact CD2-CD1 4.13Å; L332-L335 HydrophobicContact CD2-CD2 4.19Å; L332-L335 HydrophobicContact CD2-CG 4.25Å; L332-W354 HydrophobicContact CB-CH2 4.23Å; L332-W354 HydrophobicContact CD2-CH2 3.96Å; L332-V361 HydrophobicContact CB-CG2 4.34Å; L332-V361 HydrophobicContact CD2-CG1 4.45Å; L332-V361 VanDerWaalsContact O-CG2 3.26Å; L332-V361 WeakPolarHBondContact O-CG2 3.18Å
333	R	90.9	Very high	91.7	Very high	99 Å²	99	45.4 Å²	45.4	37%	0.374	21%	0.209	S	C	.	.			trans	-112.4	-39.1	178.8	-65	-174	179.2	-162.2	-5.5	110.8	D206 R309 F331 S362	D206-R333 IonicContact OD1-CZ 3.09Å; D206-R333 IonicContact OD1-NH1 3.64Å; D206-R333 PolarHBondContact OD1-NH1 2.85Å; D206-R333 IonicContact OD1-NH2 3.62Å; D206-R333 PolarHBondContact OD1-NH2 2.93Å; R309-R333 HydrophobicContact CB-CG 4.44Å; R309-R333 WeakPolarHBondContact O-CA 3.46Å; R309-R333 PolarHBondContact O-N 3.1Å; F331-R333 PolarHBondContact O-N 3.03Å; R333-S362 PolarHBondContact O-N 3.4Å
334	R	96.3	Very high	92.1	Very high	122 Å²	122	37.7 Å²	37.7	46%	0.46	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	125.7	-179.6	-175.1	167.1	53.8	-106.8	-1.7	110.6	R309 D310 L311 S362	R309-R334 PolarHBondContact O-N 2.73Å; D310-R334 VanDerWaalsContact CG-CZ 3.49Å; D310-R334 WeakPolarHBondContact OD1-CB 3.45Å; D310-R334 IonicContact OD1-CZ 3.47Å; D310-R334 IonicContact OD1-NE 2.91Å; D310-R334 IonicContact OD1-NH1 3.73Å; D310-R334 PolarHBondContact OD1-NH1 3.09Å; D310-R334 IonicContact OD1-NH2 2.63Å; D310-R334 PolarHBondContact OD1-NH2 2.97Å; D310-R334 VanDerWaalsContact OD1-NH2 3.09Å; D310-R334 IonicContact OD2-CZ 3.18Å; D310-R334 IonicContact OD2-NH2 2.67Å; D310-R334 PolarHBondContact OD2-NH2 3.47Å; L311-R334 PolarHBondContact N-O 3.18Å; R334-S362 CarbonylContact C-O 3.27Å; R334-S362 VanDerWaalsContact CA-O 3.29Å; R334-S362 WeakPolarHBondContact CA-O 3.29Å
335	L	98.1	Very high	92.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	105.6	176.1	179.6	54.1	0	0	0	109.9	L311 L326 L332 L337 W354 V361 S362 Y363 T364	L311-L335 HydrophobicContact CB-CD1 4.19Å; L311-L335 HydrophobicContact CD2-CD1 4.05Å; L311-L335 HydrophobicContact CG-CD1 4.1Å; L311-L335 WeakPolarHBondContact O-CA 3.38Å; L326-L335 HydrophobicContact CD1-CD2 4.41Å; L332-L335 HydrophobicContact CD2-CB 3.81Å; L332-L335 HydrophobicContact CD2-CD1 4.13Å; L332-L335 HydrophobicContact CD2-CD2 4.19Å; L332-L335 HydrophobicContact CD2-CG 4.25Å; L335-L337 HydrophobicContact CD1-CD1 4.46Å; L335-L337 HydrophobicContact CD1-CD2 3.93Å; L335-L337 HydrophobicContact CD1-CG 4.1Å; L335-L337 HydrophobicContact CD2-CD1 3.9Å; L335-L337 HydrophobicContact CD2-CG 4.41Å; L335-L337 HydrophobicContact CG-CD1 3.87Å; L335-L337 HydrophobicContact CG-CD2 4.21Å; L335-L337 HydrophobicContact CG-CG 3.86Å; L335-W354 HydrophobicContact CD2-CZ3 4.38Å; L335-V361 HydrophobicContact CB-CG1 3.96Å; L335-S362 PolarHBondContact N-O 3.24Å; L335-Y363 WeakPolarHBondContact O-CA 3.39Å; L335-Y363 WeakPolarHBondContact O-CB 3.19Å; L335-T364 PolarHBondContact O-N 2.89Å
336	T	98.4	Very high	92.4	Very high	24 Å²	24	47 Å²	47	15%	0.147	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.5	-178.1	-55.2	0	0	0	0	109.4	L311 L313 S314 D338	L311-T336 PolarHBondContact O-N 3.47Å; L313-T336 CarbonylContact C-O 3.22Å; L313-T336 PolarHBondContact N-O 2.89Å; S314-T336 PolarHBondContact N-O 2.93Å; T336-D338 WeakPolarHBondContact CG2-OD2 3.37Å
337	L	97.8	Very high	92.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.233	C	C	.	.			trans	-123.3	10.6	-173.1	-64.1	172.2	0	0	0	113.1	L313 F321 L335 N340 W342 L351 T364 L366	L313-L337 HydrophobicContact CB-CD2 4Å; L313-L337 HydrophobicContact CD1-CD2 4.16Å; F321-L337 HydrophobicContact CE2-CD2 4.19Å; F321-L337 HydrophobicContact CZ-CD2 3.79Å; L335-L337 HydrophobicContact CD1-CD1 4.46Å; L335-L337 HydrophobicContact CD1-CD2 3.93Å; L335-L337 HydrophobicContact CD1-CG 4.1Å; L335-L337 HydrophobicContact CD2-CD1 3.9Å; L335-L337 HydrophobicContact CD2-CG 4.41Å; L335-L337 HydrophobicContact CG-CD1 3.87Å; L335-L337 HydrophobicContact CG-CD2 4.21Å; L335-L337 HydrophobicContact CG-CG 3.86Å; L337-N340 PolarHBondContact O-ND2 2.82Å; L337-N340 VanDerWaalsContact O-ND2 3.09Å; L337-W342 HydrophobicContact CB-CZ2 3.72Å; L337-W342 HydrophobicContact CD1-CZ2 4.31Å; L337-W342 HydrophobicContact CD2-CH2 4.05Å; L337-W342 HydrophobicContact CD2-CZ2 3.79Å; L337-W342 HydrophobicContact CG-CZ2 4.15Å; L337-W342 PolarHBondContact O-NE1 3.33Å; L337-L351 HydrophobicContact CD1-CD2 4.08Å; L337-T364 WeakPolarHBondContact CA-O 3.14Å; L337-T364 VanDerWaalsContact CB-O 3.27Å; L337-T364 WeakPolarHBondContact CB-O 3.19Å; L337-T364 PolarHBondContact N-O 3.36Å; L337-L366 HydrophobicContact CB-CD2 4.26Å; L337-L366 HydrophobicContact CD1-CD1 4.22Å; L337-L366 HydrophobicContact CD1-CD2 3.58Å; L337-L366 HydrophobicContact CD1-CG 3.88Å
338	D	97.4	Very high	93	Very high	53 Å²	53	45.7 Å²	45.7	28%	0.283	21%	0.212	S	C	.	.			trans	-56.4	149.3	-175.9	-59.7	-86.1	0	0	0	112.6	S314 N315 T336 N340 T364 G365	S314-D338 CarbonylContact C-O 3.54Å; S314-D338 WeakPolarHBondContact CA-O 3.24Å; S314-D338 WeakPolarHBondContact CB-O 3.16Å; N315-D338 PolarHBondContact N-O 3.35Å; T336-D338 WeakPolarHBondContact CG2-OD2 3.37Å; D338-N340 VanDerWaalsContact C-N 3.34Å; D338-N340 PolarHBondContact O-N 3.45Å; D338-N340 PolarHBondContact O-ND2 3.02Å; D338-T364 VanDerWaalsContact OD2-CB 3.25Å; D338-T364 WeakPolarHBondContact OD2-CB 3.15Å; D338-T364 PolarHBondContact OD2-OG1 2.9Å; D338-G365 WeakPolarHBondContact OD1-CA 3.29Å; D338-G365 PolarHBondContact OD1-N 2.76Å
339	N	97.1	Very high	93.6	Very high	123 Å²	123	44.9 Å²	44.9	66%	0.658	21%	0.206	S	C	*	.	S	Bend	trans	54.8	45.7	176.6	-54.1	-43.7	0	0	0	113.8	N315	N315-N339 WeakPolarHBondContact OD1-CB 3.43Å; N315-N339 PolarHBondContact OD1-ND2 3.2Å
340	N	97.9	Very high	93.8	Very high	7 Å²	7	46 Å²	46	4%	0.037	21%	0.211	C	C	.	.			trans	-116.1	144.1	166.5	-80.5	-80.7	0	0	0	110	L313 N316 S317 L318 L337 D338 W342	L313-N340 PolarHBondContact O-ND2 3.24Å; N316-N340 VanDerWaalsContact CA-OD1 3.29Å; N316-N340 WeakPolarHBondContact CA-OD1 3.48Å; N316-N340 WeakPolarHBondContact CB-OD1 3.44Å; N316-N340 PolarHBondContact N-OD1 2.89Å; N316-N340 PolarHBondContact O-OD1 3.3Å; S317-N340 PolarHBondContact N-OD1 3.34Å; L318-N340 HydrophobicContact CB-CB 4.32Å; L318-N340 WeakPolarHBondContact CB-OD1 3.44Å; L318-N340 PolarHBondContact N-OD1 3.09Å; L337-N340 PolarHBondContact O-ND2 2.82Å; L337-N340 VanDerWaalsContact O-ND2 3.09Å; D338-N340 VanDerWaalsContact C-N 3.34Å; D338-N340 PolarHBondContact O-N 3.45Å; D338-N340 PolarHBondContact O-ND2 3.02Å; N340-W342 HydrophobicContact CB-CD2 4.16Å; N340-W342 VanDerWaalsContact CB-CE2 3.44Å; N340-W342 HydrophobicContact CB-CH2 4.32Å; N340-W342 HydrophobicContact CB-CZ2 3.5Å; N340-W342 VanDerWaalsContact CB-CZ2 3.5Å; N340-W342 PolarHBondContact O-N 2.84Å
