A0A087YLU3_POEFO Loading...

S-phase kinase-associated protein 2

Substrate recognition component of a SCF (SKP1-CUL1-F-box protein) E3 ubiquitin-protein ligase complex which mediates the ubiquitination and subsequent proteasomal degradation of target proteins involved in cell cycle progression, signal transduction and transcription. Specifically recognizes phosphorylated CDKN1B/p27kip and is involved in regulation of G1/S transition. Degradation of CDKN1B/p27kip also requires CKS1. Recognizes target proteins ORC1, CDT1, RBL2, KMT2A/MLL1, CDK9, RAG2, NBN, FOXO1, UBP43, YTHDF2, and probably MYC, TOB1 and TAL1. Degradation of TAL1 also requires STUB1. Recognizes CDKN1A in association with CCNE1 or CCNE2 and CDK2. Promotes ubiquitination and destruction of CDH1 in a CK1-dependent manner, thereby regulating cell migration. Following phosphorylation in response to DNA damage, mediates 'Lys-63'-linked ubiquitination of NBN, promoting ATM recruitment to DNA damage sites and DNA repair via homologous recombination.

AlphaFold DB , UniProt , Accession A0A087YLU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 410 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.3	Very low	26.5	Very low	231 Å²	231	146.8 Å²	146.8	100%	1.138	84%	0.842	S	S	*	*				0	74.5	0	-62.2	179.8	-163.3	0	0	106.4
2	T	23.8	Very low	26.4	Very low	134 Å²	134	148.4 Å²	148.4	82%	0.822	85%	0.845	S	S	*	*				44.2	122.2	76.1	54	0	0	0	0	111.2
3	C	24.7	Very low	26.2	Very low	118 Å²	118	145.5 Å²	145.5	80%	0.797	84%	0.839	S	S	*	*			cis	-147.8	150.1	29.5	-79.7	0	0	0	0	109.2
4	A	24.1	Very low	26	Very low	88 Å²	88	143.3 Å²	143.3	73%	0.727	83%	0.834	S	S	*	*			cis	70	112.4	41.3	0	0	0	0	0	115.1
5	C	24.9	Very low	25.9	Very low	124 Å²	124	146.4 Å²	146.4	84%	0.838	84%	0.838	S	S	*	*			trans	-177.5	94.8	146.8	-94.1	0	0	0	0	107.8
6	S	25	Very low	25.9	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	84%	0.839	S	S	*	*				60.7	97.1	77	68.1	0	0	0	0	116.3
7	L	26.7	Very low	25.9	Very low	153 Å²	153	155 Å²	155	80%	0.801	84%	0.843	S	S	*	*				24.9	154.1	125.5	-76.2	171.1	0	0	0	119.8
8	P	30.1	Very low	25.8	Very low	122 Å²	122	158.1 Å²	158.1	79%	0.792	85%	0.848	S	S	*	*			cis	-149.2	164.5	47.6	37.6	-14.8	0	0	0	120.2
9	L	24.7	Very low	25.8	Very low	161 Å²	161	153.6 Å²	153.6	84%	0.843	84%	0.842	S	S	*	*			trans	-65.2	137.8	161.2	-78.5	145.1	0	0	0	111
10	Q	25.1	Very low	25.8	Very low	185 Å²	185	153.8 Å²	153.8	86%	0.864	84%	0.841	S	S	*	*			trans	-123.6	121.7	161.6	-113.7	179.2	-7	0	0	109.4
11	E	24.7	Very low	25.8	Very low	193 Å²	193	156 Å²	156	90%	0.902	84%	0.842	S	S	*	*			trans	-61.6	131.3	164.7	-66.8	178.2	143.2	0	0	110.1
12	L	25.4	Very low	25.3	Very low	166 Å²	166	156.7 Å²	156.7	87%	0.869	83%	0.832	S	S	*	*			trans	-137.8	111.7	155.5	-90.6	167	0	0	0	109.4
13	S	23.9	Very low	25.3	Very low	110 Å²	110	160.1 Å²	160.1	77%	0.769	84%	0.836	S	S	*	*			trans	-65.9	133.9	165.8	49.6	0	0	0	0	110.6
14	C	23.8	Very low	25.4	Very low	115 Å²	115	160 Å²	160	78%	0.777	84%	0.836	S	S	*	*			trans	-156.6	105.8	154	-131.4	0	0	0	0	111.9
15	Q	24.9	Very low	25.7	Very low	190 Å²	190	164.5 Å²	164.5	89%	0.888	85%	0.847	S	S	*	*			trans	-58.4	131.3	160.4	-68.2	169.8	-23	0	0	109.7
16	K	26	Very low	25.6	Very low	196 Å²	196	162 Å²	162	85%	0.852	84%	0.841	S	S	*	*			trans	-158.7	97.3	152.6	-108.2	159.8	-166.1	179.1	0	112.6
17	R	25.2	Very low	25.6	Very low	243 Å²	243	162.9 Å²	162.9	92%	0.917	85%	0.848	S	S	*	*			trans	18.1	117.7	145.2	-63.6	179.4	-176.4	-177.2	0.6	118.3	G19	R17-G19 PolarHBondContact O-N 3.3Å
18	F	24.6	Very low	26.2	Very low	211 Å²	211	162.5 Å²	162.5	93%	0.925	85%	0.852	S	S	*	*			trans	-57	121.4	159.6	-82.9	-93.4	0	0	0	111.8
19	G	24.5	Very low	26.5	Very low	72 Å²	72	160.3 Å²	160.3	74%	0.742	85%	0.851	S	S	*	*			trans	-117.5	99.2	163.5	0	0	0	0	0	109.8	R17 K21	R17-G19 PolarHBondContact O-N 3.3Å; G19-K21 PolarHBondContact O-N 3.05Å
20	I	26.4	Very low	27	Very low	157 Å²	157	157.7 Å²	157.7	81%	0.805	85%	0.846	S	S	*	*			trans	-76.6	101.9	173.1	-62.4	171.5	0	0	0	107.9
21	K	25.1	Very low	27.6	Very low	201 Å²	201	156.7 Å²	156.7	87%	0.874	84%	0.842	S	S	*	*			trans	-86.5	117.3	164.5	-87.2	-174.9	176.5	178.9	0	109.6	G19 K23	G19-K21 PolarHBondContact O-N 3.05Å; K21-K23 PolarHBondContact O-N 3.19Å
22	R	26.6	Very low	28.1	Very low	245 Å²	245	150.5 Å²	150.5	93%	0.925	82%	0.82	S	S	*	*			trans	-54.1	124.7	166.8	-73	172.6	168.7	165.3	-3.5	109.9
23	K	25.5	Very low	28.8	Very low	207 Å²	207	145.6 Å²	145.6	90%	0.9	80%	0.797	S	S	*	*			trans	-105.1	131.4	159.9	-91.9	-176.7	174.9	-179.3	0	109.6	K21	K21-K23 PolarHBondContact O-N 3.19Å
24	S	25.4	Very low	29.6	Very low	114 Å²	114	142.3 Å²	142.3	80%	0.797	77%	0.773	S	S	*	*			trans	-64.2	144	-175.5	49.8	0	0	0	0	112.9	G26	S24-G26 PolarHBondContact O-N 3.08Å
25	L	31.7	Very low	30.6	Very low	184 Å²	184	138.1 Å²	138.1	96%	0.963	74%	0.744	S	S	*	*			trans	-57	128.1	163.2	-97.7	82.4	0	0	0	110
26	G	23.2	Very low	31.6	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	72%	0.718	S	S	*	*			trans	-157.2	124.4	167.7	0	0	0	0	0	110.7	S24	S24-G26 PolarHBondContact O-N 3.08Å
27	S	24	Very low	32.8	Very low	125 Å²	125	123.8 Å²	123.8	87%	0.874	68%	0.683	S	S	*	*			trans	79.9	128	159.5	-155.7	0	0	0	0	120.6
28	V	39.2	Very low	34	Very low	146 Å²	146	113 Å²	113	89%	0.885	64%	0.644	S	S	*	*			trans	-60.2	146	168.9	174	0	0	0	0	111
29	G	36.8	Very low	35.2	Very low	76 Å²	76	105.3 Å²	105.3	78%	0.784	61%	0.612	S	S	*	*			trans	123	74.7	169	0	0	0	0	0	112.9
30	S	34.1	Very low	36.3	Very low	106 Å²	106	107.8 Å²	107.8	74%	0.741	61%	0.607	S	S	*	*			trans	-150.8	111.8	165	163.7	0	0	0	0	108.2	S32	S30-S32 PolarHBondContact O-N 2.9Å
31	E	38.5	Very low	37.4	Very low	163 Å²	163	103.8 Å²	103.8	76%	0.762	58%	0.582	S	S	*	*			trans	-51.4	106.7	173	-65	171.5	143.8	0	0	109.3	T33	E31-T33 PolarHBondContact O-N 3.18Å
32	S	34.7	Very low	38	Very low	63 Å²	63	97.8 Å²	97.8	44%	0.441	57%	0.566	S	S	.	*			trans	-77.8	116.9	168.4	-48.5	0	0	0	0	107.1	S30	S30-S32 PolarHBondContact O-N 2.9Å
33	T	39.8	Very low	38.4	Very low	64 Å²	64	91.9 Å²	91.9	39%	0.393	56%	0.559	S	S	.	*			trans	-62.4	152.5	173.2	60.5	0	0	0	0	109.2	E31 T35 D36	E31-T33 PolarHBondContact O-N 3.18Å; T33-T35 PolarHBondContact O-N 3.42Å; T33-D36 PolarHBondContact N-OD2 2.87Å; T33-D36 WeakPolarHBondContact O-CB 3.3Å; T33-D36 PolarHBondContact O-N 3.33Å; T33-D36 PolarHBondContact OG1-OD2 3.17Å
34	P	41.4	Very low	38.7	Very low	41 Å²	41	92.6 Å²	92.6	27%	0.266	56%	0.556	S	S	.	*	H	α-helix	trans	-52.1	-29.4	178	-26.9	34.6	0	0	0	113.2	L37 L403	P34-L37 PolarHBondContact O-N 3.02Å; P34-L403 HydrophobicContact CB-CD2 4.03Å
35	T	44.1	Very low	39.1	Very low	27 Å²	27	92.8 Å²	92.8	17%	0.166	55%	0.554	C	S	.	*	H	α-helix	trans	-61.6	-44.4	174.6	-39.3	0	0	0	0	112.1	T33 L37 V38 L39 Q130	T33-T35 PolarHBondContact O-N 3.42Å; T35-L37 VanDerWaalsContact C-N 3.28Å; T35-L37 PolarHBondContact O-N 2.83Å; T35-V38 PolarHBondContact O-N 3.01Å; T35-L39 HydrophobicContact CG2-CD1 3.93Å; T35-L39 HydrophobicContact CG2-CG 4.49Å; T35-L39 VanDerWaalsContact O-CG 3.26Å; T35-L39 WeakPolarHBondContact O-CG 3.31Å; T35-L39 PolarHBondContact O-N 3.35Å; T35-L39 VanDerWaalsContact O-N 3.12Å; T35-Q130 HydrophobicContact CG2-CB 4.11Å; T35-Q130 HydrophobicContact CG2-CG 4.28Å
36	D	46.9	Very low	39.4	Very low	63 Å²	63	93.6 Å²	93.6	34%	0.337	55%	0.55	S	S	.	*	H	α-helix	trans	-63.7	-33.3	-179	-62.2	-48	0	0	0	112.7	T33 V38 L39 L40	T33-D36 PolarHBondContact N-OD2 2.87Å; T33-D36 WeakPolarHBondContact O-CB 3.3Å; T33-D36 PolarHBondContact O-N 3.33Å; T33-D36 PolarHBondContact OG1-OD2 3.17Å; D36-V38 VanDerWaalsContact C-N 3.32Å; D36-V38 PolarHBondContact O-N 3.05Å; D36-L39 PolarHBondContact O-N 3.26Å; D36-L40 HydrophobicContact CB-CD1 4.4Å; D36-L40 WeakPolarHBondContact O-CB 3.4Å; D36-L40 WeakPolarHBondContact O-CD1 3.4Å; D36-L40 WeakPolarHBondContact O-CG 3.25Å; D36-L40 PolarHBondContact O-N 2.73Å
37	L	50.8	Low	39.9	Very low	22 Å²	22	98.4 Å²	98.4	12%	0.115	55%	0.554	C	S	.	*	H	α-helix	trans	-69	-30.3	179.2	-67.1	175.2	0	0	0	112.9	P34 T35 R102	P34-L37 PolarHBondContact O-N 3.02Å; T35-L37 VanDerWaalsContact C-N 3.28Å; T35-L37 PolarHBondContact O-N 2.83Å; L37-R102 HydrophobicContact CD1-CG 4.02Å; L37-R102 HydrophobicContact CD2-CG 4.49Å
38	V	50.4	Low	40.2	Very low	17 Å²	17	98.2 Å²	98.2	10%	0.103	55%	0.55	C	S	.	.	H	α-helix	trans	-77.3	-40.9	174.2	178.1	0	0	0	0	110.6	T35 D36 L101 A134	T35-V38 PolarHBondContact O-N 3.01Å; D36-V38 VanDerWaalsContact C-N 3.32Å; D36-V38 PolarHBondContact O-N 3.05Å; V38-L101 HydrophobicContact CG2-CD1 3.67Å; V38-A134 HydrophobicContact CG1-CB 3.73Å
39	L	49.3	Very low	39.9	Very low	48 Å²	48	102.4 Å²	102.4	25%	0.251	55%	0.55	S	S	.	.	H	α-helix	trans	-73.6	-36.3	-175.2	-64.6	172.3	0	0	0	114.2	T35 D36 R41 Q130 P133	T35-L39 HydrophobicContact CG2-CD1 3.93Å; T35-L39 HydrophobicContact CG2-CG 4.49Å; T35-L39 VanDerWaalsContact O-CG 3.26Å; T35-L39 WeakPolarHBondContact O-CG 3.31Å; T35-L39 PolarHBondContact O-N 3.35Å; T35-L39 VanDerWaalsContact O-N 3.12Å; D36-L39 PolarHBondContact O-N 3.26Å; L39-R41 PolarHBondContact O-N 2.6Å; L39-Q130 VanDerWaalsContact CD1-CD 3.48Å; L39-Q130 HydrophobicContact CD1-CG 4.39Å; L39-Q130 HydrophobicContact CD2-CB 4.17Å; L39-P133 HydrophobicContact CD2-CB 3.93Å; L39-P133 HydrophobicContact CD2-CG 3.6Å
40	L	47.6	Very low	39.7	Very low	124 Å²	124	104.2 Å²	104.2	65%	0.649	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	3.6	-174.9	-83.5	160.3	0	0	0	115	D36	D36-L40 HydrophobicContact CB-CD1 4.4Å; D36-L40 WeakPolarHBondContact O-CB 3.4Å; D36-L40 WeakPolarHBondContact O-CD1 3.4Å; D36-L40 WeakPolarHBondContact O-CG 3.25Å; D36-L40 PolarHBondContact O-N 2.73Å
41	R	50.2	Low	39.7	Very low	74 Å²	74	103.9 Å²	103.9	28%	0.279	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.7	19.5	-165.7	-60.3	-162.8	-178.4	-148.4	4.5	116.7	L39 L101 S104 A105	L39-R41 PolarHBondContact O-N 2.6Å; R41-L101 PolarHBondContact NH1-O 3.15Å; R41-L101 PolarHBondContact NH2-O 2.76Å; R41-S104 VanDerWaalsContact NH1-C 3.28Å; R41-S104 PolarHBondContact NH1-OG 2.71Å; R41-A105 VanDerWaalsContact CZ-CB 3.42Å; R41-A105 VanDerWaalsContact NH1-CA 3.26Å
42	S	37.4	Very low	39.4	Very low	75 Å²	75	102.1 Å²	102.1	52%	0.524	56%	0.556	S	S	.	*	S	Bend	trans	-76.3	146.3	157.3	-63.6	0	0	0	0	110.4	R44	S42-R44 PolarHBondContact O-N 2.97Å