341	P	97.2	Very high	94.5	Very high	43 Å²	43	41 Å²	41	28%	0.279	19%	0.191	S	C	.	.			trans	-78.7	63.2	-179.1	34.3	-37.9	0	0	0	112.4	L318 R319 I343	L318-P341 CarbonylContact O-C 3.46Å; L318-P341 VanDerWaalsContact O-CD 3.23Å; L318-P341 WeakPolarHBondContact O-CD 3.27Å; R319-P341 HydrophobicContact CG-CG 4.43Å; P341-I343 PolarHBondContact O-N 3.36Å
342	W	97.4	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.191	C	C	.	.			trans	-57.6	126.4	-178.7	-59.3	113.1	0	0	0	111.8	L318 R319 F321 L337 N340 I348 G365 L366 S369 Q370	L318-W342 HydrophobicContact CB-CH2 3.59Å; L318-W342 HydrophobicContact CB-CZ2 4.28Å; L318-W342 HydrophobicContact CB-CZ3 3.86Å; L318-W342 HydrophobicContact CD1-CH2 4.16Å; R319-W342 WeakPolarHBondContact O-CA 3.45Å; F321-W342 AromaticContact CE1-CH2 3.97Å; F321-W342 HydrophobicContact CE1-CH2 3.97Å; F321-W342 HydrophobicContact CE1-CZ3 4.32Å; F321-W342 AromaticContact CZ-CH2 3.9Å; F321-W342 HydrophobicContact CZ-CH2 3.9Å; L337-W342 HydrophobicContact CB-CZ2 3.72Å; L337-W342 HydrophobicContact CD1-CZ2 4.31Å; L337-W342 HydrophobicContact CD2-CH2 4.05Å; L337-W342 HydrophobicContact CD2-CZ2 3.79Å; L337-W342 HydrophobicContact CG-CZ2 4.15Å; L337-W342 PolarHBondContact O-NE1 3.33Å; N340-W342 HydrophobicContact CB-CD2 4.16Å; N340-W342 VanDerWaalsContact CB-CE2 3.44Å; N340-W342 HydrophobicContact CB-CH2 4.32Å; N340-W342 HydrophobicContact CB-CZ2 3.5Å; N340-W342 VanDerWaalsContact CB-CZ2 3.5Å; N340-W342 PolarHBondContact O-N 2.84Å; W342-I348 HydrophobicContact CB-CD1 4.48Å; W342-I348 HydrophobicContact CE3-CD1 3.97Å; W342-G365 VanDerWaalsContact CD1-O 3.26Å; W342-G365 PolarHBondContact NE1-O 2.78Å; W342-L366 HydrophobicContact CD2-CD2 4.08Å; W342-L366 HydrophobicContact CG-CD2 4.31Å; W342-L366 HydrophobicContact CZ2-CD2 4.34Å; W342-S369 PolarHBondContact O-N 3.11Å; W342-Q370 PolarHBondContact O-N 2.84Å
343	I	97	Very high	95.1	Very high	24 Å²	24	46.7 Å²	46.7	12%	0.123	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-97.1	114.8	175.7	-55.6	-172.9	0	0	0	107.6	R319 P341 D345 Q370	R319-I343 HydrophobicContact CB-CD1 3.93Å; R319-I343 HydrophobicContact CB-CG1 3.9Å; R319-I343 HydrophobicContact CG-CD1 3.9Å; R319-I343 HydrophobicContact CG-CG1 4.09Å; R319-I343 PolarHBondContact O-N 3.37Å; P341-I343 PolarHBondContact O-N 3.36Å; I343-D345 VanDerWaalsContact C-N 3.32Å; I343-D345 HydrophobicContact CG2-CB 4.21Å; I343-D345 PolarHBondContact O-N 3.24Å; I343-D345 VanDerWaalsContact O-N 3.11Å; I343-Q370 HydrophobicContact CG1-CB 4.14Å; I343-Q370 HydrophobicContact CG2-CB 4.3Å
344	C	95.8	Very high	95.2	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.007	20%	0.199	C	C	.	.			trans	-85.8	78.2	177	-69.9	0	0	0	0	109.9	C368 Q370 P371 Y382	C344-C368 HydrophobicContact CB-CB 3.85Å; C344-C368 WeakPolarHBondContact CB-SG 3.41Å; C344-C368 VanDerWaalsContact SG-CA 3.51Å; C344-C368 WeakPolarHBondContact SG-CB 3.23Å; C344-C368 CovalentContact SG-SG 2.01Å; C344-C368 PolarHBondContact SG-SG 3.02Å; C344-Q370 PolarHBondContact N-O 3.23Å; C344-P371 VanDerWaalsContact O-CD 3.29Å; C344-P371 WeakPolarHBondContact O-CD 3.45Å; C344-Y382 HydrophobicContact CB-CD1 3.73Å; C344-Y382 HydrophobicContact CB-CD2 4.08Å; C344-Y382 HydrophobicContact CB-CE1 4Å; C344-Y382 HydrophobicContact CB-CE2 4.32Å; C344-Y382 HydrophobicContact CB-CG 3.78Å; C344-Y382 WeakPolarHBondContact O-CE2 3.46Å; C344-Y382 PolarHBondContact O-OH 3Å
345	D	93.3	Very high	95.1	Very high	50 Å²	50	37.1 Å²	37.1	27%	0.267	18%	0.179	S	C	.	.	S	Bend	trans	-123.4	-168.5	169	69	15.2	0	0	0	109.9	I343 N347 I348 Y382	I343-D345 VanDerWaalsContact C-N 3.32Å; I343-D345 HydrophobicContact CG2-CB 4.21Å; I343-D345 PolarHBondContact O-N 3.24Å; I343-D345 VanDerWaalsContact O-N 3.11Å; D345-N347 PolarHBondContact O-N 3.35Å; D345-N347 VanDerWaalsContact O-N 3.13Å; D345-N347 WeakPolarHBondContact OD1-CA 3.36Å; D345-N347 VanDerWaalsContact OD1-CB 3.26Å; D345-N347 WeakPolarHBondContact OD1-CB 3.49Å; D345-N347 PolarHBondContact OD1-N 3.4Å; D345-N347 PolarHBondContact OD1-ND2 3.09Å; D345-N347 PolarHBondContact OD2-ND2 3.17Å; D345-I348 VanDerWaalsContact O-CG2 3.29Å; D345-I348 WeakPolarHBondContact O-CG2 3.24Å; D345-I348 PolarHBondContact O-N 2.83Å; D345-Y382 WeakPolarHBondContact CA-OH 3.46Å
346	Y	90.3	Very high	94.6	Very high	159 Å²	159	45.2 Å²	45.2	62%	0.624	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-55.4	-30.8	178.4	-179.5	-101.5	0	0	0	114.1	I348 H349	Y346-I348 VanDerWaalsContact C-N 3.29Å; Y346-I348 PolarHBondContact O-N 3.47Å; Y346-H349 WeakPolarHBondContact O-CB 3.29Å; Y346-H349 PolarHBondContact O-CD2 2.95Å; Y346-H349 PolarHBondContact O-N 2.83Å
347	N	92.5	Very high	94	Very high	68 Å²	68	49.2 Å²	49.2	36%	0.364	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-71.4	-23.3	-175.8	-57.9	-64.2	0	0	0	112.9	Y320 D345 H349	Y320-N347 HydrophobicContact CD1-CB 4.2Å; Y320-N347 HydrophobicContact CD2-CB 3.61Å; Y320-N347 HydrophobicContact CE2-CB 4.06Å; Y320-N347 HydrophobicContact CG-CB 3.7Å; D345-N347 PolarHBondContact O-N 3.35Å; D345-N347 VanDerWaalsContact O-N 3.13Å; D345-N347 WeakPolarHBondContact OD1-CA 3.36Å; D345-N347 VanDerWaalsContact OD1-CB 3.26Å; D345-N347 WeakPolarHBondContact OD1-CB 3.49Å; D345-N347 PolarHBondContact OD1-N 3.4Å; D345-N347 PolarHBondContact OD1-ND2 3.09Å; D345-N347 PolarHBondContact OD2-ND2 3.17Å; N347-H349 PolarHBondContact O-N 3.37Å
348	I	94.3	Very high	93.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-70.3	-17.3	179.1	-149.1	65.4	0	0	0	112.5	W342 D345 Y346 Y350 L351 V379 Y382 V383	W342-I348 HydrophobicContact CB-CD1 4.48Å; W342-I348 HydrophobicContact CE3-CD1 3.97Å; D345-I348 VanDerWaalsContact O-CG2 3.29Å; D345-I348 WeakPolarHBondContact O-CG2 3.24Å; D345-I348 PolarHBondContact O-N 2.83Å; Y346-I348 VanDerWaalsContact C-N 3.29Å; Y346-I348 PolarHBondContact O-N 3.47Å; I348-Y350 PolarHBondContact O-N 3.37Å; I348-L351 PolarHBondContact O-N 3.3Å; I348-L351 VanDerWaalsContact O-N 3.14Å; I348-V379 HydrophobicContact CB-CG1 4.41Å; I348-V379 HydrophobicContact CG1-CG1 3.48Å; I348-V379 VanDerWaalsContact CG1-CG1 3.48Å; I348-V379 HydrophobicContact CG1-CG2 4.34Å; I348-V379 HydrophobicContact CG2-CG1 3.98Å; I348-Y382 HydrophobicContact CG2-CD1 3.93Å; I348-Y382 HydrophobicContact CG2-CE1 3.86Å; I348-V383 HydrophobicContact CG2-CG2 4.06Å
349	H	92.2	Very high	93	Very high	31 Å²	31	53.9 Å²	53.9	14%	0.144	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-33.6	-177.4	-77.1	-125.6	0	0	0	112.7	Y346 N347 L351 V352 Y353 Y386	Y346-H349 WeakPolarHBondContact O-CB 3.29Å; Y346-H349 PolarHBondContact O-CD2 2.95Å; Y346-H349 PolarHBondContact O-N 2.83Å; N347-H349 PolarHBondContact O-N 3.37Å; H349-L351 VanDerWaalsContact C-N 3.3Å; H349-L351 PolarHBondContact O-N 2.85Å; H349-V352 PolarHBondContact O-N 3.14Å; H349-Y353 VanDerWaalsContact O-CB 3.24Å; H349-Y353 WeakPolarHBondContact O-CB 3.43Å; H349-Y353 PolarHBondContact O-N 3.39Å; H349-Y386 AromaticContact CE1-CD1 3.29Å; H349-Y386 WeakPolarHBondContact CE1-CD1 3.13Å; H349-Y386 AromaticContact CE1-CE1 3.78Å; H349-Y386 AromaticContact CE1-CG 3.77Å; H349-Y386 AromaticContact NE2-CD1 3.74Å; H349-Y386 AromaticContact NE2-CG 3.79Å
350	Y	93.4	Very high	92.5	Very high	25 Å²	25	52.6 Å²	52.6	10%	0.098	26%	0.262	C	S	.	.	H	α-helix	trans	-58.5	-43.2	177.6	166.1	-110	0	0	0	111.8	F321 Q322 Y323 G324 V325 L326 I348 Y353 W354	F321-Y350 HydrophobicContact CB-CD1 3.85Å; F321-Y350 HydrophobicContact CB-CE1 3.95Å; Q322-Y350 WeakPolarHBondContact O-CD1 3.26Å; Q322-Y350 WeakPolarHBondContact O-CE1 3.49Å; Y323-Y350 AromaticContact CD2-CD2 3.63Å; Y323-Y350 HydrophobicContact CD2-CD2 3.63Å; Y323-Y350 AromaticContact CD2-CE2 3.92Å; Y323-Y350 HydrophobicContact CD2-CE2 3.92Å; Y323-Y350 HydrophobicContact CE2-CD2 4.3Å; Y323-Y350 HydrophobicContact CE2-CE2 4.35Å; Y323-Y350 HydrophobicContact CG-CD2 4.29Å; Y323-Y350 HydrophobicContact CG-CE2 4.38Å; G324-Y350 PolarHBondContact N-OH 2.79Å; V325-Y350 PolarHBondContact N-OH 2.94Å; L326-Y350 HydrophobicContact CG-CE1 4.49Å; L326-Y350 PolarHBondContact N-OH 3.18Å; I348-Y350 PolarHBondContact O-N 3.37Å; Y350-Y353 WeakPolarHBondContact O-CB 3.29Å; Y350-Y353 PolarHBondContact O-N 3.3Å; Y350-W354 HydrophobicContact CE2-CB 4.48Å; Y350-W354 WeakPolarHBondContact O-CB 3.39Å; Y350-W354 PolarHBondContact O-N 3.28Å
351	L	93.7	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-43.5	-177.2	-176.5	49.1	0	0	0	111.3	F321 L326 L337 I348 H349 W354 L355 L366	F321-L351 HydrophobicContact CD2-CD1 3.78Å; F321-L351 HydrophobicContact CD2-CD2 4.05Å; F321-L351 HydrophobicContact CD2-CG 4.39Å; F321-L351 HydrophobicContact CE2-CD1 3.96Å; F321-L351 HydrophobicContact CE2-CD2 4.13Å; L326-L351 HydrophobicContact CD1-CD1 3.69Å; L337-L351 HydrophobicContact CD1-CD2 4.08Å; I348-L351 PolarHBondContact O-N 3.3Å; I348-L351 VanDerWaalsContact O-N 3.14Å; H349-L351 VanDerWaalsContact C-N 3.3Å; H349-L351 PolarHBondContact O-N 2.85Å; L351-W354 PolarHBondContact O-N 3.21Å; L351-L355 HydrophobicContact CD1-CD1 4.28Å; L351-L355 HydrophobicContact CD1-CG 4.38Å; L351-L355 HydrophobicContact CG-CD1 4.28Å; L351-L355 WeakPolarHBondContact O-CB 3.33Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.25Å; L351-L355 PolarHBondContact O-N 3.35Å; L351-L366 HydrophobicContact CD2-CD1 3.96Å; L351-L366 HydrophobicContact CD2-CD2 3.57Å; L351-L366 HydrophobicContact CD2-CG 4.43Å; L351-L366 HydrophobicContact CG-CD1 4.06Å
352	V	94	Very high	92.2	Very high	23 Å²	23	54.6 Å²	54.6	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-65.5	-41.8	174.8	179.2	0	0	0	0	111.4	H349 W354 L355 K356 V379 V383	H349-V352 PolarHBondContact O-N 3.14Å; V352-W354 VanDerWaalsContact C-N 3.33Å; V352-W354 PolarHBondContact O-N 3.18Å; V352-L355 PolarHBondContact O-N 3.04Å; V352-K356 WeakPolarHBondContact O-CB 3.17Å; V352-K356 PolarHBondContact O-N 3.06Å; V352-V379 HydrophobicContact CG2-CG1 3.6Å; V352-V383 HydrophobicContact CB-CG1 4.41Å; V352-V383 HydrophobicContact CB-CG2 4.22Å; V352-V383 HydrophobicContact CG1-CB 4.32Å; V352-V383 HydrophobicContact CG1-CG1 4.06Å; V352-V383 HydrophobicContact CG1-CG2 4.5Å; V352-V383 HydrophobicContact CG2-CB 4.35Å; V352-V383 HydrophobicContact CG2-CG2 3.74Å
353	Y	91.4	Very high	92.1	Very high	128 Å²	128	57.6 Å²	57.6	50%	0.502	29%	0.289	S	S	.	.	H	α-helix	trans	-58	-47.3	174.6	170.4	-91.7	0	0	0	111.2	H349 Y350 K356 H357	H349-Y353 VanDerWaalsContact O-CB 3.24Å; H349-Y353 WeakPolarHBondContact O-CB 3.43Å; H349-Y353 PolarHBondContact O-N 3.39Å; Y350-Y353 WeakPolarHBondContact O-CB 3.29Å; Y350-Y353 PolarHBondContact O-N 3.3Å; Y353-K356 PolarHBondContact O-N 3.24Å; Y353-H357 AromaticContact CD2-CE1 3.61Å; Y353-H357 AromaticContact CD2-ND1 3.95Å; Y353-H357 AromaticContact CE2-CE1 3.13Å; Y353-H357 WeakPolarHBondContact CE2-CE1 3Å; Y353-H357 AromaticContact CE2-ND1 3.75Å; Y353-H357 AromaticContact CE2-NE2 3.92Å; Y353-H357 AromaticContact CZ-CE1 3.41Å; Y353-H357 VanDerWaalsContact CZ-CE1 3.41Å; Y353-H357 AromaticContact CZ-ND1 3.76Å; Y353-H357 AromaticContact CZ-NE2 3.97Å; Y353-H357 PolarHBondContact O-N 3.27Å; Y353-H357 PolarHBondContact O-ND1 3.33Å
354	W	93.9	Very high	92.1	Very high	10 Å²	10	59.5 Å²	59.5	4%	0.038	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-46.3	179.6	-175.1	93.2	0	0	0	111.3	L326 L329 L332 L335 Y350 L351 V352 K356 H357 H358 V361	L326-W354 HydrophobicContact CB-CD2 3.99Å; L326-W354 HydrophobicContact CB-CG 4.17Å; L326-W354 HydrophobicContact CB-CZ2 4.11Å; L326-W354 HydrophobicContact CD1-CD2 3.88Å; L326-W354 HydrophobicContact CD1-CE3 3.88Å; L326-W354 HydrophobicContact CD1-CG 4.27Å; L326-W354 HydrophobicContact CD1-CZ3 4.31Å; L326-W354 PolarHBondContact O-NE1 2.57Å; L329-W354 HydrophobicContact CB-CZ2 4.15Å; L332-W354 HydrophobicContact CB-CH2 4.23Å; L332-W354 HydrophobicContact CD2-CH2 3.96Å; L335-W354 HydrophobicContact CD2-CZ3 4.38Å; Y350-W354 HydrophobicContact CE2-CB 4.48Å; Y350-W354 WeakPolarHBondContact O-CB 3.39Å; Y350-W354 PolarHBondContact O-N 3.28Å; L351-W354 PolarHBondContact O-N 3.21Å; V352-W354 VanDerWaalsContact C-N 3.33Å; V352-W354 PolarHBondContact O-N 3.18Å; W354-K356 VanDerWaalsContact C-N 3.31Å; W354-K356 PolarHBondContact O-N 2.81Å; W354-H357 PolarHBondContact O-N 3.13Å; W354-H357 VanDerWaalsContact O-N 3.09Å; W354-H358 AromaticContact CD1-CE1 3.79Å; W354-H358 AromaticContact CD1-ND1 3.95Å; W354-H358 AromaticContact CD2-ND1 3.63Å; W354-H358 AromaticContact CE2-CE1 3.55Å; W354-H358 AromaticContact CE2-ND1 3.46Å; W354-H358 AromaticContact CG-ND1 3.94Å; W354-H358 HydrophobicContact CH2-CB 4.26Å; W354-H358 AromaticContact CZ2-CE1 4Å; W354-H358 AromaticContact CZ2-CG 3.93Å; W354-H358 AromaticContact CZ2-ND1 3.86Å; W354-H358 HydrophobicContact CZ3-CB 4.27Å; W354-H358 AromaticContact NE1-CE1 3.36Å; W354-H358 PolarHBondContact NE1-CE1 3.21Å; W354-H358 AromaticContact NE1-ND1 3.68Å; W354-H358 PolarHBondContact O-N 3.3Å; W354-H358 VanDerWaalsContact O-N 3.17Å; W354-H358 PolarHBondContact O-ND1 3.33Å; W354-V361 HydrophobicContact CH2-CG2 3.83Å; W354-V361 HydrophobicContact CZ3-CB 4.47Å; W354-V361 HydrophobicContact CZ3-CG1 4.28Å; W354-V361 HydrophobicContact CZ3-CG2 3.99Å