43	P	34.6	Very low	39.4	Very low	121 Å²	121	107.5 Å²	107.5	79%	0.786	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-63.7	125	-179.1	14.1	-12.1	0	0	0	110.1
44	R	32.9	Very low	39.2	Very low	221 Å²	221	107.9 Å²	107.9	83%	0.834	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-59.8	130.6	168.5	-66.9	-175.1	-179.8	-167.7	-0.9	108.4	S42 K46	S42-R44 PolarHBondContact O-N 2.97Å; R44-K46 PolarHBondContact O-N 2.9Å
45	P	33.9	Very low	38.8	Very low	118 Å²	118	116 Å²	116	77%	0.766	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-57.8	128.6	170.7	21.4	-28.8	0	0	0	108.3	Q47	P45-Q47 PolarHBondContact O-N 3.22Å; P45-Q47 VanDerWaalsContact O-N 3.12Å
46	K	36.9	Very low	38.5	Very low	202 Å²	202	123 Å²	123	88%	0.878	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.4	118.8	173.7	-74.6	178.5	179.3	174.2	0	107.1	R44	R44-K46 PolarHBondContact O-N 2.9Å
47	Q	34.3	Very low	37.9	Very low	170 Å²	170	127.8 Å²	127.8	79%	0.794	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62.2	138.1	169.5	-68.9	-147	-21.7	0	0	109.3	P45 W49	P45-Q47 PolarHBondContact O-N 3.22Å; P45-Q47 VanDerWaalsContact O-N 3.12Å; Q47-W49 PolarHBondContact O-N 3.36Å
48	P	30.6	Very low	37.4	Very low	122 Å²	122	134.9 Å²	134.9	79%	0.792	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-60.9	129.9	172.4	-11.5	24.6	0	0	0	108.5
49	W	31.9	Very low	37	Very low	234 Å²	234	143.5 Å²	143.5	89%	0.886	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.5	138.9	170.8	-79.4	47.8	0	0	0	108.7	Q47 A51	Q47-W49 PolarHBondContact O-N 3.36Å; W49-A51 PolarHBondContact O-N 3.26Å
50	P	32.8	Very low	36.4	Very low	113 Å²	113	145 Å²	145	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.8	129.3	171.8	-15	27.9	0	0	0	109	C52	P50-C52 PolarHBondContact O-N 2.97Å; P50-C52 VanDerWaalsContact O-N 3.08Å
51	A	33.7	Very low	35.7	Very low	99 Å²	99	150.5 Å²	150.5	82%	0.818	79%	0.786	S	S	*	*			trans	-57.2	112.5	174.6	0	0	0	0	0	109.7	W49 L53	W49-A51 PolarHBondContact O-N 3.26Å; A51-L53 PolarHBondContact O-N 3.39Å
52	C	33.8	Very low	35.1	Very low	127 Å²	127	157.1 Å²	157.1	86%	0.858	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-74.9	117.1	166.1	-70.2	0	0	0	0	108.2	P50	P50-C52 PolarHBondContact O-N 2.97Å; P50-C52 VanDerWaalsContact O-N 3.08Å
53	L	33.9	Very low	35.3	Very low	176 Å²	176	159 Å²	159	92%	0.921	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-48.8	138.5	167.5	-86.5	130.1	0	0	0	111.3	A51	A51-L53 PolarHBondContact O-N 3.39Å
54	G	35.1	Very low	35.6	Very low	72 Å²	72	161.6 Å²	161.6	74%	0.742	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-60	157	-165.1	0	0	0	0	0	116.8
55	K	33	Very low	36.1	Very low	210 Å²	210	154.8 Å²	154.8	91%	0.913	82%	0.823	S	S	*	*			trans	-146.2	120	136.8	-101.3	175.5	-176.8	-176.4	0	107.1
56	E	37.8	Very low	36.3	Very low	174 Å²	174	160.7 Å²	160.7	81%	0.813	83%	0.83	S	S	*	*			trans	-56.6	134.6	175.1	-67.6	168.8	136.9	0	0	110.2
57	N	35.1	Very low	36.2	Very low	165 Å²	165	162.5 Å²	162.5	88%	0.882	83%	0.831	S	S	*	*			trans	-142.2	105.7	149.5	-108.4	-3.9	0	0	0	106.6
58	Q	41	Very low	36.5	Very low	170 Å²	170	159.5 Å²	159.5	79%	0.794	83%	0.829	S	S	*	*			trans	-66.8	150.1	171.3	-70.8	172.9	-4.5	0	0	109.3
59	E	40.9	Very low	37.2	Very low	198 Å²	198	164.7 Å²	164.7	93%	0.925	83%	0.832	S	S	*	*			trans	74.5	64.7	174.1	-54.1	-167.3	165.7	0	0	118
60	A	36.3	Very low	37.7	Very low	80 Å²	80	165 Å²	165	66%	0.661	83%	0.833	S	S	*	*			trans	-135.9	115.2	146.8	0	0	0	0	0	109.4	F62	A60-F62 PolarHBondContact O-N 2.87Å
61	R	34.2	Very low	38.4	Very low	240 Å²	240	171.2 Å²	171.2	91%	0.906	84%	0.842	S	S	*	*			trans	-48.7	111.5	165.2	-95.8	173.3	155.2	163	-6.1	108.2	V63	R61-V63 VanDerWaalsContact C-N 3.27Å; R61-V63 HydrophobicContact CB-CG2 4.47Å; R61-V63 PolarHBondContact O-N 3.45Å
62	F	37.7	Very low	39.2	Very low	213 Å²	213	177.4 Å²	177.4	93%	0.934	85%	0.845	S	S	*	*			trans	-65.2	89.3	169.7	-82.6	-89	0	0	0	108.9	A60	A60-F62 PolarHBondContact O-N 2.87Å
63	V	40.2	Very low	39.9	Very low	115 Å²	115	183 Å²	183	70%	0.697	85%	0.848	S	S	*	*			trans	-84.3	112.9	166	-176.9	0	0	0	0	106.7	R61 A65	R61-V63 VanDerWaalsContact C-N 3.27Å; R61-V63 HydrophobicContact CB-CG2 4.47Å; R61-V63 PolarHBondContact O-N 3.45Å; V63-A65 PolarHBondContact O-N 2.8Å
64	L	42.2	Very low	40.7	Very low	175 Å²	175	180.7 Å²	180.7	92%	0.916	85%	0.846	S	S	*	*			trans	-65.5	76.3	160.6	-87.9	162.4	0	0	0	108.1	R66	L64-R66 PolarHBondContact O-N 2.78Å
65	A	42.5	Very low	41.7	Very low	78 Å²	78	180 Å²	180	65%	0.645	84%	0.839	S	S	*	*			trans	-65.4	106.2	167.6	0	0	0	0	0	106.7	V63 R67	V63-A65 PolarHBondContact O-N 2.8Å; A65-R67 PolarHBondContact O-N 3.21Å
66	R	37.7	Very low	43.1	Very low	241 Å²	241	176.7 Å²	176.7	91%	0.909	84%	0.843	S	S	*	*			trans	-51.1	112.1	160.5	-83.1	-180	173.4	172.4	-1.1	105.3	L64 S68	L64-R66 PolarHBondContact O-N 2.78Å; R66-S68 VanDerWaalsContact C-N 3.3Å; R66-S68 PolarHBondContact O-N 2.71Å
67	R	36.2	Very low	44.5	Very low	241 Å²	241	171.3 Å²	171.3	91%	0.909	83%	0.833	S	S	*	*			trans	-52.8	105.8	167.1	-83.6	-176	177.3	-179.7	-0.2	105.7	A65 R69	A65-R67 PolarHBondContact O-N 3.21Å; R67-R69 PolarHBondContact O-N 3.23Å; R67-R69 VanDerWaalsContact O-N 3.11Å
68	S	39	Very low	46.7	Very low	107 Å²	107	169.8 Å²	169.8	75%	0.748	83%	0.83	S	S	*	*			trans	-44.5	123.4	162.4	166.2	0	0	0	0	105.2	R66 R70	R66-S68 VanDerWaalsContact C-N 3.3Å; R66-S68 PolarHBondContact O-N 2.71Å; S68-R70 PolarHBondContact O-N 3Å
69	R	46	Very low	48.6	Very low	230 Å²	230	164.2 Å²	164.2	87%	0.868	81%	0.81	S	S	*	*			trans	-46.7	112.5	175.1	-81.8	179.1	175.1	169.8	-1.7	105	R67 R71	R67-R69 PolarHBondContact O-N 3.23Å; R67-R69 VanDerWaalsContact O-N 3.11Å; R69-R71 VanDerWaalsContact C-N 3.32Å; R69-R71 PolarHBondContact O-N 3.25Å
70	R	43.6	Very low	50.7	Low	240 Å²	240	162.5 Å²	162.5	91%	0.906	80%	0.795	S	S	*	*			trans	-48.7	110.2	169.4	-101.5	-176.2	175.1	-176.7	-1.6	104.2	S68 R72	S68-R70 PolarHBondContact O-N 3Å; R70-R72 PolarHBondContact O-N 3.21Å
71	R	45.6	Very low	53	Low	245 Å²	245	163.7 Å²	163.7	93%	0.925	79%	0.79	S	S	*	*			trans	-55.7	101.2	173.7	-141.4	177.5	176	-167.2	-1.8	102.9	R69 R73	R69-R71 VanDerWaalsContact C-N 3.32Å; R69-R71 PolarHBondContact O-N 3.25Å; R71-R73 PolarHBondContact O-N 3.37Å
72	R	51.3	Low	55.5	Low	229 Å²	229	159.7 Å²	159.7	86%	0.864	78%	0.781	S	S	*	*			trans	-54.3	119.7	175.7	-96.3	-178.7	167.3	175.6	-5.6	103.7	R70 S74	R70-R72 PolarHBondContact O-N 3.21Å; R72-S74 PolarHBondContact O-N 3.29Å; R72-S74 VanDerWaalsContact O-N 3.15Å
73	R	47.6	Very low	58.1	Low	244 Å²	244	151.4 Å²	151.4	92%	0.921	75%	0.747	S	S	*	*			trans	-45	126.5	174.1	-88.2	177.2	156.9	173.7	-7	106.9	R71 G75	R71-R73 PolarHBondContact O-N 3.37Å; R73-G75 VanDerWaalsContact C-N 3.28Å; R73-G75 PolarHBondContact O-N 3.38Å
74	S	52	Low	60.7	Low	127 Å²	127	149 Å²	149	89%	0.888	73%	0.733	S	S	*	*			trans	-56.9	93.3	178.2	-40	0	0	0	0	108.2	R72	R72-S74 PolarHBondContact O-N 3.29Å; R72-S74 VanDerWaalsContact O-N 3.15Å
75	G	56.8	Low	63.3	Low	58 Å²	58	142.5 Å²	142.5	60%	0.598	70%	0.7	S	S	*	*			trans	-63.7	149.6	156	0	0	0	0	0	107.1	R73 G77	R73-G75 VanDerWaalsContact C-N 3.28Å; R73-G75 PolarHBondContact O-N 3.38Å; G75-G77 PolarHBondContact O-N 3.47Å
76	S	61.5	Low	65.8	Low	141 Å²	141	145.1 Å²	145.1	99%	0.986	70%	0.699	S	S	*	*	S	Bend	trans	-65	33.8	-179.5	48.3	0	0	0	0	114.5
77	G	67.7	Low	68.6	Low	60 Å²	60	138 Å²	138	62%	0.619	68%	0.678	S	S	*	*	S	Bend	trans	-115.1	153.3	-177.4	0	0	0	0	0	113	G75 S79	G75-G77 PolarHBondContact O-N 3.47Å; G77-S79 PolarHBondContact O-N 3.47Å
78	V	79.9	Confident	71.3	Confident	134 Å²	134	126.6 Å²	126.6	81%	0.812	64%	0.635	S	S	*	*			trans	-66.6	127.5	173.7	-179.9	0	0	0	0	109.8
79	S	82.4	Confident	74	Confident	52 Å²	52	123.2 Å²	123.2	36%	0.364	61%	0.608	S	S	.	*			trans	-104.3	113.7	179.4	175.6	0	0	0	0	111.5	G77 D81 H82	G77-S79 PolarHBondContact O-N 3.47Å; S79-D81 PolarHBondContact O-N 3.26Å; S79-D81 PolarHBondContact OG-N 3.2Å; S79-H82 PolarHBondContact OG-ND1 2.99Å
80	W	83.8	Confident	76.4	Confident	162 Å²	162	121.4 Å²	121.4	61%	0.614	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-68.8	-11.5	174	-63.2	91.1	0	0	0	113.7	H82 L83	W80-H82 PolarHBondContact O-N 3.21Å; W80-L83 HydrophobicContact CE3-CD2 4.24Å; W80-L83 HydrophobicContact CZ3-CD2 4.44Å; W80-L83 WeakPolarHBondContact O-CB 3.39Å; W80-L83 PolarHBondContact O-N 3.43Å
81	D	84.7	Confident	78.8	Confident	106 Å²	106	113.1 Å²	113.1	57%	0.567	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-67.7	-16.7	179.5	-71.9	-35.5	0	0	0	113	S79 R109	S79-D81 PolarHBondContact O-N 3.26Å; S79-D81 PolarHBondContact OG-N 3.2Å; D81-R109 PolarHBondContact O-NH1 2.66Å
82	H	87.1	Confident	81.2	Confident	155 Å²	155	101.5 Å²	101.5	72%	0.718	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-93.9	-7.7	179.1	-57.2	89	0	0	0	113.1	S79 W80	S79-H82 PolarHBondContact OG-ND1 2.99Å; W80-H82 PolarHBondContact O-N 3.21Å
83	L	92.1	Very high	83.2	Confident	39 Å²	39	92 Å²	92	20%	0.204	50%	0.504	C	S	.	.	S	Bend	trans	-64.7	132.7	179.2	-164.2	71.2	0	0	0	109.6	W80 L87 L88 I91 R109	W80-L83 HydrophobicContact CE3-CD2 4.24Å; W80-L83 HydrophobicContact CZ3-CD2 4.44Å; W80-L83 WeakPolarHBondContact O-CB 3.39Å; W80-L83 PolarHBondContact O-N 3.43Å; L83-L87 HydrophobicContact CD1-CB 4.16Å; L83-L87 HydrophobicContact CD1-CD1 3.67Å; L83-L87 HydrophobicContact CD2-CB 3.92Å; L83-L87 HydrophobicContact CG-CB 3.83Å; L83-L87 HydrophobicContact CG-CD1 4.22Å; L83-L88 HydrophobicContact CB-CG 4.4Å; L83-L88 HydrophobicContact CD2-CD2 3.79Å; L83-L88 HydrophobicContact CD2-CG 3.98Å; L83-L88 HydrophobicContact CG-CG 4.47Å; L83-I91 HydrophobicContact CD2-CD1 3.64Å; L83-R109 VanDerWaalsContact O-CZ 3.29Å; L83-R109 PolarHBondContact O-NH1 3.24Å; L83-R109 PolarHBondContact O-NH2 3.13Å
84	P	95.4	Very high	85.3	Confident	64 Å²	64	85.4 Å²	85.4	42%	0.416	49%	0.494	S	S	.	.			trans	-55.9	153.2	175.4	-26.8	33.8	0	0	0	113.8	E86 L87 L88	P84-E86 WeakPolarHBondContact CB-OE2 3.22Å; P84-E86 PolarHBondContact O-N 2.87Å; P84-L87 HydrophobicContact CG-CD1 4.43Å; P84-L87 PolarHBondContact O-N 3.33Å; P84-L88 PolarHBondContact O-N 3.17Å