355	L	93.1	Very high	92.1	Very high	10 Å²	10	60.3 Å²	60.3	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-60.7	-38.9	177.3	-73.6	169.1	0	0	0	112.5	L351 V352 H357 H358 V361 Y363 L366	L351-L355 HydrophobicContact CD1-CD1 4.28Å; L351-L355 HydrophobicContact CD1-CG 4.38Å; L351-L355 HydrophobicContact CG-CD1 4.28Å; L351-L355 WeakPolarHBondContact O-CB 3.33Å; L351-L355 VanDerWaalsContact O-CG 3.29Å; L351-L355 WeakPolarHBondContact O-CG 3.25Å; L351-L355 PolarHBondContact O-N 3.35Å; V352-L355 PolarHBondContact O-N 3.04Å; L355-H357 PolarHBondContact O-N 3.09Å; L355-H358 CarbonylContact O-C 3.21Å; L355-H358 PolarHBondContact O-N 3.34Å; L355-V361 HydrophobicContact CD2-CB 4.49Å; L355-V361 HydrophobicContact CD2-CG1 4.28Å; L355-Y363 HydrophobicContact CD1-CD1 3.94Å; L355-Y363 HydrophobicContact CD1-CD2 4.28Å; L355-Y363 HydrophobicContact CD1-CE1 3.9Å; L355-Y363 HydrophobicContact CD1-CE2 4.29Å; L355-Y363 HydrophobicContact CD1-CG 4.12Å; L355-Y363 HydrophobicContact CD2-CD1 3.63Å; L355-Y363 HydrophobicContact CD2-CE1 4.23Å; L355-Y363 HydrophobicContact CD2-CG 4.04Å; L355-Y363 HydrophobicContact CG-CD1 4.35Å; L355-L366 HydrophobicContact CD1-CD1 3.5Å
356	K	88.7	Confident	92.2	Very high	171 Å²	171	58.1 Å²	58.1	74%	0.743	30%	0.299	S	S	*	.	H	α-helix	trans	-60.8	-33.6	175.7	-174.9	179.4	178.4	-178.7	0	112.7	V352 Y353 W354 H358	V352-K356 WeakPolarHBondContact O-CB 3.17Å; V352-K356 PolarHBondContact O-N 3.06Å; Y353-K356 PolarHBondContact O-N 3.24Å; W354-K356 VanDerWaalsContact C-N 3.31Å; W354-K356 PolarHBondContact O-N 2.81Å; K356-H358 VanDerWaalsContact C-N 3.33Å
357	H	85.8	Confident	92.5	Very high	107 Å²	107	52.9 Å²	52.9	50%	0.495	28%	0.284	S	S	.	.	H	α-helix	trans	-84.5	-8.9	177	-68.1	78	0	0	0	113.1	Y353 W354 L355 P359	Y353-H357 AromaticContact CD2-CE1 3.61Å; Y353-H357 AromaticContact CD2-ND1 3.95Å; Y353-H357 AromaticContact CE2-CE1 3.13Å; Y353-H357 WeakPolarHBondContact CE2-CE1 3Å; Y353-H357 AromaticContact CE2-ND1 3.75Å; Y353-H357 AromaticContact CE2-NE2 3.92Å; Y353-H357 AromaticContact CZ-CE1 3.41Å; Y353-H357 VanDerWaalsContact CZ-CE1 3.41Å; Y353-H357 AromaticContact CZ-ND1 3.76Å; Y353-H357 AromaticContact CZ-NE2 3.97Å; Y353-H357 PolarHBondContact O-N 3.27Å; Y353-H357 PolarHBondContact O-ND1 3.33Å; W354-H357 PolarHBondContact O-N 3.13Å; W354-H357 VanDerWaalsContact O-N 3.09Å; L355-H357 PolarHBondContact O-N 3.09Å; H357-P359 VanDerWaalsContact C-CD 3.45Å; H357-P359 WeakPolarHBondContact O-CD 3.29Å
358	H	88.3	Confident	92.7	Very high	32 Å²	32	49.8 Å²	49.8	15%	0.148	27%	0.267	C	S	.	.			trans	-126.2	64.1	179.1	-60	85.7	0	0	0	111.4	Y330 W354 L355 K356 S360 V361	Y330-H358 AromaticContact CD1-NE2 3.95Å; W354-H358 AromaticContact CD1-CE1 3.79Å; W354-H358 AromaticContact CD1-ND1 3.95Å; W354-H358 AromaticContact CD2-ND1 3.63Å; W354-H358 AromaticContact CE2-CE1 3.55Å; W354-H358 AromaticContact CE2-ND1 3.46Å; W354-H358 AromaticContact CG-ND1 3.94Å; W354-H358 HydrophobicContact CH2-CB 4.26Å; W354-H358 AromaticContact CZ2-CE1 4Å; W354-H358 AromaticContact CZ2-CG 3.93Å; W354-H358 AromaticContact CZ2-ND1 3.86Å; W354-H358 HydrophobicContact CZ3-CB 4.27Å; W354-H358 AromaticContact NE1-CE1 3.36Å; W354-H358 PolarHBondContact NE1-CE1 3.21Å; W354-H358 AromaticContact NE1-ND1 3.68Å; W354-H358 PolarHBondContact O-N 3.3Å; W354-H358 VanDerWaalsContact O-N 3.17Å; W354-H358 PolarHBondContact O-ND1 3.33Å; L355-H358 CarbonylContact O-C 3.21Å; L355-H358 PolarHBondContact O-N 3.34Å; K356-H358 VanDerWaalsContact C-N 3.33Å; H358-S360 PolarHBondContact O-N 2.8Å; H358-V361 HydrophobicContact CB-CG2 3.62Å; H358-V361 WeakPolarHBondContact O-CB 3.33Å; H358-V361 WeakPolarHBondContact O-CG2 3.45Å; H358-V361 PolarHBondContact O-N 2.9Å
359	P	85.9	Confident	92.8	Very high	119 Å²	119	52 Å²	52	77%	0.773	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13.3	-172.5	28.6	-37.3	0	0	0	114.3	H357 V361	H357-P359 VanDerWaalsContact C-CD 3.45Å; H357-P359 WeakPolarHBondContact O-CD 3.29Å; P359-V361 VanDerWaalsContact C-N 3.33Å
360	S	85.8	Confident	92.9	Very high	97 Å²	97	55.2 Å²	55.2	68%	0.678	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-8.5	174.9	55.3	0	0	0	0	114	H358 S362	H358-S360 PolarHBondContact O-N 2.8Å; S360-S362 PolarHBondContact O-N 2.94Å
361	V	93.3	Very high	93	Very high	12 Å²	12	55.9 Å²	55.9	7%	0.073	31%	0.305	C	S	.	.			trans	-80	116.3	179	-179.3	0	0	0	0	108.9	L332 L335 W354 L355 H358 P359	L332-V361 HydrophobicContact CB-CG2 4.34Å; L332-V361 HydrophobicContact CD2-CG1 4.45Å; L332-V361 VanDerWaalsContact O-CG2 3.26Å; L332-V361 WeakPolarHBondContact O-CG2 3.18Å; L335-V361 HydrophobicContact CB-CG1 3.96Å; W354-V361 HydrophobicContact CH2-CG2 3.83Å; W354-V361 HydrophobicContact CZ3-CB 4.47Å; W354-V361 HydrophobicContact CZ3-CG1 4.28Å; W354-V361 HydrophobicContact CZ3-CG2 3.99Å; L355-V361 HydrophobicContact CD2-CB 4.49Å; L355-V361 HydrophobicContact CD2-CG1 4.28Å; H358-V361 HydrophobicContact CB-CG2 3.62Å; H358-V361 WeakPolarHBondContact O-CB 3.33Å; H358-V361 WeakPolarHBondContact O-CG2 3.45Å; H358-V361 PolarHBondContact O-N 2.9Å; P359-V361 VanDerWaalsContact C-N 3.33Å
362	S	95.8	Very high	93	Very high	79 Å²	79	60.9 Å²	60.9	55%	0.552	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	125.2	166.2	-178.9	0	0	0	0	108.9	R333 R334 L335 S360	R333-S362 PolarHBondContact O-N 3.4Å; R334-S362 CarbonylContact C-O 3.27Å; R334-S362 VanDerWaalsContact CA-O 3.29Å; R334-S362 WeakPolarHBondContact CA-O 3.29Å; L335-S362 PolarHBondContact N-O 3.24Å; S360-S362 PolarHBondContact O-N 2.94Å