85	D	95.6	Very high	87.3	Confident	40 Å²	40	81.5 Å²	81.5	21%	0.214	46%	0.463	C	S	.	.	H	α-helix	trans	-62.7	-34.1	-178.4	-83.6	1	0	0	0	111.4	L87 L88 L89 R109 R112 L113	D85-L87 VanDerWaalsContact C-N 3.35Å; D85-L87 PolarHBondContact O-N 3.21Å; D85-L88 PolarHBondContact O-N 3.37Å; D85-L89 WeakPolarHBondContact O-CB 3.43Å; D85-L89 VanDerWaalsContact O-CG 3.29Å; D85-L89 WeakPolarHBondContact O-CG 3.26Å; D85-L89 PolarHBondContact O-N 3.04Å; D85-R109 IonicContact OD1-CZ 2.71Å; D85-R109 IonicContact OD1-NE 2.77Å; D85-R109 PolarHBondContact OD1-NE 3.1Å; D85-R109 IonicContact OD1-NH2 2.94Å; D85-R109 PolarHBondContact OD1-NH2 2.89Å; D85-R112 IonicContact OD1-NH2 3.77Å; D85-R112 IonicContact OD2-CZ 2.82Å; D85-R112 IonicContact OD2-NH2 3.16Å; D85-R112 PolarHBondContact OD2-NH2 3.5Å; D85-L113 HydrophobicContact CB-CD1 4.37Å; D85-L113 HydrophobicContact CB-CD2 3.88Å
86	E	96.2	Very high	88.8	Confident	133 Å²	133	81.2 Å²	81.2	62%	0.621	45%	0.451	S	S	*	.	H	α-helix	trans	-64.2	-39.7	179.9	-57.3	74.4	-163.1	0	0	111.6	P84 L89 R90	P84-E86 WeakPolarHBondContact CB-OE2 3.22Å; P84-E86 PolarHBondContact O-N 2.87Å; E86-L89 PolarHBondContact O-N 3.36Å; E86-R90 PolarHBondContact O-N 3.05Å
87	L	95.4	Very high	90.2	Very high	91 Å²	91	74.8 Å²	74.8	48%	0.476	41%	0.405	S	S	.	.	H	α-helix	trans	-72.8	-38.2	176.9	-63.5	-172.5	0	0	0	111.2	L83 P84 D85 L89 R90 I91	L83-L87 HydrophobicContact CD1-CB 4.16Å; L83-L87 HydrophobicContact CD1-CD1 3.67Å; L83-L87 HydrophobicContact CD2-CB 3.92Å; L83-L87 HydrophobicContact CG-CB 3.83Å; L83-L87 HydrophobicContact CG-CD1 4.22Å; P84-L87 HydrophobicContact CG-CD1 4.43Å; P84-L87 PolarHBondContact O-N 3.33Å; D85-L87 VanDerWaalsContact C-N 3.35Å; D85-L87 PolarHBondContact O-N 3.21Å; L87-L89 VanDerWaalsContact C-N 3.35Å; L87-R90 WeakPolarHBondContact O-CB 3.27Å; L87-R90 PolarHBondContact O-N 3.17Å; L87-I91 VanDerWaalsContact O-CG1 3.29Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3Å
88	L	94.4	Very high	91.2	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-63.6	-40.6	172.4	-73.5	174.2	0	0	0	111.7	L83 P84 D85 R90 I91 C92 W110 L113	L83-L88 HydrophobicContact CB-CG 4.4Å; L83-L88 HydrophobicContact CD2-CD2 3.79Å; L83-L88 HydrophobicContact CD2-CG 3.98Å; L83-L88 HydrophobicContact CG-CG 4.47Å; P84-L88 PolarHBondContact O-N 3.17Å; D85-L88 PolarHBondContact O-N 3.37Å; L88-R90 VanDerWaalsContact C-N 3.3Å; L88-R90 PolarHBondContact O-N 3.35Å; L88-I91 HydrophobicContact CD2-CD1 4.49Å; L88-I91 PolarHBondContact O-N 3.05Å; L88-C92 WeakPolarHBondContact O-CB 3.46Å; L88-C92 PolarHBondContact O-N 3.13Å; L88-C92 PolarHBondContact O-SG 2.84Å; L88-W110 HydrophobicContact CD2-CH2 3.94Å; L88-W110 HydrophobicContact CD2-CZ2 3.54Å; L88-L113 HydrophobicContact CB-CD1 3.67Å; L88-L113 HydrophobicContact CD1-CD1 3.58Å; L88-L113 HydrophobicContact CG-CD1 4.28Å
89	L	95.9	Very high	91.8	Very high	36 Å²	36	68.8 Å²	68.8	19%	0.188	36%	0.355	C	S	.	.	H	α-helix	trans	-62.4	-39.4	173.1	-74.4	171.3	0	0	0	111.1	D85 E86 L87 C92 G93 L113 D116 L119	D85-L89 WeakPolarHBondContact O-CB 3.43Å; D85-L89 VanDerWaalsContact O-CG 3.29Å; D85-L89 WeakPolarHBondContact O-CG 3.26Å; D85-L89 PolarHBondContact O-N 3.04Å; E86-L89 PolarHBondContact O-N 3.36Å; L87-L89 VanDerWaalsContact C-N 3.35Å; L89-C92 CarbonylContact O-C 3.53Å; L89-C92 PolarHBondContact O-N 2.96Å; L89-G93 WeakPolarHBondContact O-CA 3.46Å; L89-G93 PolarHBondContact O-N 3.36Å; L89-L113 HydrophobicContact CD1-CD2 4.4Å; L89-L113 HydrophobicContact CD2-CB 4.07Å; L89-L113 HydrophobicContact CD2-CD2 4.09Å; L89-L113 WeakPolarHBondContact CD2-O 3.45Å; L89-L113 HydrophobicContact CG-CD2 4.05Å; L89-D116 HydrophobicContact CD2-CB 3.55Å; L89-L119 HydrophobicContact CD2-CD1 4.17Å; L89-L119 HydrophobicContact CD2-CG 4.34Å
90	R	95.1	Very high	92.3	Very high	192 Å²	192	66.3 Å²	66.3	73%	0.725	34%	0.338	S	S	*	.	H	α-helix	trans	-64.2	-41.7	175.2	-167.2	63.5	174.9	-178.9	0.8	112	E86 L87 L88 G93 C94	E86-R90 PolarHBondContact O-N 3.05Å; L87-R90 WeakPolarHBondContact O-CB 3.27Å; L87-R90 PolarHBondContact O-N 3.17Å; L88-R90 VanDerWaalsContact C-N 3.3Å; L88-R90 PolarHBondContact O-N 3.35Å; R90-G93 WeakPolarHBondContact O-CA 3.34Å; R90-G93 PolarHBondContact O-N 2.93Å; R90-G93 VanDerWaalsContact O-N 3.14Å; R90-C94 PolarHBondContact O-N 2.67Å; R90-C94 PolarHBondContact O-SG 3.41Å
91	I	94.8	Very high	92.6	Very high	67 Å²	67	59 Å²	59	34%	0.344	31%	0.311	S	S	.	.	H	α-helix	trans	-62.1	-50.4	174.4	-67.2	163.2	0	0	0	110.3	L83 L87 L88 G93 C94	L83-I91 HydrophobicContact CD2-CD1 3.64Å; L87-I91 VanDerWaalsContact O-CG1 3.29Å; L87-I91 WeakPolarHBondContact O-CG1 3.49Å; L87-I91 PolarHBondContact O-N 3Å; L88-I91 HydrophobicContact CD2-CD1 4.49Å; L88-I91 PolarHBondContact O-N 3.05Å; I91-G93 PolarHBondContact O-N 2.73Å; I91-C94 WeakPolarHBondContact O-CB 3.19Å; I91-C94 PolarHBondContact O-N 3.24Å
92	C	94.6	Very high	93	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.007	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-29.1	173.8	-70.3	0	0	0	0	112.3	L88 L89 C94 L95 L100 L119 R400	L88-C92 WeakPolarHBondContact O-CB 3.46Å; L88-C92 PolarHBondContact O-N 3.13Å; L88-C92 PolarHBondContact O-SG 2.84Å; L89-C92 CarbonylContact O-C 3.53Å; L89-C92 PolarHBondContact O-N 2.96Å; C92-C94 PolarHBondContact O-N 3.21Å; C92-L95 PolarHBondContact O-N 2.92Å; C92-L95 VanDerWaalsContact O-N 3.17Å; C92-L100 HydrophobicContact CB-CD1 3.8Å; C92-L119 HydrophobicContact CB-CD1 3.64Å; C92-L119 HydrophobicContact CB-CD2 4.36Å; C92-R400 PolarHBondContact O-NH2 3.08Å
93	G	93.6	Very high	93.3	Very high	29 Å²	29	54 Å²	54	30%	0.299	28%	0.281	S	S	.	.	H	α-helix	trans	-54.3	-35	171.8	0	0	0	0	0	113.2	L89 R90 I91 R400	L89-G93 WeakPolarHBondContact O-CA 3.46Å; L89-G93 PolarHBondContact O-N 3.36Å; R90-G93 WeakPolarHBondContact O-CA 3.34Å; R90-G93 PolarHBondContact O-N 2.93Å; R90-G93 VanDerWaalsContact O-N 3.14Å; I91-G93 PolarHBondContact O-N 2.73Å; G93-R400 PolarHBondContact O-NE 3.24Å; G93-R400 PolarHBondContact O-NH2 3.3Å
94	C	93.3	Very high	93.3	Very high	106 Å²	106	52.6 Å²	52.6	72%	0.716	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-10	-179	-59.8	0	0	0	0	113.8	R90 I91 C92	R90-C94 PolarHBondContact O-N 2.67Å; R90-C94 PolarHBondContact O-SG 3.41Å; I91-C94 WeakPolarHBondContact O-CB 3.19Å; I91-C94 PolarHBondContact O-N 3.24Å; C92-C94 PolarHBondContact O-N 3.21Å
95	L	92.1	Very high	93.2	Very high	44 Å²	44	52.5 Å²	52.5	23%	0.23	28%	0.279	C	S	.	.	S	Bend	trans	-87.1	139.3	-175	-59.9	178.8	0	0	0	111.9	C92 D99 L100 V103	C92-L95 PolarHBondContact O-N 2.92Å; C92-L95 VanDerWaalsContact O-N 3.17Å; L95-D99 HydrophobicContact CB-CB 4.21Å; L95-D99 HydrophobicContact CD2-CB 4.34Å; L95-L100 HydrophobicContact CB-CB 4.45Å; L95-V103 HydrophobicContact CD1-CB 4.39Å; L95-V103 HydrophobicContact CD1-CG1 3.68Å; L95-V103 HydrophobicContact CD1-CG2 3.83Å
96	P	90.1	Very high	93.2	Very high	52 Å²	52	55.3 Å²	55.3	34%	0.338	30%	0.297	S	S	.	.			trans	-69.4	165	167.6	32.8	-36.8	0	0	0	110.6	D99 L100	P96-D99 HydrophobicContact CG-CB 4.08Å; P96-D99 VanDerWaalsContact CG-OD2 3.22Å; P96-D99 WeakPolarHBondContact CG-OD2 3.4Å; P96-D99 PolarHBondContact O-N 3.06Å; P96-D99 VanDerWaalsContact O-N 3.12Å; P96-L100 WeakPolarHBondContact O-CB 3.46Å; P96-L100 PolarHBondContact O-N 3.09Å
97	L	89.6	Confident	93	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-53.9	-45.2	-175.2	178	57.9	0	0	0	113.9	D99 L100 L101 W120 V123 L401 K402 L403	L97-D99 VanDerWaalsContact C-N 3.33Å; L97-D99 PolarHBondContact O-N 2.82Å; L97-L100 PolarHBondContact O-N 3.23Å; L97-L101 HydrophobicContact CD1-CD1 4.19Å; L97-L101 HydrophobicContact CD1-CG 4.14Å; L97-L101 HydrophobicContact CG-CD1 4.38Å; L97-L101 WeakPolarHBondContact O-CG 3.48Å; L97-L101 PolarHBondContact O-N 2.92Å; L97-W120 HydrophobicContact CD1-CH2 3.33Å; L97-W120 HydrophobicContact CD1-CZ2 4.21Å; L97-W120 HydrophobicContact CD1-CZ3 3.54Å; L97-V123 HydrophobicContact CD2-CG1 4.45Å; L97-L401 HydrophobicContact CB-CB 4.15Å; L97-L401 HydrophobicContact CB-CD2 4.43Å; L97-L401 HydrophobicContact CD1-CB 4.35Å; L97-L401 HydrophobicContact CD1-CD1 4.32Å; L97-L401 HydrophobicContact CD2-CB 4.44Å; L97-K402 WeakPolarHBondContact CB-O 3.32Å; L97-L403 HydrophobicContact CD2-CD2 4.12Å; L97-L403 HydrophobicContact CD2-CG 3.89Å
98	P	89.1	Confident	92.9	Very high	16 Å²	16	58.2 Å²	58.2	10%	0.104	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-41.7	178.5	-23.6	35.3	0	0	0	112.8	L101 R102	P98-L101 PolarHBondContact O-N 3.02Å; P98-R102 WeakPolarHBondContact O-CG 3.39Å; P98-R102 PolarHBondContact O-N 3.33Å
99	D	91.9	Very high	93	Very high	52 Å²	52	61.1 Å²	61.1	28%	0.278	31%	0.314	S	S	.	.	H	α-helix	trans	-74.2	-36	-179.6	-66.2	-31.7	0	0	0	111.9	L95 P96 L97 L101 R102 V103	L95-D99 HydrophobicContact CB-CB 4.21Å; L95-D99 HydrophobicContact CD2-CB 4.34Å; P96-D99 HydrophobicContact CG-CB 4.08Å; P96-D99 VanDerWaalsContact CG-OD2 3.22Å; P96-D99 WeakPolarHBondContact CG-OD2 3.4Å; P96-D99 PolarHBondContact O-N 3.06Å; P96-D99 VanDerWaalsContact O-N 3.12Å; L97-D99 VanDerWaalsContact C-N 3.33Å; L97-D99 PolarHBondContact O-N 2.82Å; D99-L101 VanDerWaalsContact C-N 3.26Å; D99-L101 PolarHBondContact O-N 2.98Å; D99-R102 WeakPolarHBondContact O-CB 3.4Å; D99-R102 PolarHBondContact O-N 3.02Å; D99-R102 VanDerWaalsContact O-N 3.09Å; D99-R102 IonicContact OD1-CZ 3.67Å; D99-R102 IonicContact OD1-NE 3.96Å; D99-R102 IonicContact OD1-NH1 2.75Å; D99-R102 PolarHBondContact OD1-NH1 3.23Å; D99-V103 WeakPolarHBondContact O-CG1 3.33Å; D99-V103 PolarHBondContact O-N 3.29Å
100	L	93.3	Very high	92.9	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-58.4	-41.7	172.5	-172.5	62.7	0	0	0	111.1	C92 L95 P96 L97 V103 S104 A114 L119 W120 L401	C92-L100 HydrophobicContact CB-CD1 3.8Å; L95-L100 HydrophobicContact CB-CB 4.45Å; P96-L100 WeakPolarHBondContact O-CB 3.46Å; P96-L100 PolarHBondContact O-N 3.09Å; L97-L100 PolarHBondContact O-N 3.23Å; L100-V103 HydrophobicContact CD1-CG2 4.26Å; L100-V103 WeakPolarHBondContact O-CG2 3.41Å; L100-S104 PolarHBondContact O-N 3.09Å; L100-A114 HydrophobicContact CD1-CB 3.89Å; L100-A114 HydrophobicContact CG-CB 4.37Å; L100-L119 HydrophobicContact CD1-CD1 3.9Å; L100-L119 HydrophobicContact CD2-CB 4.39Å; L100-L119 HydrophobicContact CD2-CD1 4.41Å; L100-W120 HydrophobicContact CD2-CZ2 3.94Å; L100-L401 HydrophobicContact CD2-CD1 3.98Å; L100-L401 HydrophobicContact CD2-CD2 3.95Å