363	Y	96.6	Very high	93	Very high	63 Å²	63	65.9 Å²	65.9	25%	0.247	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	156.1	179.4	74.9	-90.3	0	0	0	112.1	L335 L355 L366 E380	L335-Y363 WeakPolarHBondContact O-CA 3.39Å; L335-Y363 WeakPolarHBondContact O-CB 3.19Å; L355-Y363 HydrophobicContact CD1-CD1 3.94Å; L355-Y363 HydrophobicContact CD1-CD2 4.28Å; L355-Y363 HydrophobicContact CD1-CE1 3.9Å; L355-Y363 HydrophobicContact CD1-CE2 4.29Å; L355-Y363 HydrophobicContact CD1-CG 4.12Å; L355-Y363 HydrophobicContact CD2-CD1 3.63Å; L355-Y363 HydrophobicContact CD2-CE1 4.23Å; L355-Y363 HydrophobicContact CD2-CG 4.04Å; L355-Y363 HydrophobicContact CG-CD1 4.35Å; Y363-L366 HydrophobicContact CD2-CB 4.36Å; Y363-L366 HydrophobicContact CD2-CD1 3.74Å; Y363-L366 HydrophobicContact CD2-CG 3.98Å; Y363-L366 HydrophobicContact CE2-CB 4.03Å; Y363-L366 HydrophobicContact CE2-CD1 3.68Å; Y363-L366 HydrophobicContact CE2-CG 4.06Å; Y363-E380 PolarHBondContact OH-OE1 3.39Å
364	T	97.1	Very high	93.1	Very high	64 Å²	64	62.5 Å²	62.5	39%	0.393	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.7	177.9	54.4	0	0	0	0	110.6	L335 L337 D338	L335-T364 PolarHBondContact O-N 2.89Å; L337-T364 WeakPolarHBondContact CA-O 3.14Å; L337-T364 VanDerWaalsContact CB-O 3.27Å; L337-T364 WeakPolarHBondContact CB-O 3.19Å; L337-T364 PolarHBondContact N-O 3.36Å; D338-T364 VanDerWaalsContact OD2-CB 3.25Å; D338-T364 WeakPolarHBondContact OD2-CB 3.15Å; D338-T364 PolarHBondContact OD2-OG1 2.9Å
365	G	94	Very high	93.2	Very high	19 Å²	19	71 Å²	71	20%	0.196	38%	0.38	C	S	.	.			trans	87.4	10	167.8	0	0	0	0	0	117.8	D338 W342 V367	D338-G365 WeakPolarHBondContact OD1-CA 3.29Å; D338-G365 PolarHBondContact OD1-N 2.76Å; W342-G365 VanDerWaalsContact CD1-O 3.26Å; W342-G365 PolarHBondContact NE1-O 2.78Å; G365-V367 VanDerWaalsContact C-N 3.31Å; G365-V367 PolarHBondContact O-N 2.01Å; G365-V367 VanDerWaalsContact O-N 3.09Å
366	L	95.4	Very high	93.3	Very high	3 Å²	3	73 Å²	73	2%	0.016	40%	0.403	C	S	.	.			trans	-85.8	69	177.2	-73.2	-172.3	0	0	0	113.2	L337 W342 L351 L355 Y363 Q378 V379	L337-L366 HydrophobicContact CB-CD2 4.26Å; L337-L366 HydrophobicContact CD1-CD1 4.22Å; L337-L366 HydrophobicContact CD1-CD2 3.58Å; L337-L366 HydrophobicContact CD1-CG 3.88Å; W342-L366 HydrophobicContact CD2-CD2 4.08Å; W342-L366 HydrophobicContact CG-CD2 4.31Å; W342-L366 HydrophobicContact CZ2-CD2 4.34Å; L351-L366 HydrophobicContact CD2-CD1 3.96Å; L351-L366 HydrophobicContact CD2-CD2 3.57Å; L351-L366 HydrophobicContact CD2-CG 4.43Å; L351-L366 HydrophobicContact CG-CD1 4.06Å; L355-L366 HydrophobicContact CD1-CD1 3.5Å; Y363-L366 HydrophobicContact CD2-CB 4.36Å; Y363-L366 HydrophobicContact CD2-CD1 3.74Å; Y363-L366 HydrophobicContact CD2-CG 3.98Å; Y363-L366 HydrophobicContact CE2-CB 4.03Å; Y363-L366 HydrophobicContact CE2-CD1 3.68Å; Y363-L366 HydrophobicContact CE2-CG 4.06Å; L366-Q378 PolarHBondContact O-OE1 3.32Å; L366-V379 HydrophobicContact CB-CB 4.15Å; L366-V379 HydrophobicContact CB-CG2 4Å; L366-V379 VanDerWaalsContact O-CG2 3.29Å; L366-V379 WeakPolarHBondContact O-CG2 3.28Å; L366-V379 PolarHBondContact O-N 3.42Å
367	V	97	Very high	93.6	Very high	50 Å²	50	70.2 Å²	70.2	30%	0.303	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-114.2	127.7	176.6	-175.9	0	0	0	0	109.9	G365 S369 W377	G365-V367 VanDerWaalsContact C-N 3.31Å; G365-V367 PolarHBondContact O-N 2.01Å; G365-V367 VanDerWaalsContact O-N 3.09Å; V367-S369 PolarHBondContact O-N 3.31Å; V367-W377 CarbonylContact C-O 3.57Å; V367-W377 WeakPolarHBondContact CA-O 3.47Å
368	C	97.4	Very high	94.1	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.014	38%	0.384	C	S	.	.			trans	-59	125.8	177.6	-61.7	0	0	0	0	110.8	C344 F374 R375 G376 W377	C344-C368 HydrophobicContact CB-CB 3.85Å; C344-C368 WeakPolarHBondContact CB-SG 3.41Å; C344-C368 VanDerWaalsContact SG-CA 3.51Å; C344-C368 WeakPolarHBondContact SG-CB 3.23Å; C344-C368 CovalentContact SG-SG 2.01Å; C344-C368 PolarHBondContact SG-SG 3.02Å; C368-F374 HydrophobicContact CB-CB 4.29Å; C368-F374 WeakPolarHBondContact CB-O 3.07Å; C368-R375 CarbonylContact O-C 3.59Å; C368-R375 WeakPolarHBondContact O-CA 3.29Å; C368-G376 PolarHBondContact O-N 3.24Å; C368-W377 HydrophobicContact CB-CB 4.38Å; C368-W377 WeakPolarHBondContact CB-O 3.44Å; C368-W377 PolarHBondContact N-O 3.04Å; C368-W377 PolarHBondContact SG-O 3.25Å
369	S	96.9	Very high	94.5	Very high	47 Å²	47	68 Å²	68	33%	0.329	38%	0.378	S	S	.	.			trans	-100.1	-30.2	171.4	-70	0	0	0	0	112.2	W342 V367	W342-S369 PolarHBondContact O-N 3.11Å; V367-S369 PolarHBondContact O-N 3.31Å
370	Q	93.9	Very high	94.8	Very high	98 Å²	98	65.9 Å²	65.9	46%	0.458	36%	0.357	S	S	.	.	B	Isolated β-bridge	trans	-138.7	161.2	175.7	-64.5	-174.2	9.3	0	0	109.6	W342 I343 C344	W342-Q370 PolarHBondContact O-N 2.84Å; I343-Q370 HydrophobicContact CG1-CB 4.14Å; I343-Q370 HydrophobicContact CG2-CB 4.3Å; C344-Q370 PolarHBondContact N-O 3.23Å
371	P	95.7	Very high	95.1	Very high	40 Å²	40	64.5 Å²	64.5	26%	0.26	34%	0.342	S	S	.	.	S	Bend	cis	-69.4	167.6	-11.8	38.1	-41.9	0	0	0	110.9	C344 E373 F374 R375	C344-P371 VanDerWaalsContact O-CD 3.29Å; C344-P371 WeakPolarHBondContact O-CD 3.45Å; P371-E373 WeakPolarHBondContact CB-OE2 3.48Å; P371-E373 WeakPolarHBondContact CG-OE2 3.44Å; P371-E373 PolarHBondContact O-N 3.32Å; P371-E373 VanDerWaalsContact O-N 3.07Å; P371-F374 HydrophobicContact CG-CD2 3.68Å; P371-F374 HydrophobicContact CG-CE2 4.23Å; P371-F374 PolarHBondContact O-N 2.54Å; P371-R375 PolarHBondContact O-N 2.8Å
372	P	93.8	Very high	95.1	Very high	104 Å²	104	64.8 Å²	64.8	68%	0.675	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-59.6	-23.4	-170	21.5	-32	0	0	0	114.1	F374 R375	P372-F374 VanDerWaalsContact C-N 3.3Å; P372-F374 PolarHBondContact O-N 3.47Å; P372-R375 PolarHBondContact O-N 2.81Å
373	E	92.8	Very high	94.9	Very high	129 Å²	129	61.4 Å²	61.4	60%	0.603	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-65.9	-32.6	177.5	-54.7	75.5	-160.5	0	0	112.3	P371	P371-E373 WeakPolarHBondContact CB-OE2 3.48Å; P371-E373 WeakPolarHBondContact CG-OE2 3.44Å; P371-E373 PolarHBondContact O-N 3.32Å; P371-E373 VanDerWaalsContact O-N 3.07Å