101	L	90.6	Very high	92.9	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-40.7	173.7	-68.4	175.3	0	0	0	111.8	V38 R41 L97 P98 D99 S104 W120 L137	V38-L101 HydrophobicContact CG2-CD1 3.67Å; R41-L101 PolarHBondContact NH1-O 3.15Å; R41-L101 PolarHBondContact NH2-O 2.76Å; L97-L101 HydrophobicContact CD1-CD1 4.19Å; L97-L101 HydrophobicContact CD1-CG 4.14Å; L97-L101 HydrophobicContact CG-CD1 4.38Å; L97-L101 WeakPolarHBondContact O-CG 3.48Å; L97-L101 PolarHBondContact O-N 2.92Å; P98-L101 PolarHBondContact O-N 3.02Å; D99-L101 VanDerWaalsContact C-N 3.26Å; D99-L101 PolarHBondContact O-N 2.98Å; L101-S104 PolarHBondContact O-N 2.87Å; L101-S104 PolarHBondContact O-OG 3.13Å; L101-W120 HydrophobicContact CD2-CH2 3.94Å; L101-W120 HydrophobicContact CD2-CZ2 4.29Å; L101-L137 HydrophobicContact CD2-CD2 4.05Å
102	R	92.4	Very high	92.9	Very high	132 Å²	132	62.5 Å²	62.5	50%	0.498	31%	0.312	S	S	.	.	H	α-helix	trans	-59.5	-50.1	175.3	-72	170.2	-176.5	163.7	-6	111.5	L37 P98 D99 S104 A105	L37-R102 HydrophobicContact CD1-CG 4.02Å; L37-R102 HydrophobicContact CD2-CG 4.49Å; P98-R102 WeakPolarHBondContact O-CG 3.39Å; P98-R102 PolarHBondContact O-N 3.33Å; D99-R102 WeakPolarHBondContact O-CB 3.4Å; D99-R102 PolarHBondContact O-N 3.02Å; D99-R102 VanDerWaalsContact O-N 3.09Å; D99-R102 IonicContact OD1-CZ 3.67Å; D99-R102 IonicContact OD1-NE 3.96Å; D99-R102 IonicContact OD1-NH1 2.75Å; D99-R102 PolarHBondContact OD1-NH1 3.23Å; R102-S104 PolarHBondContact O-N 2.89Å; R102-A105 WeakPolarHBondContact O-CB 3.3Å; R102-A105 PolarHBondContact O-N 2.88Å
103	V	93.5	Very high	92.9	Very high	26 Å²	26	62.7 Å²	62.7	16%	0.158	31%	0.313	C	S	.	.	H	α-helix	trans	-64.4	-25.5	-178.3	-59.9	0	0	0	0	112.8	L95 D99 L100 A105 V106 W110 A114	L95-V103 HydrophobicContact CD1-CB 4.39Å; L95-V103 HydrophobicContact CD1-CG1 3.68Å; L95-V103 HydrophobicContact CD1-CG2 3.83Å; D99-V103 WeakPolarHBondContact O-CG1 3.33Å; D99-V103 PolarHBondContact O-N 3.29Å; L100-V103 HydrophobicContact CD1-CG2 4.26Å; L100-V103 WeakPolarHBondContact O-CG2 3.41Å; V103-A105 PolarHBondContact O-N 3.41Å; V103-V106 WeakPolarHBondContact O-CB 3.35Å; V103-V106 WeakPolarHBondContact O-CG2 3.4Å; V103-V106 PolarHBondContact O-N 3.33Å; V103-V106 VanDerWaalsContact O-N 3.08Å; V103-W110 HydrophobicContact CB-CE3 3.88Å; V103-W110 HydrophobicContact CB-CZ3 4.16Å; V103-W110 HydrophobicContact CG1-CZ3 4.29Å; V103-W110 HydrophobicContact CG2-CE3 4.38Å; V103-A114 HydrophobicContact CG2-CB 4.17Å
104	S	93.2	Very high	93	Very high	8 Å²	8	61.3 Å²	61.3	6%	0.056	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.4	174.2	81	0	0	0	0	113.9	R41 L100 L101 R102 R111	R41-S104 VanDerWaalsContact NH1-C 3.28Å; R41-S104 PolarHBondContact NH1-OG 2.71Å; L100-S104 PolarHBondContact O-N 3.09Å; L101-S104 PolarHBondContact O-N 2.87Å; L101-S104 PolarHBondContact O-OG 3.13Å; R102-S104 PolarHBondContact O-N 2.89Å; S104-R111 WeakPolarHBondContact O-CB 3.26Å; S104-R111 WeakPolarHBondContact O-CG 3.28Å
105	A	93.4	Very high	93	Very high	63 Å²	63	58.7 Å²	58.7	52%	0.521	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-13.3	175.3	0	0	0	0	0	114	R41 R102 V103	R41-A105 VanDerWaalsContact CZ-CB 3.42Å; R41-A105 VanDerWaalsContact NH1-CA 3.26Å; R102-A105 WeakPolarHBondContact O-CB 3.3Å; R102-A105 PolarHBondContact O-N 2.88Å; V103-A105 PolarHBondContact O-N 3.41Å
106	V	94	Very high	93.1	Very high	98 Å²	98	59.4 Å²	59.4	59%	0.594	28%	0.282	S	S	*	.	S	Bend	trans	-62.7	-55.3	-169.3	173.7	0	0	0	0	110.8	V103 W110	V103-V106 WeakPolarHBondContact O-CB 3.35Å; V103-V106 WeakPolarHBondContact O-CG2 3.4Å; V103-V106 PolarHBondContact O-N 3.33Å; V103-V106 VanDerWaalsContact O-N 3.08Å; V106-W110 HydrophobicContact CB-CB 4.23Å; V106-W110 HydrophobicContact CB-CG 4.26Å; V106-W110 HydrophobicContact CG1-CG 4.37Å
107	C	92.7	Very high	93.2	Very high	50 Å²	50	63 Å²	63	34%	0.338	29%	0.294	S	S	.	.			trans	-157.8	175.3	172.8	75.9	0	0	0	0	111.4	R109 W110 R111	C107-R109 VanDerWaalsContact C-N 3.28Å; C107-R109 PolarHBondContact O-N 3.23Å; C107-W110 PolarHBondContact O-N 3.37Å; C107-R111 WeakPolarHBondContact O-CB 3.44Å; C107-R111 PolarHBondContact O-N 3.13Å
108	R	93.9	Very high	93.4	Very high	235 Å²	235	66 Å²	66	89%	0.887	32%	0.315	S	S	*	.	H	α-helix	trans	-56.5	-37	-179.9	-65.6	-175.5	-176.3	173.3	1.1	113.8	R112	R108-R112 PolarHBondContact O-N 3.23Å; R108-R112 VanDerWaalsContact O-N 3.1Å
109	R	95.2	Very high	93.7	Very high	62 Å²	62	65.5 Å²	65.5	23%	0.234	31%	0.312	C	S	.	.	H	α-helix	trans	-66.9	-51.4	179	-175.5	-176.8	-178.2	-163.8	2	110.9	D81 L83 D85 C107 R111 R112 L113	D81-R109 PolarHBondContact O-NH1 2.66Å; L83-R109 VanDerWaalsContact O-CZ 3.29Å; L83-R109 PolarHBondContact O-NH1 3.24Å; L83-R109 PolarHBondContact O-NH2 3.13Å; D85-R109 IonicContact OD1-CZ 2.71Å; D85-R109 IonicContact OD1-NE 2.77Å; D85-R109 PolarHBondContact OD1-NE 3.1Å; D85-R109 IonicContact OD1-NH2 2.94Å; D85-R109 PolarHBondContact OD1-NH2 2.89Å; C107-R109 VanDerWaalsContact C-N 3.28Å; C107-R109 PolarHBondContact O-N 3.23Å; R109-R111 VanDerWaalsContact C-N 3.3Å; R109-R111 PolarHBondContact O-N 2.8Å; R109-R112 WeakPolarHBondContact O-CB 3.25Å; R109-R112 PolarHBondContact O-N 3.23Å; R109-R112 VanDerWaalsContact O-N 3.16Å; R109-L113 HydrophobicContact CG-CD1 4.1Å; R109-L113 WeakPolarHBondContact O-CG 3.28Å; R109-L113 PolarHBondContact O-N 3.25Å
110	W	94.4	Very high	93.9	Very high	44 Å²	44	63.2 Å²	63.2	17%	0.167	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-36.9	177	-75.5	67	0	0	0	112.2	L88 V103 V106 C107 R112 L113 A114	L88-W110 HydrophobicContact CD2-CH2 3.94Å; L88-W110 HydrophobicContact CD2-CZ2 3.54Å; V103-W110 HydrophobicContact CB-CE3 3.88Å; V103-W110 HydrophobicContact CB-CZ3 4.16Å; V103-W110 HydrophobicContact CG1-CZ3 4.29Å; V103-W110 HydrophobicContact CG2-CE3 4.38Å; V106-W110 HydrophobicContact CB-CB 4.23Å; V106-W110 HydrophobicContact CB-CG 4.26Å; V106-W110 HydrophobicContact CG1-CG 4.37Å; C107-W110 PolarHBondContact O-N 3.37Å; W110-R112 PolarHBondContact O-N 3.11Å; W110-L113 PolarHBondContact O-N 2.71Å; W110-A114 WeakPolarHBondContact O-CB 3.33Å; W110-A114 PolarHBondContact O-N 3.3Å
111	R	94.4	Very high	94	Very high	128 Å²	128	66 Å²	66	48%	0.483	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-46.1	172.7	-171.2	174	175.1	166.7	2.3	112.4	S104 C107 R109 L115	S104-R111 WeakPolarHBondContact O-CB 3.26Å; S104-R111 WeakPolarHBondContact O-CG 3.28Å; C107-R111 WeakPolarHBondContact O-CB 3.44Å; C107-R111 PolarHBondContact O-N 3.13Å; R109-R111 VanDerWaalsContact C-N 3.3Å; R109-R111 PolarHBondContact O-N 2.8Å; R111-L115 HydrophobicContact CG-CD1 4.24Å; R111-L115 WeakPolarHBondContact O-CG 3.45Å; R111-L115 PolarHBondContact O-N 2.94Å
112	R	95.1	Very high	94.2	Very high	152 Å²	152	66.2 Å²	66.2	57%	0.574	32%	0.318	S	S	*	.	H	α-helix	trans	-60.5	-48.9	177.4	-177.8	-175.2	67.8	176.7	0.2	110.8	D85 R108 R109 W110 L115 D116	D85-R112 IonicContact OD1-NH2 3.77Å; D85-R112 IonicContact OD2-CZ 2.82Å; D85-R112 IonicContact OD2-NH2 3.16Å; D85-R112 PolarHBondContact OD2-NH2 3.5Å; R108-R112 PolarHBondContact O-N 3.23Å; R108-R112 VanDerWaalsContact O-N 3.1Å; R109-R112 WeakPolarHBondContact O-CB 3.25Å; R109-R112 PolarHBondContact O-N 3.23Å; R109-R112 VanDerWaalsContact O-N 3.16Å; W110-R112 PolarHBondContact O-N 3.11Å; R112-L115 PolarHBondContact O-N 3.48Å; R112-D116 PolarHBondContact O-N 3.39Å
113	L	95.5	Very high	94.3	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-36.5	-176.4	-62.7	172.8	0	0	0	112.9	D85 L88 L89 R109 W110 L115 D116 L119	D85-L113 HydrophobicContact CB-CD1 4.37Å; D85-L113 HydrophobicContact CB-CD2 3.88Å; L88-L113 HydrophobicContact CB-CD1 3.67Å; L88-L113 HydrophobicContact CD1-CD1 3.58Å; L88-L113 HydrophobicContact CG-CD1 4.28Å; L89-L113 HydrophobicContact CD1-CD2 4.4Å; L89-L113 HydrophobicContact CD2-CB 4.07Å; L89-L113 HydrophobicContact CD2-CD2 4.09Å; L89-L113 WeakPolarHBondContact CD2-O 3.45Å; L89-L113 HydrophobicContact CG-CD2 4.05Å; R109-L113 HydrophobicContact CG-CD1 4.1Å; R109-L113 WeakPolarHBondContact O-CG 3.28Å; R109-L113 PolarHBondContact O-N 3.25Å; W110-L113 PolarHBondContact O-N 2.71Å; L113-L115 PolarHBondContact O-N 3.43Å; L113-D116 WeakPolarHBondContact O-CB 3.29Å; L113-D116 PolarHBondContact O-N 2.89Å; L113-L119 WeakPolarHBondContact O-CD1 3.49Å
114	A	94.9	Very high	94.2	Very high	1 Å²	1	59 Å²	59	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-21.9	177.2	0	0	0	0	0	112.9	L100 V103 W110 W120	L100-A114 HydrophobicContact CD1-CB 3.89Å; L100-A114 HydrophobicContact CG-CB 4.37Å; V103-A114 HydrophobicContact CG2-CB 4.17Å; W110-A114 WeakPolarHBondContact O-CB 3.33Å; W110-A114 PolarHBondContact O-N 3.3Å; A114-W120 PolarHBondContact O-NE1 3.49Å
115	L	93.1	Very high	94.1	Very high	51 Å²	51	58.9 Å²	58.9	27%	0.267	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	13.4	176.5	-63	176.3	0	0	0	112.7	R111 R112 L113 W120 L137 T141	R111-L115 HydrophobicContact CG-CD1 4.24Å; R111-L115 WeakPolarHBondContact O-CG 3.45Å; R111-L115 PolarHBondContact O-N 2.94Å; R112-L115 PolarHBondContact O-N 3.48Å; L113-L115 PolarHBondContact O-N 3.43Å; L115-W120 HydrophobicContact CD2-CZ2 3.94Å; L115-L137 HydrophobicContact CD2-CD1 4.25Å; L115-T141 HydrophobicContact CD2-CG2 4.33Å
116	D	94.8	Very high	93.9	Very high	58 Å²	58	58.1 Å²	58.1	31%	0.31	27%	0.273	S	S	.	.			trans	-68.2	137.9	179	-172.9	-91	0	0	0	111.8	L89 R112 L113 S118 L119 W120	L89-D116 HydrophobicContact CD2-CB 3.55Å; R112-D116 PolarHBondContact O-N 3.39Å; L113-D116 WeakPolarHBondContact O-CB 3.29Å; L113-D116 PolarHBondContact O-N 2.89Å; D116-S118 PolarHBondContact O-N 3.01Å; D116-S118 VanDerWaalsContact O-N 3.12Å; D116-S118 WeakPolarHBondContact OD1-CB 3.29Å; D116-S118 PolarHBondContact OD1-N 3.33Å; D116-S118 PolarHBondContact OD1-OG 3.44Å; D116-L119 WeakPolarHBondContact O-CB 3.41Å; D116-L119 PolarHBondContact O-N 3.22Å; D116-W120 VanDerWaalsContact O-CD1 3.31Å
117	E	93.1	Very high	93.2	Very high	129 Å²	129	56 Å²	56	60%	0.603	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-33.6	-174.8	-60.9	-175.9	170.4	0	0	113.2	L119 W120 T141	E117-L119 PolarHBondContact O-N 3.49Å; E117-W120 PolarHBondContact O-N 3.17Å; E117-W120 VanDerWaalsContact O-N 3.1Å; E117-T141 WeakPolarHBondContact CA-O 3.35Å
118	S	94.1	Very high	92.7	Very high	68 Å²	68	54.7 Å²	54.7	48%	0.476	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-23	178.3	67.9	0	0	0	0	112.7	D116	D116-S118 PolarHBondContact O-N 3.01Å; D116-S118 VanDerWaalsContact O-N 3.12Å; D116-S118 WeakPolarHBondContact OD1-CB 3.29Å; D116-S118 PolarHBondContact OD1-N 3.33Å; D116-S118 PolarHBondContact OD1-OG 3.44Å
119	L	95	Very high	91.7	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-31.4	179.9	-59.8	-179.2	0	0	0	112.7	L89 C92 L100 L113 D116 E117 V121 R400 L401	L89-L119 HydrophobicContact CD2-CD1 4.17Å; L89-L119 HydrophobicContact CD2-CG 4.34Å; C92-L119 HydrophobicContact CB-CD1 3.64Å; C92-L119 HydrophobicContact CB-CD2 4.36Å; L100-L119 HydrophobicContact CD1-CD1 3.9Å; L100-L119 HydrophobicContact CD2-CB 4.39Å; L100-L119 HydrophobicContact CD2-CD1 4.41Å; L113-L119 WeakPolarHBondContact O-CD1 3.49Å; D116-L119 WeakPolarHBondContact O-CB 3.41Å; D116-L119 PolarHBondContact O-N 3.22Å; E117-L119 PolarHBondContact O-N 3.49Å; L119-V121 PolarHBondContact O-N 3.39Å; L119-R400 VanDerWaalsContact CD2-NH1 3.34Å; L119-R400 PolarHBondContact O-NH1 3.34Å; L119-L401 WeakPolarHBondContact O-CD1 3.33Å
120	W	95.1	Very high	90.9	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.011	26%	0.263	C	S	.	.			trans	-100.1	22	-167.8	-65	80.1	0	0	0	114.1	L97 L100 L101 A114 L115 D116 E117 S122 V123 V138 T141 V143 L401	L97-W120 HydrophobicContact CD1-CH2 3.33Å; L97-W120 HydrophobicContact CD1-CZ2 4.21Å; L97-W120 HydrophobicContact CD1-CZ3 3.54Å; L100-W120 HydrophobicContact CD2-CZ2 3.94Å; L101-W120 HydrophobicContact CD2-CH2 3.94Å; L101-W120 HydrophobicContact CD2-CZ2 4.29Å; A114-W120 PolarHBondContact O-NE1 3.49Å; L115-W120 HydrophobicContact CD2-CZ2 3.94Å; D116-W120 VanDerWaalsContact O-CD1 3.31Å; E117-W120 PolarHBondContact O-N 3.17Å; E117-W120 VanDerWaalsContact O-N 3.1Å; W120-S122 PolarHBondContact O-N 3.26Å; W120-S122 VanDerWaalsContact O-N 3.15Å; W120-V123 HydrophobicContact CE3-CG2 3.85Å; W120-V138 HydrophobicContact CE3-CG2 4.24Å; W120-V138 HydrophobicContact CZ3-CG2 3.89Å; W120-T141 HydrophobicContact CB-CG2 4.39Å; W120-T141 WeakPolarHBondContact CB-OG1 3.21Å; W120-T141 HydrophobicContact CD2-CG2 3.72Å; W120-T141 HydrophobicContact CE3-CG2 4.12Å; W120-T141 VanDerWaalsContact CG-CB 3.45Å; W120-T141 HydrophobicContact CG-CG2 3.82Å; W120-V143 WeakPolarHBondContact O-CA 3.41Å; W120-V143 WeakPolarHBondContact O-CG2 3.35Å; W120-L401 HydrophobicContact CB-CD1 4.39Å; W120-L401 HydrophobicContact CD2-CD1 3.52Å; W120-L401 HydrophobicContact CE3-CD1 3.56Å; W120-L401 HydrophobicContact CG-CD1 3.92Å; W120-L401 HydrophobicContact CH2-CD1 4.47Å; W120-L401 HydrophobicContact CZ2-CD1 4.45Å; W120-L401 HydrophobicContact CZ3-CD1 4.05Å
121	V	94.8	Very high	90.3	Very high	60 Å²	60	48.8 Å²	48.8	36%	0.364	26%	0.255	S	S	.	.	S	Bend	trans	-52.6	-40.1	-177.3	179.4	0	0	0	0	112.8	L119 Q144 R145	L119-V121 PolarHBondContact O-N 3.39Å; V121-Q144 PolarHBondContact O-N 2.71Å; V121-Q144 VanDerWaalsContact O-N 3.1Å; V121-R145 PolarHBondContact O-N 2.93Å
122	S	95.3	Very high	90	Very high	11 Å²	11	44 Å²	44	8%	0.077	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	129	179.1	55.7	0	0	0	0	112.3	W120 R145 R400 L401	W120-S122 PolarHBondContact O-N 3.26Å; W120-S122 VanDerWaalsContact O-N 3.15Å; S122-R145 CarbonylContact C-O 3.6Å; S122-R145 VanDerWaalsContact CA-O 3.28Å; S122-R145 WeakPolarHBondContact CA-O 3.47Å; S122-R400 PolarHBondContact O-N 2.97Å; S122-R400 PolarHBondContact OG-N 3.43Å; S122-L401 PolarHBondContact O-N 3.43Å
123	V	94.5	Very high	89.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	136.6	-174	-173.1	0	0	0	0	110.1	L97 W120 L125 V138 V143 R145 L146 R147 L401	L97-V123 HydrophobicContact CD2-CG1 4.45Å; W120-V123 HydrophobicContact CE3-CG2 3.85Å; V123-L125 HydrophobicContact CG1-CD2 3.65Å; V123-L125 HydrophobicContact CG1-CG 4Å; V123-V138 HydrophobicContact CB-CG1 3.98Å; V123-V138 HydrophobicContact CG1-CG1 4.13Å; V123-V138 HydrophobicContact CG1-CG2 3.99Å; V123-V138 HydrophobicContact CG2-CG1 3.87Å; V123-V143 HydrophobicContact CB-CG2 4.33Å; V123-V143 HydrophobicContact CG2-CG2 3.93Å; V123-R145 PolarHBondContact N-O 2.66Å; V123-L146 HydrophobicContact CB-CD1 4.3Å; V123-L146 WeakPolarHBondContact O-CA 3.19Å; V123-R147 PolarHBondContact O-N 3.24Å; V123-L401 CarbonylContact C-O 3.53Å; V123-L401 WeakPolarHBondContact CA-O 3.44Å; V123-L401 HydrophobicContact CG2-CB 4.22Å; V123-L401 HydrophobicContact CG2-CD1 4.31Å
124	D	92.7	Very high	89.4	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.032	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.4	171.6	-171.5	-0.5	0	0	0	110.4	E126 R147 R392 C399 L401 K402	D124-E126 VanDerWaalsContact OD1-CB 3.23Å; D124-E126 WeakPolarHBondContact OD1-CB 3.41Å; D124-E126 PolarHBondContact OD1-N 2.82Å; D124-R147 HydrophobicContact CB-CB 4.33Å; D124-R147 WeakPolarHBondContact OD1-CD 3.4Å; D124-R147 IonicContact OD1-NE 3.92Å; D124-R147 IonicContact OD2-NE 3.78Å; D124-R392 WeakPolarHBondContact OD2-CB 3.48Å; D124-C399 HydrophobicContact CB-CB 3.78Å; D124-L401 PolarHBondContact N-O 3.39Å; D124-K402 HydrophobicContact CB-CB 4.44Å; D124-K402 HydrophobicContact CB-CG 4.15Å
125	L	91.3	Very high	89.2	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.031	23%	0.225	C	C	.	.			trans	-109.8	8	-179.1	-61.9	-172.5	0	0	0	112.6	V123 G127 L128 A134 V138 L146 R147 C148 L403	V123-L125 HydrophobicContact CG1-CD2 3.65Å; V123-L125 HydrophobicContact CG1-CG 4Å; L125-G127 PolarHBondContact O-N 2.99Å; L125-L128 HydrophobicContact CB-CD1 4.08Å; L125-L128 HydrophobicContact CD2-CD1 3.91Å; L125-L128 HydrophobicContact CG-CD1 4.4Å; L125-L128 PolarHBondContact O-N 3.04Å; L125-A134 HydrophobicContact CD1-CB 4.44Å; L125-V138 HydrophobicContact CD1-CG2 4.24Å; L125-V138 HydrophobicContact CD2-CG2 4.27Å; L125-L146 HydrophobicContact CD1-CD1 3.89Å; L125-L146 HydrophobicContact CG-CD1 4.01Å; L125-R147 PolarHBondContact N-O 3.38Å; L125-C148 HydrophobicContact CB-CB 4.26Å; L125-L403 HydrophobicContact CD2-CD1 4.14Å
126	E	87.6	Confident	89.1	Confident	48 Å²	48	39.5 Å²	39.5	22%	0.224	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	132.5	178.3	-176	170.6	-169.3	0	0	111.6	D124 R147 P149 R150 I405	D124-E126 VanDerWaalsContact OD1-CB 3.23Å; D124-E126 WeakPolarHBondContact OD1-CB 3.41Å; D124-E126 PolarHBondContact OD1-N 2.82Å; E126-R147 IonicContact OE1-NH2 2.65Å; E126-R147 IonicContact OE2-CZ 2.61Å; E126-R147 IonicContact OE2-NE 3.93Å; E126-R147 PolarHBondContact OE2-NE 3.06Å; E126-R147 IonicContact OE2-NH2 3.62Å; E126-R147 PolarHBondContact OE2-NH2 2.72Å; E126-P149 HydrophobicContact CB-CG 4.24Å; E126-P149 HydrophobicContact CG-CG 4.01Å; E126-R150 IonicContact OE1-CZ 2.63Å; E126-R150 IonicContact OE1-NH1 3.74Å; E126-R150 IonicContact OE1-NH2 3.91Å; E126-R150 PolarHBondContact OE1-NH2 3.32Å; E126-I405 WeakPolarHBondContact O-CD1 3.34Å
127	G	79.6	Confident	88.9	Confident	53 Å²	53	39.1 Å²	39.1	55%	0.546	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	4	177.7	0	0	0	0	0	115.6	L125 I405	L125-G127 PolarHBondContact O-N 2.99Å; G127-I405 VanDerWaalsContact C-CD1 3.43Å; G127-I405 WeakPolarHBondContact O-CD1 3.26Å
128	L	81.9	Confident	88.9	Confident	22 Å²	22	33.2 Å²	33.2	12%	0.115	20%	0.195	C	C	.	.			trans	-69.1	136.7	171.7	-83	-177.2	0	0	0	112.8	L125 A134 L403	L125-L128 HydrophobicContact CB-CD1 4.08Å; L125-L128 HydrophobicContact CD2-CD1 3.91Å; L125-L128 HydrophobicContact CG-CD1 4.4Å; L125-L128 PolarHBondContact O-N 3.04Å; L128-A134 HydrophobicContact CD1-CB 3.49Å; L128-A134 VanDerWaalsContact CD1-CB 3.49Å; L128-L403 HydrophobicContact CD1-CD1 3.5Å; L128-L403 HydrophobicContact CD2-CD1 3.29Å; L128-L403 HydrophobicContact CD2-CG 4.47Å; L128-L403 HydrophobicContact CG-CD1 3.23Å
129	T	73.4	Confident	88.9	Confident	114 Å²	114	30.3 Å²	30.3	70%	0.699	17%	0.174	S	C	*	.	S	Bend	trans	-84.5	-35.3	174.8	53.1	0	0	0	0	113.2
130	Q	78	Confident	88.7	Confident	101 Å²	101	36.7 Å²	36.7	47%	0.472	20%	0.198	S	C	.	.			trans	-112.5	88.9	175.2	-64.7	-161.2	18.6	0	0	110.6	T35 L39	T35-Q130 HydrophobicContact CG2-CB 4.11Å; T35-Q130 HydrophobicContact CG2-CG 4.28Å; L39-Q130 VanDerWaalsContact CD1-CD 3.48Å; L39-Q130 HydrophobicContact CD1-CG 4.39Å; L39-Q130 HydrophobicContact CD2-CB 4.17Å
131	T	83.3	Confident	88.5	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-77.4	-39.7	-172.2	-31	0	0	0	0	112.9	A134 L135 C148 A151 F152 V153	T131-A134 WeakPolarHBondContact O-CB 3.5Å; T131-A134 PolarHBondContact O-N 3.1Å; T131-A134 VanDerWaalsContact O-N 3.11Å; T131-L135 HydrophobicContact CG2-CB 4.42Å; T131-L135 VanDerWaalsContact O-CB 3.26Å; T131-L135 WeakPolarHBondContact O-CB 3.37Å; T131-L135 PolarHBondContact O-N 3.22Å; T131-C148 VanDerWaalsContact CG2-SG 3.54Å; T131-A151 HydrophobicContact CG2-CB 3.63Å; T131-F152 VanDerWaalsContact CB-O 3.26Å; T131-F152 WeakPolarHBondContact CB-O 3.45Å; T131-F152 PolarHBondContact OG1-O 2.94Å; T131-V153 HydrophobicContact CG2-CG2 4.03Å
132	D	87.9	Confident	88.4	Confident	28 Å²	28	34.5 Å²	34.5	15%	0.15	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-47.9	-165.7	-53	20.6	0	0	0	113	A134 R136 V153 E154 E155	D132-A134 PolarHBondContact O-N 3.37Å; D132-R136 VanDerWaalsContact O-CB 3.28Å; D132-R136 WeakPolarHBondContact O-CB 3.49Å; D132-R136 PolarHBondContact O-N 2.91Å; D132-V153 VanDerWaalsContact OD1-CA 3.3Å; D132-V153 WeakPolarHBondContact OD1-CA 3.21Å; D132-E154 PolarHBondContact OD2-N 2.94Å; D132-E154 VanDerWaalsContact OD2-N 3.16Å; D132-E155 PolarHBondContact OD2-N 3.22Å
133	P	87.6	Confident	88.5	Confident	37 Å²	37	34 Å²	34	24%	0.24	18%	0.184	C	C	.	.	H	α-helix	trans	-69.5	-35.8	179.6	-21.1	37.7	0	0	0	112.1	L39 L137	L39-P133 HydrophobicContact CD2-CB 3.93Å; L39-P133 HydrophobicContact CD2-CG 3.6Å; P133-L137 WeakPolarHBondContact O-CB 3.41Å; P133-L137 PolarHBondContact O-N 3.33Å
134	A	88.8	Confident	88.6	Confident	4 Å²	4	38.2 Å²	38.2	3%	0.033	20%	0.204	C	C	.	.	H	α-helix	trans	-65.1	-48.8	177.1	0	0	0	0	0	110.9	V38 L125 L128 T131 D132 L137 V138	V38-A134 HydrophobicContact CG1-CB 3.73Å; L125-A134 HydrophobicContact CD1-CB 4.44Å; L128-A134 HydrophobicContact CD1-CB 3.49Å; L128-A134 VanDerWaalsContact CD1-CB 3.49Å; T131-A134 WeakPolarHBondContact O-CB 3.5Å; T131-A134 PolarHBondContact O-N 3.1Å; T131-A134 VanDerWaalsContact O-N 3.11Å; D132-A134 PolarHBondContact O-N 3.37Å; A134-L137 PolarHBondContact O-N 2.91Å; A134-V138 WeakPolarHBondContact O-CB 3.33Å; A134-V138 VanDerWaalsContact O-CG2 3.28Å; A134-V138 WeakPolarHBondContact O-CG2 3.48Å; A134-V138 PolarHBondContact O-N 3.11Å