374	F	94.6	Very high	94.5	Very high	56 Å²	56	64.3 Å²	64.3	25%	0.246	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-105.8	8.7	-179.6	-57.1	-60.3	0	0	0	112.7	C368 P371 P372 G376 W377 Y382	C368-F374 HydrophobicContact CB-CB 4.29Å; C368-F374 WeakPolarHBondContact CB-O 3.07Å; P371-F374 HydrophobicContact CG-CD2 3.68Å; P371-F374 HydrophobicContact CG-CE2 4.23Å; P371-F374 PolarHBondContact O-N 2.54Å; P372-F374 VanDerWaalsContact C-N 3.3Å; P372-F374 PolarHBondContact O-N 3.47Å; F374-G376 PolarHBondContact O-N 3.02Å; F374-W377 HydrophobicContact CB-CB 4.5Å; F374-W377 HydrophobicContact CB-CG 4.44Å; F374-W377 HydrophobicContact CD1-CD2 4.25Å; F374-W377 HydrophobicContact CD1-CE3 4.33Å; F374-W377 VanDerWaalsContact O-CB 3.22Å; F374-W377 WeakPolarHBondContact O-CB 3.07Å; F374-W377 PolarHBondContact O-N 3.22Å; F374-Y382 AromaticContact CD1-CD2 3.99Å; F374-Y382 HydrophobicContact CD1-CD2 3.99Å; F374-Y382 AromaticContact CD2-CD2 3.68Å; F374-Y382 HydrophobicContact CD2-CD2 3.68Å; F374-Y382 AromaticContact CD2-CE2 3.66Å; F374-Y382 HydrophobicContact CD2-CE2 3.66Å; F374-Y382 HydrophobicContact CE1-CD2 4.09Å; F374-Y382 HydrophobicContact CE1-CE2 4.48Å; F374-Y382 AromaticContact CE2-CD2 3.82Å; F374-Y382 HydrophobicContact CE2-CD2 3.82Å; F374-Y382 AromaticContact CE2-CE2 3.5Å; F374-Y382 HydrophobicContact CE2-CE2 3.5Å; F374-Y382 AromaticContact CG-CD2 3.79Å; F374-Y382 HydrophobicContact CG-CD2 3.79Å; F374-Y382 HydrophobicContact CG-CE2 4.26Å; F374-Y382 HydrophobicContact CZ-CD2 4.01Å; F374-Y382 AromaticContact CZ-CE2 3.94Å; F374-Y382 HydrophobicContact CZ-CE2 3.94Å
375	R	95.5	Very high	93.9	Very high	190 Å²	190	64.1 Å²	64.1	72%	0.717	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	128	-177.7	-174.1	176.1	180	180	1.1	111.1	C368 P371 P372 W377	C368-R375 CarbonylContact O-C 3.59Å; C368-R375 WeakPolarHBondContact O-CA 3.29Å; P371-R375 PolarHBondContact O-N 2.8Å; P372-R375 PolarHBondContact O-N 2.81Å; R375-W377 VanDerWaalsContact C-N 3.3Å
376	G	94.4	Very high	93.2	Very high	52 Å²	52	67.3 Å²	67.3	54%	0.536	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	-4.9	-177.6	0	0	0	0	0	114.6	C368 F374	C368-G376 PolarHBondContact O-N 3.24Å; F374-G376 PolarHBondContact O-N 3.02Å
377	W	96.3	Very high	92.2	Very high	111 Å²	111	71.4 Å²	71.4	42%	0.42	36%	0.36	S	S	.	.			trans	-73.1	147.4	175.2	-75.3	46.5	0	0	0	111.2	V367 C368 F374 R375 D381	V367-W377 CarbonylContact C-O 3.57Å; V367-W377 WeakPolarHBondContact CA-O 3.47Å; C368-W377 HydrophobicContact CB-CB 4.38Å; C368-W377 WeakPolarHBondContact CB-O 3.44Å; C368-W377 PolarHBondContact N-O 3.04Å; C368-W377 PolarHBondContact SG-O 3.25Å; F374-W377 HydrophobicContact CB-CB 4.5Å; F374-W377 HydrophobicContact CB-CG 4.44Å; F374-W377 HydrophobicContact CD1-CD2 4.25Å; F374-W377 HydrophobicContact CD1-CE3 4.33Å; F374-W377 VanDerWaalsContact O-CB 3.22Å; F374-W377 WeakPolarHBondContact O-CB 3.07Å; F374-W377 PolarHBondContact O-N 3.22Å; R375-W377 VanDerWaalsContact C-N 3.3Å; W377-D381 HydrophobicContact CE3-CB 4.4Å
378	Q	96.3	Very high	90.7	Very high	93 Å²	93	72.2 Å²	72.2	44%	0.435	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-67	135.7	165.6	-63.6	-62.6	-30.5	0	0	108.8	L366 E380 D381 Y382	L366-Q378 PolarHBondContact O-OE1 3.32Å; Q378-E380 PolarHBondContact O-N 3.39Å; Q378-D381 HydrophobicContact CB-CB 4.48Å; Q378-D381 PolarHBondContact O-N 3.07Å; Q378-Y382 PolarHBondContact O-N 3.06Å
379	V	95.5	Very high	88.9	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.006	41%	0.41	C	S	.	.	H	α-helix	trans	-58.4	-36.8	-179	171.4	0	0	0	0	111.4	I348 V352 L366 D381 Y382 V383	I348-V379 HydrophobicContact CB-CG1 4.41Å; I348-V379 HydrophobicContact CG1-CG1 3.48Å; I348-V379 VanDerWaalsContact CG1-CG1 3.48Å; I348-V379 HydrophobicContact CG1-CG2 4.34Å; I348-V379 HydrophobicContact CG2-CG1 3.98Å; V352-V379 HydrophobicContact CG2-CG1 3.6Å; L366-V379 HydrophobicContact CB-CB 4.15Å; L366-V379 HydrophobicContact CB-CG2 4Å; L366-V379 VanDerWaalsContact O-CG2 3.29Å; L366-V379 WeakPolarHBondContact O-CG2 3.28Å; L366-V379 PolarHBondContact O-N 3.42Å; V379-D381 VanDerWaalsContact C-N 3.3Å; V379-D381 PolarHBondContact O-N 3.41Å; V379-Y382 PolarHBondContact O-N 2.99Å; V379-V383 WeakPolarHBondContact O-CG2 3.22Å; V379-V383 PolarHBondContact O-N 3.08Å; V379-V383 VanDerWaalsContact O-N 3.08Å
380	E	92.2	Very high	86.5	Confident	74 Å²	74	80.2 Å²	80.2	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-60.8	-38.4	176.7	-68.6	-168.7	169.3	0	0	112.8	Y363 Q378 V383 K384	Y363-E380 PolarHBondContact OH-OE1 3.39Å; Q378-E380 PolarHBondContact O-N 3.39Å; E380-V383 PolarHBondContact O-N 3.45Å; E380-K384 VanDerWaalsContact O-CG 3.28Å; E380-K384 WeakPolarHBondContact O-CG 3.33Å; E380-K384 PolarHBondContact O-N 3.04Å
381	D	92.6	Very high	84.2	Confident	68 Å²	68	81 Å²	81	36%	0.364	43%	0.43	S	S	.	.	H	α-helix	trans	-72.2	-39.5	-178.2	-64.7	-28.1	0	0	0	110.8	W377 Q378 V379 V383 K384 T385	W377-D381 HydrophobicContact CE3-CB 4.4Å; Q378-D381 HydrophobicContact CB-CB 4.48Å; Q378-D381 PolarHBondContact O-N 3.07Å; V379-D381 VanDerWaalsContact C-N 3.3Å; V379-D381 PolarHBondContact O-N 3.41Å; D381-V383 PolarHBondContact O-N 3.22Å; D381-K384 PolarHBondContact O-N 3.36Å; D381-K384 IonicContact OD1-NZ 2.7Å; D381-K384 PolarHBondContact OD1-NZ 3.11Å; D381-T385 PolarHBondContact O-N 3.29Å; D381-T385 PolarHBondContact O-OG1 3.46Å
382	Y	93.5	Very high	82.1	Confident	17 Å²	17	85.6 Å²	85.6	7%	0.067	46%	0.457	C	S	.	.	H	α-helix	trans	-54.9	-49.5	169.4	166.6	-100.5	0	0	0	111.9	C344 D345 I348 F374 Q378 V379 K384 T385 Y386	C344-Y382 HydrophobicContact CB-CD1 3.73Å; C344-Y382 HydrophobicContact CB-CD2 4.08Å; C344-Y382 HydrophobicContact CB-CE1 4Å; C344-Y382 HydrophobicContact CB-CE2 4.32Å; C344-Y382 HydrophobicContact CB-CG 3.78Å; C344-Y382 WeakPolarHBondContact O-CE2 3.46Å; C344-Y382 PolarHBondContact O-OH 3Å; D345-Y382 WeakPolarHBondContact CA-OH 3.46Å; I348-Y382 HydrophobicContact CG2-CD1 3.93Å; I348-Y382 HydrophobicContact CG2-CE1 3.86Å; F374-Y382 AromaticContact CD1-CD2 3.99Å; F374-Y382 HydrophobicContact CD1-CD2 3.99Å; F374-Y382 AromaticContact CD2-CD2 3.68Å; F374-Y382 HydrophobicContact CD2-CD2 3.68Å; F374-Y382 AromaticContact CD2-CE2 3.66Å; F374-Y382 HydrophobicContact CD2-CE2 3.66Å; F374-Y382 HydrophobicContact CE1-CD2 4.09Å; F374-Y382 HydrophobicContact CE1-CE2 4.48Å; F374-Y382 AromaticContact CE2-CD2 3.82Å; F374-Y382 HydrophobicContact CE2-CD2 3.82Å; F374-Y382 AromaticContact CE2-CE2 3.5Å; F374-Y382 HydrophobicContact CE2-CE2 3.5Å; F374-Y382 AromaticContact CG-CD2 3.79Å; F374-Y382 HydrophobicContact CG-CD2 3.79Å; F374-Y382 HydrophobicContact CG-CE2 4.26Å; F374-Y382 HydrophobicContact CZ-CD2 4.01Å; F374-Y382 AromaticContact CZ-CE2 3.94Å; F374-Y382 HydrophobicContact CZ-CE2 3.94Å; Q378-Y382 PolarHBondContact O-N 3.06Å; V379-Y382 PolarHBondContact O-N 2.99Å; Y382-K384 VanDerWaalsContact C-N 3.33Å; Y382-K384 PolarHBondContact O-N 3.48Å; Y382-T385 PolarHBondContact O-N 3.29Å; Y382-Y386 PolarHBondContact O-N 3.39Å