135	L	91.3	Very high	88.8	Confident	6 Å²	6	39.8 Å²	39.8	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-46.5	178.1	-176.8	58.9	0	0	0	110.6	T131 L137 V138 L139 L146 V153 L156	T131-L135 HydrophobicContact CG2-CB 4.42Å; T131-L135 VanDerWaalsContact O-CB 3.26Å; T131-L135 WeakPolarHBondContact O-CB 3.37Å; T131-L135 PolarHBondContact O-N 3.22Å; L135-L137 VanDerWaalsContact C-N 3.31Å; L135-L137 PolarHBondContact O-N 3.37Å; L135-V138 PolarHBondContact O-N 2.67Å; L135-L139 HydrophobicContact CD1-CD1 3.92Å; L135-L139 HydrophobicContact CD1-CD2 4.42Å; L135-L139 HydrophobicContact CD1-CG 3.98Å; L135-L139 HydrophobicContact CG-CD1 3.85Å; L135-L139 HydrophobicContact CG-CG 4.33Å; L135-L139 WeakPolarHBondContact O-CB 3.35Å; L135-L139 WeakPolarHBondContact O-CG 3.24Å; L135-L139 PolarHBondContact O-N 3.5Å; L135-L146 HydrophobicContact CD1-CD2 3.48Å; L135-L146 VanDerWaalsContact CD1-CD2 3.48Å; L135-V153 HydrophobicContact CD2-CG1 4.11Å; L135-V153 HydrophobicContact CD2-CG2 3.85Å; L135-L156 HydrophobicContact CB-CD1 4.27Å; L135-L156 HydrophobicContact CD2-CD1 4.11Å; L135-L156 HydrophobicContact CD2-CD2 3.84Å; L135-L156 HydrophobicContact CG-CD1 4.04Å; L135-L156 HydrophobicContact CG-CD2 4.22Å
136	R	91.6	Very high	89	Confident	67 Å²	67	39.5 Å²	39.5	25%	0.253	21%	0.207	S	C	.	.	H	α-helix	trans	-57.7	-42.3	175.6	-172.9	-176.9	-61.4	151.1	7.8	112.3	D132 R140 E155 L156 D157 L158	D132-R136 VanDerWaalsContact O-CB 3.28Å; D132-R136 WeakPolarHBondContact O-CB 3.49Å; D132-R136 PolarHBondContact O-N 2.91Å; R136-R140 VanDerWaalsContact O-CG 3.3Å; R136-R140 WeakPolarHBondContact O-CG 3.34Å; R136-E155 PolarHBondContact NH2-O 3.35Å; R136-L156 HydrophobicContact CB-CD1 4.02Å; R136-D157 PolarHBondContact NE-O 2.96Å; R136-D157 VanDerWaalsContact NE-O 3.14Å; R136-L158 HydrophobicContact CG-CD2 4.41Å
137	L	89.9	Confident	89.3	Confident	51 Å²	51	37.8 Å²	37.8	27%	0.267	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-51.3	177.1	176.6	63.5	0	0	0	110.8	L101 L115 P133 A134 L135 L139 R140 T141	L101-L137 HydrophobicContact CD2-CD2 4.05Å; L115-L137 HydrophobicContact CD2-CD1 4.25Å; P133-L137 WeakPolarHBondContact O-CB 3.41Å; P133-L137 PolarHBondContact O-N 3.33Å; A134-L137 PolarHBondContact O-N 2.91Å; L135-L137 VanDerWaalsContact C-N 3.31Å; L135-L137 PolarHBondContact O-N 3.37Å; L137-L139 PolarHBondContact O-N 2.79Å; L137-R140 WeakPolarHBondContact O-CB 3.4Å; L137-R140 PolarHBondContact O-N 3.01Å; L137-R140 VanDerWaalsContact O-N 3.08Å; L137-T141 PolarHBondContact O-N 3.47Å
138	V	93.3	Very high	90	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.024	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-38	-175.8	169.5	0	0	0	0	112.3	W120 V123 L125 A134 L135 R140 T141 V143 L146	W120-V138 HydrophobicContact CE3-CG2 4.24Å; W120-V138 HydrophobicContact CZ3-CG2 3.89Å; V123-V138 HydrophobicContact CB-CG1 3.98Å; V123-V138 HydrophobicContact CG1-CG1 4.13Å; V123-V138 HydrophobicContact CG1-CG2 3.99Å; V123-V138 HydrophobicContact CG2-CG1 3.87Å; L125-V138 HydrophobicContact CD1-CG2 4.24Å; L125-V138 HydrophobicContact CD2-CG2 4.27Å; A134-V138 WeakPolarHBondContact O-CB 3.33Å; A134-V138 VanDerWaalsContact O-CG2 3.28Å; A134-V138 WeakPolarHBondContact O-CG2 3.48Å; A134-V138 PolarHBondContact O-N 3.11Å; L135-V138 PolarHBondContact O-N 2.67Å; V138-R140 PolarHBondContact O-N 2.68Å; V138-T141 PolarHBondContact O-N 3.15Å; V138-T141 PolarHBondContact O-OG1 3.42Å; V138-V143 HydrophobicContact CG1-CB 3.97Å; V138-V143 HydrophobicContact CG1-CG1 3.83Å; V138-V143 HydrophobicContact CG1-CG2 4.09Å; V138-V143 VanDerWaalsContact O-CG1 3.3Å; V138-V143 WeakPolarHBondContact O-CG1 3.47Å; V138-L146 HydrophobicContact CG1-CD1 3.9Å
139	L	93.3	Very high	90.5	Very high	8 Å²	8	34.6 Å²	34.6	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-24.4	176	-68.3	174.7	0	0	0	112.6	L135 L137 V143 L146 L156 L158 L164 L166 V184	L135-L139 HydrophobicContact CD1-CD1 3.92Å; L135-L139 HydrophobicContact CD1-CD2 4.42Å; L135-L139 HydrophobicContact CD1-CG 3.98Å; L135-L139 HydrophobicContact CG-CD1 3.85Å; L135-L139 HydrophobicContact CG-CG 4.33Å; L135-L139 WeakPolarHBondContact O-CB 3.35Å; L135-L139 WeakPolarHBondContact O-CG 3.24Å; L135-L139 PolarHBondContact O-N 3.5Å; L137-L139 PolarHBondContact O-N 2.79Å; L139-V143 HydrophobicContact CD2-CG1 4.33Å; L139-L146 HydrophobicContact CD2-CD2 4.04Å; L139-L156 HydrophobicContact CD1-CD2 3.85Å; L139-L158 HydrophobicContact CB-CD2 4.11Å; L139-L158 HydrophobicContact CD1-CD1 4.21Å; L139-L158 HydrophobicContact CD1-CD2 4Å; L139-L164 HydrophobicContact CB-CD2 4.15Å; L139-L164 HydrophobicContact CD2-CD1 4.15Å; L139-L164 HydrophobicContact CD2-CD2 4.49Å; L139-L164 WeakPolarHBondContact O-CD2 3.38Å; L139-L166 HydrophobicContact CD2-CD1 3.75Å; L139-L166 HydrophobicContact CD2-CG 4.45Å; L139-V184 HydrophobicContact CD1-CG2 3.85Å
140	R	91.3	Very high	91.3	Very high	139 Å²	139	37.1 Å²	37.1	53%	0.525	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-11.7	176.9	-69.9	174.3	-179.7	-162.8	-1	113.9	R136 L137 V138 S159	R136-R140 VanDerWaalsContact O-CG 3.3Å; R136-R140 WeakPolarHBondContact O-CG 3.34Å; L137-R140 WeakPolarHBondContact O-CB 3.4Å; L137-R140 PolarHBondContact O-N 3.01Å; L137-R140 VanDerWaalsContact O-N 3.08Å; V138-R140 PolarHBondContact O-N 2.68Å; R140-S159 PolarHBondContact NH2-OG 3.35Å
141	T	91.9	Very high	92	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.031	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	8.9	-177.2	61	0	0	0	0	113.8	L115 E117 W120 L137 V138	L115-T141 HydrophobicContact CD2-CG2 4.33Å; E117-T141 WeakPolarHBondContact CA-O 3.35Å; W120-T141 HydrophobicContact CB-CG2 4.39Å; W120-T141 WeakPolarHBondContact CB-OG1 3.21Å; W120-T141 HydrophobicContact CD2-CG2 3.72Å; W120-T141 HydrophobicContact CE3-CG2 4.12Å; W120-T141 VanDerWaalsContact CG-CB 3.45Å; W120-T141 HydrophobicContact CG-CG2 3.82Å; L137-T141 PolarHBondContact O-N 3.47Å; V138-T141 PolarHBondContact O-N 3.15Å; V138-T141 PolarHBondContact O-OG1 3.42Å
142	G	92.9	Very high	92.4	Very high	12 Å²	12	38 Å²	38	12%	0.124	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	27.6	-177.7	0	0	0	0	0	113.9	Q144	G142-Q144 PolarHBondContact O-N 3.25Å
143	V	95.9	Very high	92.6	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	16%	0.163	C	C	.	.			trans	-54.9	138	179.3	64.2	0	0	0	0	111.8	W120 V123 V138 L139 R145 L146 Q165 L166	W120-V143 WeakPolarHBondContact O-CA 3.41Å; W120-V143 WeakPolarHBondContact O-CG2 3.35Å; V123-V143 HydrophobicContact CB-CG2 4.33Å; V123-V143 HydrophobicContact CG2-CG2 3.93Å; V138-V143 HydrophobicContact CG1-CB 3.97Å; V138-V143 HydrophobicContact CG1-CG1 3.83Å; V138-V143 HydrophobicContact CG1-CG2 4.09Å; V138-V143 VanDerWaalsContact O-CG1 3.3Å; V138-V143 WeakPolarHBondContact O-CG1 3.47Å; L139-V143 HydrophobicContact CD2-CG1 4.33Å; V143-R145 VanDerWaalsContact CG2-O 3.25Å; V143-R145 WeakPolarHBondContact CG2-O 3.31Å; V143-L146 HydrophobicContact CG2-CB 4.31Å; V143-Q165 CarbonylContact O-C 3.2Å; V143-L166 HydrophobicContact CG1-CD2 3.82Å; V143-L166 HydrophobicContact CG1-CG 4.43Å; V143-L166 PolarHBondContact O-N 3.48Å
144	Q	96.6	Very high	92.6	Very high	88 Å²	88	40.7 Å²	40.7	41%	0.411	18%	0.179	S	C	.	.	S	Bend	trans	-105.8	-33.7	177.9	-60.5	-177.7	25.3	0	0	112.3	V121 G142 Q165 V167 D168	V121-Q144 PolarHBondContact O-N 2.71Å; V121-Q144 VanDerWaalsContact O-N 3.1Å; G142-Q144 PolarHBondContact O-N 3.25Å; Q144-Q165 WeakPolarHBondContact CA-O 3.37Å; Q144-Q165 HydrophobicContact CG-CB 4.37Å; Q144-V167 HydrophobicContact CB-CG2 4.3Å; Q144-V167 WeakPolarHBondContact O-CA 3.35Å; Q144-V167 PolarHBondContact O-N 3.31Å; Q144-D168 PolarHBondContact O-N 2.8Å
145	R	96.9	Very high	92.4	Very high	38 Å²	38	47.2 Å²	47.2	14%	0.143	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.4	174.3	177.4	176.8	-51.5	127.1	18.8	110.7	V121 S122 V123 V143 D168 M394 G398	V121-R145 PolarHBondContact O-N 2.93Å; S122-R145 CarbonylContact C-O 3.6Å; S122-R145 VanDerWaalsContact CA-O 3.28Å; S122-R145 WeakPolarHBondContact CA-O 3.47Å; V123-R145 PolarHBondContact N-O 2.66Å; V143-R145 VanDerWaalsContact CG2-O 3.25Å; V143-R145 WeakPolarHBondContact CG2-O 3.31Å; R145-D168 CarbonylContact C-O 3.52Å; R145-D168 WeakPolarHBondContact CA-O 3.47Å; R145-D168 HydrophobicContact CB-CB 3.98Å; R145-D168 HydrophobicContact CG-CB 3.78Å; R145-D168 IonicContact CZ-OD2 3.79Å; R145-D168 IonicContact NE-OD2 3.9Å; R145-D168 PolarHBondContact NE-OD2 3.32Å; R145-D168 IonicContact NH2-OD2 2.76Å; R145-D168 PolarHBondContact NH2-OD2 3.5Å; R145-M394 HydrophobicContact CG-CE 4.36Å; R145-G398 PolarHBondContact NH1-O 2.89Å; R145-G398 VanDerWaalsContact NH1-O 3.09Å
146	L	95.9	Very high	92.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	115	179.3	178.2	58.3	0	0	0	110.3	V123 L125 L135 V138 L139 V143 C148 L166 D168 L169 D170 M394	V123-L146 HydrophobicContact CB-CD1 4.3Å; V123-L146 WeakPolarHBondContact O-CA 3.19Å; L125-L146 HydrophobicContact CD1-CD1 3.89Å; L125-L146 HydrophobicContact CG-CD1 4.01Å; L135-L146 HydrophobicContact CD1-CD2 3.48Å; L135-L146 VanDerWaalsContact CD1-CD2 3.48Å; V138-L146 HydrophobicContact CG1-CD1 3.9Å; L139-L146 HydrophobicContact CD2-CD2 4.04Å; V143-L146 HydrophobicContact CG2-CB 4.31Å; L146-C148 HydrophobicContact CD1-CB 4.43Å; L146-C148 HydrophobicContact CG-CB 4.35Å; L146-L166 HydrophobicContact CB-CD2 3.75Å; L146-D168 PolarHBondContact N-O 3.21Å; L146-L169 HydrophobicContact CB-CD1 3.97Å; L146-L169 HydrophobicContact CD2-CD1 3.86Å; L146-L169 HydrophobicContact CG-CD1 4.02Å; L146-L169 WeakPolarHBondContact O-CA 3.49Å; L146-D170 PolarHBondContact O-N 2.96Å; L146-M394 WeakPolarHBondContact O-CE 3.3Å
147	R	94.6	Very high	91.7	Very high	13 Å²	13	49 Å²	49	5%	0.049	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	117.6	169.3	-177.6	178.1	174.3	116.7	-0.6	108.6	V123 D124 L125 E126 P149 T383 T393 M394	V123-R147 PolarHBondContact O-N 3.24Å; D124-R147 HydrophobicContact CB-CB 4.33Å; D124-R147 WeakPolarHBondContact OD1-CD 3.4Å; D124-R147 IonicContact OD1-NE 3.92Å; D124-R147 IonicContact OD2-NE 3.78Å; L125-R147 PolarHBondContact N-O 3.38Å; E126-R147 IonicContact OE1-NH2 2.65Å; E126-R147 IonicContact OE2-CZ 2.61Å; E126-R147 IonicContact OE2-NE 3.93Å; E126-R147 PolarHBondContact OE2-NE 3.06Å; E126-R147 IonicContact OE2-NH2 3.62Å; E126-R147 PolarHBondContact OE2-NH2 2.72Å; R147-P149 HydrophobicContact CG-CG 4.34Å; R147-T383 PolarHBondContact NH1-OG1 3.36Å; R147-T383 PolarHBondContact NH2-OG1 3.03Å; R147-T393 PolarHBondContact NH1-O 3.01Å; R147-M394 HydrophobicContact CB-SD 3.5Å; R147-M394 VanDerWaalsContact CB-SD 3.5Å; R147-M394 HydrophobicContact CG-SD 3.93Å