383	V	91.3	Very high	79.8	Confident	9 Å²	9	87.7 Å²	87.7	6%	0.055	46%	0.463	C	S	.	.	H	α-helix	trans	-66.1	-34.6	-178.8	173	0	0	0	0	112	I348 V352 V379 E380 D381 N387	I348-V383 HydrophobicContact CG2-CG2 4.06Å; V352-V383 HydrophobicContact CB-CG1 4.41Å; V352-V383 HydrophobicContact CB-CG2 4.22Å; V352-V383 HydrophobicContact CG1-CB 4.32Å; V352-V383 HydrophobicContact CG1-CG1 4.06Å; V352-V383 HydrophobicContact CG1-CG2 4.5Å; V352-V383 HydrophobicContact CG2-CB 4.35Å; V352-V383 HydrophobicContact CG2-CG2 3.74Å; V379-V383 WeakPolarHBondContact O-CG2 3.22Å; V379-V383 PolarHBondContact O-N 3.08Å; V379-V383 VanDerWaalsContact O-N 3.08Å; E380-V383 PolarHBondContact O-N 3.45Å; D381-V383 PolarHBondContact O-N 3.22Å; V383-N387 WeakPolarHBondContact CG1-ND2 3.41Å; V383-N387 WeakPolarHBondContact O-CB 3.14Å; V383-N387 PolarHBondContact O-N 3.05Å; V383-N387 PolarHBondContact O-ND2 2.95Å; V383-N387 VanDerWaalsContact O-ND2 3.11Å
384	K	87.9	Confident	77.3	Confident	124 Å²	124	90.5 Å²	90.5	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-62.4	-45.3	173.2	-72.3	167.7	-158.8	156.2	0	111.3	E380 D381 Y382 N387 G388	E380-K384 VanDerWaalsContact O-CG 3.28Å; E380-K384 WeakPolarHBondContact O-CG 3.33Å; E380-K384 PolarHBondContact O-N 3.04Å; D381-K384 PolarHBondContact O-N 3.36Å; D381-K384 IonicContact OD1-NZ 2.7Å; D381-K384 PolarHBondContact OD1-NZ 3.11Å; Y382-K384 VanDerWaalsContact C-N 3.33Å; Y382-K384 PolarHBondContact O-N 3.48Å; K384-N387 PolarHBondContact O-N 3.15Å; K384-G388 PolarHBondContact O-N 3.02Å
385	T	84.4	Confident	74.6	Confident	59 Å²	59	93.6 Å²	93.6	36%	0.362	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-47.6	177.8	-56.8	0	0	0	0	111.3	D381 Y382 N387 G388 E389	D381-T385 PolarHBondContact O-N 3.29Å; D381-T385 PolarHBondContact O-OG1 3.46Å; Y382-T385 PolarHBondContact O-N 3.29Å; T385-N387 VanDerWaalsContact C-N 3.33Å; T385-N387 PolarHBondContact O-N 3.08Å; T385-G388 PolarHBondContact O-N 2.99Å; T385-G388 VanDerWaalsContact O-N 3.08Å; T385-E389 PolarHBondContact O-N 2.91Å; T385-E389 VanDerWaalsContact O-N 3.15Å
386	Y	79.1	Confident	71.7	Confident	87 Å²	87	91.1 Å²	91.1	34%	0.341	51%	0.505	S	S	.	.	H	α-helix	trans	-57.5	-44.9	178.1	-172.2	-81.2	0	0	0	112.2	H349 Y382 G388 E389	H349-Y386 AromaticContact CE1-CD1 3.29Å; H349-Y386 WeakPolarHBondContact CE1-CD1 3.13Å; H349-Y386 AromaticContact CE1-CE1 3.78Å; H349-Y386 AromaticContact CE1-CG 3.77Å; H349-Y386 AromaticContact NE2-CD1 3.74Å; H349-Y386 AromaticContact NE2-CG 3.79Å; Y382-Y386 PolarHBondContact O-N 3.39Å; Y386-G388 VanDerWaalsContact C-N 3.3Å; Y386-G388 PolarHBondContact O-N 3.44Å; Y386-E389 PolarHBondContact O-N 3.17Å
387	N	74.6	Confident	68.7	Low	89 Å²	89	97.8 Å²	97.8	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-71.4	-24.5	178.7	-67.4	-27	0	0	0	113.2	V383 K384 T385 E389	V383-N387 WeakPolarHBondContact CG1-ND2 3.41Å; V383-N387 WeakPolarHBondContact O-CB 3.14Å; V383-N387 PolarHBondContact O-N 3.05Å; V383-N387 PolarHBondContact O-ND2 2.95Å; V383-N387 VanDerWaalsContact O-ND2 3.11Å; K384-N387 PolarHBondContact O-N 3.15Å; T385-N387 VanDerWaalsContact C-N 3.33Å; T385-N387 PolarHBondContact O-N 3.08Å; N387-E389 VanDerWaalsContact C-N 3.33Å
388	G	66	Low	65.8	Low	66 Å²	66	95.8 Å²	95.8	68%	0.68	54%	0.536	S	S	*	.	H	α-helix	trans	-75.8	-20.6	174	0	0	0	0	0	113.7	K384 T385 Y386	K384-G388 PolarHBondContact O-N 3.02Å; T385-G388 PolarHBondContact O-N 2.99Å; T385-G388 VanDerWaalsContact O-N 3.08Å; Y386-G388 VanDerWaalsContact C-N 3.3Å; Y386-G388 PolarHBondContact O-N 3.44Å
389	E	58.9	Low	62.9	Low	150 Å²	150	98.4 Å²	98.4	70%	0.701	56%	0.558	S	S	*	*	H	α-helix	trans	-85.9	-11.8	174	-68.3	-176.5	176.4	0	0	113.1	T385 Y386 N387 P391	T385-E389 PolarHBondContact O-N 2.91Å; T385-E389 VanDerWaalsContact O-N 3.15Å; Y386-E389 PolarHBondContact O-N 3.17Å; N387-E389 VanDerWaalsContact C-N 3.33Å; E389-P391 WeakPolarHBondContact O-CD 3.45Å
390	C	46.9	Very low	59.9	Low	67 Å²	67	105.7 Å²	105.7	45%	0.453	60%	0.597	S	S	.	*	S	Bend	trans	-72.7	122.3	171.5	-80.1	0	0	0	0	110.2	V392	C390-V392 PolarHBondContact O-N 3.13Å; C390-V392 VanDerWaalsContact O-N 3.13Å
391	P	45.1	Very low	57.2	Low	114 Å²	114	108.9 Å²	108.9	74%	0.74	62%	0.622	S	S	*	*			trans	-58.2	121.8	172.4	-17.7	29.4	0	0	0	108.9	E389 D393	E389-P391 WeakPolarHBondContact O-CD 3.45Å; P391-D393 PolarHBondContact O-N 3.08Å; P391-D393 VanDerWaalsContact O-N 3.08Å
392	V	52.2	Low	54.2	Low	137 Å²	137	109.2 Å²	109.2	83%	0.83	64%	0.641	S	S	*	*			trans	-64.7	110.8	164.5	-176.5	0	0	0	0	105.6	C390 K394	C390-V392 PolarHBondContact O-N 3.13Å; C390-V392 VanDerWaalsContact O-N 3.13Å; V392-K394 PolarHBondContact O-N 3.49Å
393	D	44.8	Very low	51.2	Low	149 Å²	149	116.8 Å²	116.8	80%	0.797	68%	0.677	S	S	*	*			trans	-53.9	108.2	174	-73.9	-38.8	0	0	0	108.2	P391	P391-D393 PolarHBondContact O-N 3.08Å; P391-D393 VanDerWaalsContact O-N 3.08Å
394	K	41.7	Very low	48.2	Very low	188 Å²	188	124.9 Å²	124.9	82%	0.817	72%	0.715	S	S	*	*			trans	-63	128.4	164.7	-80.8	-176.8	175.6	-178.5	0	106.2	V392 T396	V392-K394 PolarHBondContact O-N 3.49Å; K394-T396 PolarHBondContact O-N 2.89Å
395	P	36.3	Very low	45.4	Very low	121 Å²	121	122.8 Å²	122.8	79%	0.786	73%	0.728	S	S	*	*			trans	-58.2	117.5	170.4	22.8	-28.7	0	0	0	107.7	E397	P395-E397 PolarHBondContact O-N 3.12Å; P395-E397 VanDerWaalsContact O-N 3.12Å
396	T	34.6	Very low	42.7	Very low	138 Å²	138	129.8 Å²	129.8	85%	0.847	76%	0.756	S	S	*	*			trans	-54.5	113.3	170.2	30	0	0	0	0	108.4	K394 G398	K394-T396 PolarHBondContact O-N 2.89Å; T396-G398 PolarHBondContact O-N 2.99Å
397	E	32.3	Very low	40.1	Very low	192 Å²	192	129.4 Å²	129.4	90%	0.897	78%	0.779	S	S	*	*			trans	-58	102.2	164.4	-77.9	-178.6	162	0	0	107.8	P395 T399	P395-E397 PolarHBondContact O-N 3.12Å; P395-E397 VanDerWaalsContact O-N 3.12Å; E397-T399 PolarHBondContact O-N 2.92Å
398	G	35.1	Very low	37.9	Very low	69 Å²	69	129 Å²	129	71%	0.711	80%	0.796	S	S	*	*			trans	-59.6	120.9	162.4	0	0	0	0	0	107.8	T396 D400	T396-G398 PolarHBondContact O-N 2.99Å; G398-D400 PolarHBondContact O-N 3.29Å
399	T	36.3	Very low	36.1	Very low	148 Å²	148	130.6 Å²	130.6	91%	0.908	80%	0.797	S	S	*	*			trans	-62	103.4	164.5	-1.5	0	0	0	0	106.7	E397	E397-T399 PolarHBondContact O-N 2.92Å
400	D	32.2	Very low	34.7	Very low	153 Å²	153	131.1 Å²	131.1	82%	0.818	80%	0.799	S	S	*	*			trans	-129.4	114.2	162.6	-139.2	-5.2	0	0	0	109.1	G398 G402	G398-D400 PolarHBondContact O-N 3.29Å; D400-G402 PolarHBondContact O-N 3.05Å
401	T	34.6	Very low	33.9	Very low	142 Å²	142	135.7 Å²	135.7	87%	0.871	82%	0.819	S	S	*	*			trans	-68.6	113	176.2	40.9	0	0	0	0	109.3