148	C	93.4	Very high	91.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.007	21%	0.214	C	C	.	.			trans	-149.8	54.6	179.7	-168.9	0	0	0	0	111.3	L125 T131 L146 A151 D170 L171 S174	L125-C148 HydrophobicContact CB-CB 4.26Å; T131-C148 VanDerWaalsContact CG2-SG 3.54Å; L146-C148 HydrophobicContact CD1-CB 4.43Å; L146-C148 HydrophobicContact CG-CB 4.35Å; C148-A151 VanDerWaalsContact SG-CB 3.58Å; C148-D170 CarbonylContact C-O 3.3Å; C148-D170 WeakPolarHBondContact CA-O 3.45Å; C148-D170 PolarHBondContact N-O 3.46Å; C148-L171 HydrophobicContact CB-CD2 4Å; C148-S174 PolarHBondContact O-OG 3.49Å
149	P	92.4	Very high	90.3	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.039	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	155	177.4	33.4	-36.9	0	0	0	111.2	E126 R147 A151 S172	E126-P149 HydrophobicContact CB-CG 4.24Å; E126-P149 HydrophobicContact CG-CG 4.01Å; R147-P149 HydrophobicContact CG-CG 4.34Å; P149-A151 PolarHBondContact O-N 3.15Å; P149-S172 CarbonylContact C-O 3.51Å; P149-S172 VanDerWaalsContact CA-O 3.28Å; P149-S172 WeakPolarHBondContact CA-O 3.45Å; P149-S172 WeakPolarHBondContact CB-O 3.36Å
150	R	91.4	Very high	89.4	Confident	167 Å²	167	56.6 Å²	56.6	63%	0.63	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	33.3	175.2	-55.8	-178.8	-61.9	-93.7	-1.7	113.9	E126 S172 G173 S174	E126-R150 IonicContact OE1-CZ 2.63Å; E126-R150 IonicContact OE1-NH1 3.74Å; E126-R150 IonicContact OE1-NH2 3.91Å; E126-R150 PolarHBondContact OE1-NH2 3.32Å; R150-S172 PolarHBondContact N-O 2.98Å; R150-G173 WeakPolarHBondContact CA-O 3.27Å; R150-S174 PolarHBondContact N-OG 2.99Å
151	A	91.5	Very high	88.4	Confident	7 Å²	7	56 Å²	56	6%	0.058	28%	0.279	C	S	.	.			trans	-85.2	153.5	176.6	0	0	0	0	0	111.5	T131 C148 P149 V153 S174 V175	T131-A151 HydrophobicContact CG2-CB 3.63Å; C148-A151 VanDerWaalsContact SG-CB 3.58Å; P149-A151 PolarHBondContact O-N 3.15Å; A151-V153 HydrophobicContact CB-CG2 4.28Å; A151-S174 PolarHBondContact N-OG 3.21Å; A151-S174 CarbonylContact O-C 3.45Å; A151-S174 WeakPolarHBondContact O-CA 3.31Å; A151-S174 WeakPolarHBondContact O-CB 3.48Å; A151-V175 PolarHBondContact O-N 3.03Å
152	F	92.3	Very high	88	Confident	114 Å²	114	57.6 Å²	57.6	50%	0.5	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.8	163.2	-177.5	-95.6	0	0	0	108.3	T131 E154 V175	T131-F152 VanDerWaalsContact CB-O 3.26Å; T131-F152 WeakPolarHBondContact CB-O 3.45Å; T131-F152 PolarHBondContact OG1-O 2.94Å; F152-E154 HydrophobicContact CE1-CB 3.89Å; F152-E154 HydrophobicContact CZ-CB 4.17Å; F152-V175 CarbonylContact C-O 3.59Å; F152-V175 WeakPolarHBondContact CA-O 3.5Å; F152-V175 HydrophobicContact CD2-CB 3.88Å; F152-V175 HydrophobicContact CD2-CG1 3.92Å; F152-V175 HydrophobicContact CE2-CB 4.43Å; F152-V175 HydrophobicContact CE2-CG1 3.96Å
153	V	90.9	Very high	88	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	104.1	-179.5	-175.6	0	0	0	0	110.2	T131 D132 L135 A151 L156 V175 V176 S177 A180	T131-V153 HydrophobicContact CG2-CG2 4.03Å; D132-V153 VanDerWaalsContact OD1-CA 3.3Å; D132-V153 WeakPolarHBondContact OD1-CA 3.21Å; L135-V153 HydrophobicContact CD2-CG1 4.11Å; L135-V153 HydrophobicContact CD2-CG2 3.85Å; A151-V153 HydrophobicContact CB-CG2 4.28Å; V153-L156 HydrophobicContact CG1-CB 4.14Å; V153-V175 PolarHBondContact N-O 2.78Å; V153-V176 HydrophobicContact CB-CB 4.48Å; V153-V176 HydrophobicContact CB-CG1 4.17Å; V153-V176 HydrophobicContact CB-CG2 4.22Å; V153-V176 HydrophobicContact CG1-CG1 4.39Å; V153-V176 HydrophobicContact CG2-CG2 4.4Å; V153-V176 CarbonylContact O-C 3.48Å; V153-V176 WeakPolarHBondContact O-CA 3.49Å; V153-S177 PolarHBondContact O-N 3.3Å; V153-A180 HydrophobicContact CG1-CB 3.98Å
154	E	88.3	Confident	88	Confident	120 Å²	120	66.5 Å²	66.5	56%	0.561	33%	0.327	S	S	*	.	S	Bend	trans	-96.6	-47.7	-178.7	-169.8	171.9	-169.3	0	0	111.1	D132 F152 S177	D132-E154 PolarHBondContact OD2-N 2.94Å; D132-E154 VanDerWaalsContact OD2-N 3.16Å; F152-E154 HydrophobicContact CE1-CB 3.89Å; F152-E154 HydrophobicContact CZ-CB 4.17Å; E154-S177 VanDerWaalsContact O-CB 3.3Å; E154-S177 WeakPolarHBondContact O-CB 3.34Å; E154-S177 PolarHBondContact O-OG 2.87Å
155	E	85.4	Confident	87.9	Confident	142 Å²	142	65.6 Å²	65.6	66%	0.664	32%	0.323	S	S	*	.			trans	-128.3	105.8	-174.1	-68.8	-168.7	168.4	0	0	112.9	D132 R136	D132-E155 PolarHBondContact OD2-N 3.22Å; R136-E155 PolarHBondContact NH2-O 3.35Å
156	L	86.6	Confident	87.9	Confident	13 Å²	13	63.8 Å²	63.8	7%	0.068	32%	0.316	C	S	.	.			trans	-119.8	81.9	176.7	-165.6	71	0	0	0	112.1	L135 R136 L139 V153 L158 A180 S183 V184	L135-L156 HydrophobicContact CB-CD1 4.27Å; L135-L156 HydrophobicContact CD2-CD1 4.11Å; L135-L156 HydrophobicContact CD2-CD2 3.84Å; L135-L156 HydrophobicContact CG-CD1 4.04Å; L135-L156 HydrophobicContact CG-CD2 4.22Å; R136-L156 HydrophobicContact CB-CD1 4.02Å; L139-L156 HydrophobicContact CD1-CD2 3.85Å; V153-L156 HydrophobicContact CG1-CB 4.14Å; L156-L158 HydrophobicContact CG-CD2 4.39Å; L156-L158 HydrophobicContact CG-CG 4.35Å; L156-L158 PolarHBondContact O-N 2.82Å; L156-A180 HydrophobicContact CB-CB 3.63Å; L156-S183 PolarHBondContact O-OG 3.32Å; L156-V184 HydrophobicContact CD2-CG2 3.31Å
157	D	80.6	Confident	88	Confident	98 Å²	98	64.9 Å²	64.9	52%	0.524	32%	0.323	S	S	.	.			trans	-80.8	114.8	166.7	-179.3	32	0	0	0	111.3	R136 S159	R136-D157 PolarHBondContact NE-O 2.96Å; R136-D157 VanDerWaalsContact NE-O 3.14Å; D157-S159 PolarHBondContact OD1-N 3.27Å; D157-S159 PolarHBondContact OD2-OG 2.94Å
158	L	81.4	Confident	88.2	Confident	15 Å²	15	64.3 Å²	64.3	8%	0.079	32%	0.321	C	S	.	.			trans	-101.2	79.8	170.5	-60.9	175	0	0	0	108	R136 L139 L156 E160 L164 R187	R136-L158 HydrophobicContact CG-CD2 4.41Å; L139-L158 HydrophobicContact CB-CD2 4.11Å; L139-L158 HydrophobicContact CD1-CD1 4.21Å; L139-L158 HydrophobicContact CD1-CD2 4Å; L156-L158 HydrophobicContact CG-CD2 4.39Å; L156-L158 HydrophobicContact CG-CG 4.35Å; L156-L158 PolarHBondContact O-N 2.82Å; L158-E160 PolarHBondContact O-N 2.91Å; L158-L164 HydrophobicContact CD1-CD1 4.42Å; L158-R187 PolarHBondContact O-NH1 2.98Å; L158-R187 VanDerWaalsContact O-NH1 3.16Å
159	S	73.2	Confident	88.4	Confident	70 Å²	70	64.3 Å²	64.3	49%	0.49	32%	0.321	S	S	.	.			trans	-50.4	-14.6	-171.7	-36.4	0	0	0	0	117	R140 D157	R140-S159 PolarHBondContact NH2-OG 3.35Å; D157-S159 PolarHBondContact OD1-N 3.27Å; D157-S159 PolarHBondContact OD2-OG 2.94Å
160	E	74.4	Confident	88.6	Confident	136 Å²	136	64.1 Å²	64.1	64%	0.636	32%	0.319	S	S	*	.	S	Bend	trans	-111.7	130	179.8	-66.2	-62.9	156.8	0	0	110.6	L158 G162 R187	L158-E160 PolarHBondContact O-N 2.91Å; E160-G162 VanDerWaalsContact C-N 3.26Å; E160-G162 PolarHBondContact O-N 3.48Å; E160-R187 PolarHBondContact O-NH1 3.41Å; E160-R187 PolarHBondContact O-NH2 2.89Å
161	P	69.3	Low	88.8	Confident	126 Å²	126	56.4 Å²	56.4	82%	0.818	29%	0.291	S	S	*	.			trans	-77.4	21.3	-172	29.6	-34.9	0	0	0	116.8
162	G	84.6	Confident	89	Confident	40 Å²	40	57 Å²	57	41%	0.412	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-73.9	153.9	-175.1	0	0	0	0	0	116.2	E160 R187	E160-G162 VanDerWaalsContact C-N 3.26Å; E160-G162 PolarHBondContact O-N 3.48Å; G162-R187 PolarHBondContact O-NE 3.17Å; G162-R187 PolarHBondContact O-NH2 3.15Å
163	R	92.2	Very high	88.9	Confident	191 Å²	191	53.5 Å²	53.5	72%	0.721	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-66.4	142.3	170.8	-66.7	-173.5	-177.1	-164.4	5.1	111.3	S189	R163-S189 PolarHBondContact NH1-OG 2.76Å
164	L	95.2	Very high	89	Confident	10 Å²	10	53.7 Å²	53.7	5%	0.052	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-82.6	147.7	172.5	-62.9	174.9	0	0	0	109.9	L139 L158 L166 V184 R187	L139-L164 HydrophobicContact CB-CD2 4.15Å; L139-L164 HydrophobicContact CD2-CD1 4.15Å; L139-L164 HydrophobicContact CD2-CD2 4.49Å; L139-L164 WeakPolarHBondContact O-CD2 3.38Å; L158-L164 HydrophobicContact CD1-CD1 4.42Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 HydrophobicContact CB-CD1 4.45Å; L164-L166 HydrophobicContact CB-CG 4.48Å; L164-L166 HydrophobicContact CD1-CD1 4.13Å; L164-L166 PolarHBondContact O-N 3.49Å; L164-V184 HydrophobicContact CD1-CG1 3.98Å; L164-R187 HydrophobicContact CB-CB 4.47Å; L164-R187 HydrophobicContact CD1-CB 4Å; L164-R187 HydrophobicContact CG-CB 3.85Å; L164-R187 PolarHBondContact N-O 3.2Å
165	Q	95.4	Very high	89.3	Confident	68 Å²	68	52.5 Å²	52.5	32%	0.318	29%	0.292	S	S	.	.			trans	-90.6	13.6	178.9	-60.5	-57.5	-35.8	0	0	113.1	V143 Q144 V167	V143-Q165 CarbonylContact O-C 3.2Å; Q144-Q165 WeakPolarHBondContact CA-O 3.37Å; Q144-Q165 HydrophobicContact CG-CB 4.37Å; Q165-V167 PolarHBondContact O-N 3.1Å
166	L	97.3	Very high	89.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.264	C	S	.	.			trans	-61.8	130.9	-177.6	-75.7	169.7	0	0	0	111.6	L139 V143 L146 L164 L169 V184 R190 L191	L139-L166 HydrophobicContact CD2-CD1 3.75Å; L139-L166 HydrophobicContact CD2-CG 4.45Å; V143-L166 HydrophobicContact CG1-CD2 3.82Å; V143-L166 HydrophobicContact CG1-CG 4.43Å; V143-L166 PolarHBondContact O-N 3.48Å; L146-L166 HydrophobicContact CB-CD2 3.75Å; L164-L166 VanDerWaalsContact C-N 3.27Å; L164-L166 HydrophobicContact CB-CD1 4.45Å; L164-L166 HydrophobicContact CB-CG 4.48Å; L164-L166 HydrophobicContact CD1-CD1 4.13Å; L164-L166 PolarHBondContact O-N 3.49Å; L166-L169 HydrophobicContact CD1-CD1 4.48Å; L166-L169 HydrophobicContact CD1-CD2 4.31Å; L166-V184 HydrophobicContact CD1-CG1 3.96Å; L166-R190 CarbonylContact O-C 3.58Å; L166-L191 HydrophobicContact CB-CD2 3.99Å
167	V	97.8	Very high	90	Very high	23 Å²	23	46.9 Å²	46.9	14%	0.139	27%	0.27	C	S	.	.	S	Bend	trans	-116.4	-39.9	175.4	179.3	0	0	0	0	110.1	Q144 Q165 R192 R193	Q144-V167 HydrophobicContact CB-CG2 4.3Å; Q144-V167 WeakPolarHBondContact O-CA 3.35Å; Q144-V167 PolarHBondContact O-N 3.31Å; Q165-V167 PolarHBondContact O-N 3.1Å; V167-R192 HydrophobicContact CG1-CB 3.91Å; V167-R192 HydrophobicContact CG1-CG 3.86Å; V167-R192 PolarHBondContact O-N 2.88Å; V167-R193 PolarHBondContact O-N 3.31Å; V167-R193 VanDerWaalsContact O-N 3.17Å