402	G	31.3	Very low	33.1	Very low	75 Å²	75	138.7 Å²	138.7	77%	0.773	82%	0.823	S	S	*	*			trans	-163.5	115.4	173.7	0	0	0	0	0	111.5	D400	D400-G402 PolarHBondContact O-N 3.05Å
403	Q	29.4	Very low	32.1	Very low	175 Å²	175	136.3 Å²	136.3	82%	0.818	82%	0.818	S	S	*	*			trans	-63.8	155.5	-174.4	-97.6	164.8	-63.5	0	0	115.9
404	E	28.4	Very low	31.6	Very low	180 Å²	180	136.7 Å²	136.7	84%	0.841	82%	0.819	S	S	*	*			trans	86.3	126.3	145.5	-76.3	169.8	-162.3	0	0	120.9
405	G	28.5	Very low	31	Very low	79 Å²	79	131 Å²	131	81%	0.814	81%	0.813	S	S	*	*			trans	138.3	79.9	148.4	0	0	0	0	0	116.3
406	Q	27.4	Very low	30.5	Very low	206 Å²	206	133.2 Å²	133.2	96%	0.963	82%	0.818	S	S	*	*			trans	-58	143.9	167.4	-77.6	169.2	-32.7	0	0	113.3
407	G	25.9	Very low	30.4	Very low	80 Å²	80	134.6 Å²	134.6	83%	0.825	82%	0.817	S	S	*	*				129.6	107.4	129.7	0	0	0	0	0	117.5
408	G	27.1	Very low	30.2	Very low	81 Å²	81	129.4 Å²	129.4	84%	0.835	82%	0.815	S	S	*	*				120.4	108.7	124.8	0	0	0	0	0	119.4
409	S	29.1	Very low	30	Very low	98 Å²	98	135.2 Å²	135.2	69%	0.685	82%	0.823	S	S	*	*			trans	63.5	110.8	146.4	-85.5	0	0	0	0	122.3
410	E	29	Very low	29.6	Very low	162 Å²	162	131.6 Å²	131.6	76%	0.757	82%	0.815	S	S	*	*				53.6	116.1	106.7	-63.6	165.6	160.3	0	0	118.7
411	N	30.4	Very low	29.4	Very low	163 Å²	163	133.5 Å²	133.5	87%	0.872	82%	0.819	S	S	*	*				-158.5	110	101.7	-91.2	-31.5	0	0	0	110.8
412	E	28.6	Very low	29.2	Very low	177 Å²	177	130.6 Å²	130.6	83%	0.827	82%	0.818	S	S	*	*			trans	-71.4	148.1	152.5	-68.4	179.6	143.9	0	0	110
413	A	31.8	Very low	29.1	Very low	87 Å²	87	135.8 Å²	135.8	72%	0.719	82%	0.822	S	S	*	*				176.1	109.7	123.5	0	0	0	0	0	107.5
414	I	33.2	Very low	29.5	Very low	157 Å²	157	135.7 Å²	135.7	81%	0.805	83%	0.826	S	S	*	*				65.3	126.4	78.7	-59.8	160.6	0	0	0	109.5
415	G	29.4	Very low	29.8	Very low	67 Å²	67	134.7 Å²	134.7	69%	0.691	83%	0.825	S	S	*	*			cis	151.9	161.3	12.1	0	0	0	0	0	106.8
416	D	26.3	Very low	30.1	Very low	168 Å²	168	136.6 Å²	136.6	90%	0.898	82%	0.824	S	S	*	*			trans	-159.1	139.2	131.7	-151	2.2	0	0	0	111.2
417	M	32.4	Very low	30.5	Very low	168 Å²	168	135.6 Å²	135.6	83%	0.828	82%	0.819	S	S	*	*			trans	-98	149.6	-175.2	-72.9	175.8	170.7	0	0	110.5
418	G	27.1	Very low	30.8	Very low	82 Å²	82	137.4 Å²	137.4	85%	0.845	82%	0.816	S	S	*	*			trans	-132.9	100.5	156.8	0	0	0	0	0	109.2
419	E	32.1	Very low	31.2	Very low	192 Å²	192	141.4 Å²	141.4	90%	0.897	82%	0.817	S	S	*	*			trans	-73	142.3	172	-73.4	-175.1	144.2	0	0	111.6
420	G	28.1	Very low	31.3	Very low	72 Å²	72	146.5 Å²	146.5	74%	0.742	83%	0.826	S	S	*	*			trans	-161.7	87.9	172.9	0	0	0	0	0	112.5
421	Q	28.4	Very low	31.6	Very low	193 Å²	193	147.2 Å²	147.2	90%	0.902	83%	0.83	S	S	*	*			trans	44.8	97.6	151.8	-63.5	179.3	-0.8	0	0	118.4	Q423	Q421-Q423 PolarHBondContact O-N 3.26Å
422	G	28.6	Very low	32	Very low	81 Å²	81	149.3 Å²	149.3	84%	0.835	83%	0.831	S	S	*	*			trans	-69.3	109.9	164.5	0	0	0	0	0	112.1
423	Q	29.9	Very low	32.3	Very low	184 Å²	184	150.3 Å²	150.3	86%	0.86	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-79.3	118.5	156.9	-83.1	176.7	-11.5	0	0	108.4	Q421 L425	Q421-Q423 PolarHBondContact O-N 3.26Å; Q423-L425 PolarHBondContact O-N 3.36Å
424	L	38.8	Very low	32.5	Very low	172 Å²	172	153.3 Å²	153.3	90%	0.901	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-59.4	120.5	170.1	-81.7	108.8	0	0	0	109.8
425	L	33.3	Very low	32.5	Very low	159 Å²	159	149.5 Å²	149.5	83%	0.832	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-76	144	169.9	-72.1	163.3	0	0	0	110.4	Q423	Q423-L425 PolarHBondContact O-N 3.36Å
426	P	34.4	Very low	32.6	Very low	120 Å²	120	155.8 Å²	155.8	78%	0.779	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-74.3	143.2	-179	-8.8	25	0	0	0	112.1
427	Q	37.3	Very low	32.9	Very low	184 Å²	184	156.8 Å²	156.8	86%	0.86	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-76.1	140.1	174.3	-66.4	-170.9	-3.2	0	0	111.8
428	P	32.3	Very low	32.9	Very low	119 Å²	119	156.3 Å²	156.3	77%	0.773	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-74.6	143.4	176.9	27.6	-31	0	0	0	112.7	K430	P428-K430 PolarHBondContact O-N 3.31Å
429	I	34	Very low	33.4	Very low	164 Å²	164	159.2 Å²	159.2	84%	0.841	84%	0.838	S	S	*	*			trans	-65.8	115.6	178.3	-63.1	166.7	0	0	0	109.2	E431	I429-E431 PolarHBondContact O-N 3.26Å
430	K	32.8	Very low	33.4	Very low	205 Å²	205	161.2 Å²	161.2	89%	0.891	84%	0.837	S	S	*	*			trans	-74.7	104.2	173	-78	-178.8	176.6	177.5	0	110.3	P428	P428-K430 PolarHBondContact O-N 3.31Å
431	E	34.9	Very low	33.7	Very low	178 Å²	178	165.6 Å²	165.6	83%	0.832	84%	0.843	S	S	*	*			trans	-85.3	127.9	156.5	-77.7	-168.2	161.6	0	0	110.2	I429 K433	I429-E431 PolarHBondContact O-N 3.26Å; E431-K433 PolarHBondContact O-N 3.26Å
432	K	39.2	Very low	34.7	Very low	206 Å²	206	165.6 Å²	165.6	90%	0.896	86%	0.864	S	S	*	*			trans	-67	126.5	175.4	-79.4	177.2	173.3	177.1	0	110
433	K	34	Very low	35	Very low	199 Å²	199	169.9 Å²	169.9	87%	0.865	87%	0.866	S	S	*	*			trans	-118.9	132.6	158.4	-84.7	-176.2	178	174.1	0	111.1	E431	E431-K433 PolarHBondContact O-N 3.26Å
434	N	35.8	Very low	35.2	Very low	149 Å²	149	169.1 Å²	169.1	80%	0.797	87%	0.866	S	S	*	*			trans	-60.4	145.3	-176.4	-69.6	-29.2	0	0	0	112.2
435	G	33.5	Very low	35	Very low	77 Å²	77	168.9 Å²	168.9	79%	0.794	86%	0.864	S	S	*	*			trans	-69.1	152.8	-177.6	0	0	0	0	0	114
436	F	31.2	Very low	35.1	Very low	200 Å²	200	169.5 Å²	169.5	88%	0.877	87%	0.866	S	S	*	*			trans	-117.7	129	162.4	-70.8	-84	0	0	0	108.5
437	E	33.2	Very low	35.2	Very low	188 Å²	188	172.6 Å²	172.6	88%	0.879	87%	0.872	S	S	*	*			trans	-84.3	127.9	179.1	-136.1	176.4	-175.8	0	0	109.4
438	I	33.1	Very low	35.1	Very low	159 Å²	159	171.9 Å²	171.9	82%	0.815	87%	0.872	S	S	*	*			trans	-96	110.4	174.6	-60.6	174.7	0	0	0	108.1
439	I	36.9	Very low	35.3	Very low	142 Å²	142	175.6 Å²	175.6	73%	0.728	88%	0.88	S	S	*	*	P	Polyproline II helix	trans	-79.2	119.4	170.6	-58.9	172.1	0	0	0	108.2
440	R	32.3	Very low	35.3	Very low	234 Å²	234	176.5 Å²	176.5	88%	0.883	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-82.1	123.3	166.3	-81.7	-177.1	172.8	169.2	-1.9	108.9
441	L	33.1	Very low	35.6	Very low	164 Å²	164	174.2 Å²	174.2	86%	0.859	88%	0.882	S	S	*	*	P	Polyproline II helix	trans	-94.7	130.8	162.7	-72.7	168.9	0	0	0	108.7
442	S	49.6	Very low	35.6	Very low	194 Å²	194	173.8 Å²	173.8	100%	1.357	89%	0.886	S	S	*	*			trans	-62.4	0	-177.5	-30.6	0	0	0	0	114.1

Retrieved 442 of 442 residues in 108.6 ms (Link to these results)

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