168	D	98.1	Very high	90.6	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.011	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.3	-179.3	-57.2	-41.5	0	0	0	108.8	Q144 R145 L146 R193 M394 W395	Q144-D168 PolarHBondContact O-N 2.8Å; R145-D168 CarbonylContact C-O 3.52Å; R145-D168 WeakPolarHBondContact CA-O 3.47Å; R145-D168 HydrophobicContact CB-CB 3.98Å; R145-D168 HydrophobicContact CG-CB 3.78Å; R145-D168 IonicContact CZ-OD2 3.79Å; R145-D168 IonicContact NE-OD2 3.9Å; R145-D168 PolarHBondContact NE-OD2 3.32Å; R145-D168 IonicContact NH2-OD2 2.76Å; R145-D168 PolarHBondContact NH2-OD2 3.5Å; L146-D168 PolarHBondContact N-O 3.21Å; D168-R193 CarbonylContact C-O 3.53Å; D168-R193 WeakPolarHBondContact CA-O 3.41Å; D168-R193 IonicContact OD1-CZ 2.98Å; D168-R193 IonicContact OD1-NE 2.83Å; D168-R193 PolarHBondContact OD1-NE 3.09Å; D168-R193 IonicContact OD1-NH2 3.18Å; D168-R193 PolarHBondContact OD1-NH2 2.94Å; D168-R193 IonicContact OD2-CZ 3.75Å; D168-R193 IonicContact OD2-NE 2.67Å; D168-R193 IonicContact OD2-NH2 3.62Å; D168-R193 PolarHBondContact OD2-NH2 3.07Å; D168-M394 HydrophobicContact CB-CE 3.98Å; D168-W395 HydrophobicContact CB-CE3 4.19Å; D168-W395 HydrophobicContact CB-CZ3 3.91Å
169	L	97.7	Very high	91.1	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	124.5	-179.1	176.5	63.8	0	0	0	111.6	L146 L166 L171 V184 L191 R193 L194 S195 W395	L146-L169 HydrophobicContact CB-CD1 3.97Å; L146-L169 HydrophobicContact CD2-CD1 3.86Å; L146-L169 HydrophobicContact CG-CD1 4.02Å; L146-L169 WeakPolarHBondContact O-CA 3.49Å; L166-L169 HydrophobicContact CD1-CD1 4.48Å; L166-L169 HydrophobicContact CD1-CD2 4.31Å; L169-L171 HydrophobicContact CD1-CD1 4.4Å; L169-L171 HydrophobicContact CD1-CD2 4.21Å; L169-L171 HydrophobicContact CD1-CG 3.97Å; L169-L171 HydrophobicContact CD2-CD1 4.03Å; L169-L171 HydrophobicContact CD2-CG 4.34Å; L169-L171 HydrophobicContact CG-CD1 4.34Å; L169-L171 HydrophobicContact CG-CG 4.09Å; L169-V184 HydrophobicContact CD2-CG1 4.06Å; L169-L191 HydrophobicContact CB-CD2 4.27Å; L169-R193 PolarHBondContact N-O 2.81Å; L169-L194 HydrophobicContact CB-CD1 3.83Å; L169-L194 HydrophobicContact CD2-CD1 3.85Å; L169-L194 HydrophobicContact CG-CD1 3.96Å; L169-L194 WeakPolarHBondContact O-CA 3.38Å; L169-S195 PolarHBondContact O-N 2.95Å; L169-W395 WeakPolarHBondContact O-CH2 3.19Å
170	D	96.9	Very high	92.1	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	115.1	172.6	177.5	20.5	0	0	0	110.4	L146 C148 S172 P382 M394	L146-D170 PolarHBondContact O-N 2.96Å; C148-D170 CarbonylContact C-O 3.3Å; C148-D170 WeakPolarHBondContact CA-O 3.45Å; C148-D170 PolarHBondContact N-O 3.46Å; D170-S172 VanDerWaalsContact OD1-CB 3.23Å; D170-S172 WeakPolarHBondContact OD1-CB 3.4Å; D170-S172 PolarHBondContact OD1-N 3.27Å; D170-S172 PolarHBondContact OD1-OG 3.27Å; D170-P382 HydrophobicContact CB-CB 4.05Å; D170-P382 HydrophobicContact CB-CG 3.97Å; D170-P382 VanDerWaalsContact CG-CG 3.4Å; D170-P382 WeakPolarHBondContact OD1-CG 3.26Å; D170-P382 VanDerWaalsContact OD2-CB 3.29Å; D170-P382 WeakPolarHBondContact OD2-CB 3.43Å; D170-M394 HydrophobicContact CB-CE 3.57Å; D170-M394 HydrophobicContact CB-CG 4.42Å; D170-M394 HydrophobicContact CB-SD 3.51Å; D170-M394 VanDerWaalsContact CB-SD 3.51Å
171	L	96.2	Very high	93.1	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.031	25%	0.245	C	C	.	.			trans	-119.4	18.9	171.4	-63.2	176	0	0	0	111.3	C148 L169 G173 S174 L181 S195 L196 L199	C148-L171 HydrophobicContact CB-CD2 4Å; L169-L171 HydrophobicContact CD1-CD1 4.4Å; L169-L171 HydrophobicContact CD1-CD2 4.21Å; L169-L171 HydrophobicContact CD1-CG 3.97Å; L169-L171 HydrophobicContact CD2-CD1 4.03Å; L169-L171 HydrophobicContact CD2-CG 4.34Å; L169-L171 HydrophobicContact CG-CD1 4.34Å; L169-L171 HydrophobicContact CG-CG 4.09Å; L171-G173 PolarHBondContact O-N 3.1Å; L171-S174 WeakPolarHBondContact O-CB 3.42Å; L171-S174 PolarHBondContact O-N 2.95Å; L171-S174 PolarHBondContact O-OG 3.23Å; L171-L181 HydrophobicContact CD1-CD1 4.12Å; L171-S195 PolarHBondContact N-O 2.99Å; L171-L196 HydrophobicContact CB-CD2 4.25Å; L171-L196 HydrophobicContact CD1-CD2 4.12Å; L171-L199 HydrophobicContact CB-CD1 4.09Å
172	S	94.6	Very high	94.2	Very high	19 Å²	19	40.7 Å²	40.7	13%	0.133	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	136.4	-174.6	52.9	0	0	0	0	113.3	P149 R150 D170 S174	P149-S172 CarbonylContact C-O 3.51Å; P149-S172 VanDerWaalsContact CA-O 3.28Å; P149-S172 WeakPolarHBondContact CA-O 3.45Å; P149-S172 WeakPolarHBondContact CB-O 3.36Å; R150-S172 PolarHBondContact N-O 2.98Å; D170-S172 VanDerWaalsContact OD1-CB 3.23Å; D170-S172 WeakPolarHBondContact OD1-CB 3.4Å; D170-S172 PolarHBondContact OD1-N 3.27Å; D170-S172 PolarHBondContact OD1-OG 3.27Å; S172-S174 PolarHBondContact O-N 3.22Å; S172-S174 VanDerWaalsContact O-N 3.11Å
173	G	91	Very high	94.6	Very high	41 Å²	41	40.2 Å²	40.2	42%	0.423	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	14.9	177.7	0	0	0	0	0	114.4	R150 L171 E197	R150-G173 WeakPolarHBondContact CA-O 3.27Å; L171-G173 PolarHBondContact O-N 3.1Å; G173-E197 PolarHBondContact N-O 3.35Å
174	S	93.6	Very high	94.7	Very high	6 Å²	6	31.4 Å²	31.4	4%	0.042	19%	0.188	C	C	.	.			trans	-79.9	165.3	175.3	-56.9	0	0	0	0	111.1	C148 R150 A151 L171 S172 L199	C148-S174 PolarHBondContact O-OG 3.49Å; R150-S174 PolarHBondContact N-OG 2.99Å; A151-S174 PolarHBondContact N-OG 3.21Å; A151-S174 CarbonylContact O-C 3.45Å; A151-S174 WeakPolarHBondContact O-CA 3.31Å; A151-S174 WeakPolarHBondContact O-CB 3.48Å; L171-S174 WeakPolarHBondContact O-CB 3.42Å; L171-S174 PolarHBondContact O-N 2.95Å; L171-S174 PolarHBondContact O-OG 3.23Å; S172-S174 PolarHBondContact O-N 3.22Å; S172-S174 VanDerWaalsContact O-N 3.11Å; S174-L199 WeakPolarHBondContact O-CD2 3.28Å
175	V	94	Very high	94.7	Very high	94 Å²	94	30.9 Å²	30.9	57%	0.57	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	102.4	165.5	179.6	0	0	0	0	106.4	A151 F152 V153	A151-V175 PolarHBondContact O-N 3.03Å; F152-V175 CarbonylContact C-O 3.59Å; F152-V175 WeakPolarHBondContact CA-O 3.5Å; F152-V175 HydrophobicContact CD2-CB 3.88Å; F152-V175 HydrophobicContact CD2-CG1 3.92Å; F152-V175 HydrophobicContact CE2-CB 4.43Å; F152-V175 HydrophobicContact CE2-CG1 3.96Å; V153-V175 PolarHBondContact N-O 2.78Å
176	V	93.9	Very high	94.6	Very high	12 Å²	12	29.6 Å²	29.6	7%	0.073	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.1	-176.9	-174.7	0	0	0	0	108.7	V153 A180 L181 L199	V153-V176 HydrophobicContact CB-CB 4.48Å; V153-V176 HydrophobicContact CB-CG1 4.17Å; V153-V176 HydrophobicContact CB-CG2 4.22Å; V153-V176 HydrophobicContact CG1-CG1 4.39Å; V153-V176 HydrophobicContact CG2-CG2 4.4Å; V153-V176 CarbonylContact O-C 3.48Å; V153-V176 WeakPolarHBondContact O-CA 3.49Å; V176-A180 HydrophobicContact CG1-CB 3.93Å; V176-L181 HydrophobicContact CG1-CB 3.91Å; V176-L199 HydrophobicContact CB-CD2 4.26Å; V176-L199 HydrophobicContact CG2-CD2 4.15Å
177	S	93.6	Very high	94.5	Very high	26 Å²	26	32 Å²	32	18%	0.182	19%	0.192	C	C	.	.			trans	-62.4	145.8	175.2	71.9	0	0	0	0	111	V153 E154 S179 A180 L181	V153-S177 PolarHBondContact O-N 3.3Å; E154-S177 VanDerWaalsContact O-CB 3.3Å; E154-S177 WeakPolarHBondContact O-CB 3.34Å; E154-S177 PolarHBondContact O-OG 2.87Å; S177-S179 PolarHBondContact O-N 3.25Å; S177-S179 PolarHBondContact OG-OG 2.76Å; S177-A180 PolarHBondContact O-N 2.71Å; S177-A180 VanDerWaalsContact O-N 3.1Å; S177-A180 WeakPolarHBondContact OG-CB 3.5Å; S177-A180 PolarHBondContact OG-N 3.48Å; S177-L181 PolarHBondContact O-N 3.17Å
178	P	92.3	Very high	94.4	Very high	89 Å²	89	31 Å²	31	58%	0.578	19%	0.186	S	C	*	.	H	α-helix	trans	-57.2	-35.4	-179.2	-27.8	35.4	0	0	0	113.6	R182	P178-R182 VanDerWaalsContact O-CB 3.28Å; P178-R182 WeakPolarHBondContact O-CB 3.25Å; P178-R182 PolarHBondContact O-N 3.28Å
179	S	92.2	Very high	94.3	Very high	87 Å²	87	32.5 Å²	32.5	61%	0.608	20%	0.197	S	C	*	.	H	α-helix	trans	-67.2	-43.3	176.4	53.1	0	0	0	0	112.1	S177 S183	S177-S179 PolarHBondContact O-N 3.25Å; S177-S179 PolarHBondContact OG-OG 2.76Å; S179-S183 WeakPolarHBondContact O-CB 3.48Å; S179-S183 PolarHBondContact O-N 3.04Å
180	A	93.3	Very high	94.3	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-65.8	-42.7	175.4	0	0	0	0	0	111.9	V153 L156 V176 S177 R182 S183 V184	V153-A180 HydrophobicContact CG1-CB 3.98Å; L156-A180 HydrophobicContact CB-CB 3.63Å; V176-A180 HydrophobicContact CG1-CB 3.93Å; S177-A180 PolarHBondContact O-N 2.71Å; S177-A180 VanDerWaalsContact O-N 3.1Å; S177-A180 WeakPolarHBondContact OG-CB 3.5Å; S177-A180 PolarHBondContact OG-N 3.48Å; A180-R182 PolarHBondContact O-N 2.72Å; A180-S183 PolarHBondContact O-N 3.31Å; A180-S183 PolarHBondContact O-OG 3.15Å; A180-V184 PolarHBondContact O-N 2.77Å
181	L	95	Very high	94.3	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-61.4	-46.6	177.3	-178.6	61.6	0	0	0	111	L171 V176 S177 S183 V184 V185 L196 L199 L201 V205	L171-L181 HydrophobicContact CD1-CD1 4.12Å; V176-L181 HydrophobicContact CG1-CB 3.91Å; S177-L181 PolarHBondContact O-N 3.17Å; L181-S183 VanDerWaalsContact C-N 3.32Å; L181-S183 PolarHBondContact O-N 3.09Å; L181-V184 PolarHBondContact O-N 3.33Å; L181-V185 HydrophobicContact CD1-CG2 3.75Å; L181-V185 HydrophobicContact CG-CG2 4.24Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 2.99Å; L181-L196 HydrophobicContact CD1-CD2 3.87Å; L181-L199 HydrophobicContact CD1-CD1 4.41Å; L181-L201 HydrophobicContact CD2-CD2 3.61Å; L181-V205 HydrophobicContact CD2-CG1 4.41Å; L181-V205 HydrophobicContact CD2-CG2 4.32Å; L181-V205 HydrophobicContact CG-CG2 4.45Å
182	R	93.4	Very high	94.4	Very high	135 Å²	135	43.5 Å²	43.5	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-60.5	-41.7	176.2	-171.2	-178.2	176.8	-136.8	3.1	111.6	P178 A180 V184 C186 D204	P178-R182 VanDerWaalsContact O-CB 3.28Å; P178-R182 WeakPolarHBondContact O-CB 3.25Å; P178-R182 PolarHBondContact O-N 3.28Å; A180-R182 PolarHBondContact O-N 2.72Å; R182-V184 PolarHBondContact O-N 3.41Å; R182-C186 VanDerWaalsContact CG-SG 3.53Å; R182-C186 VanDerWaalsContact O-CB 3.24Å; R182-C186 WeakPolarHBondContact O-CB 3.46Å; R182-C186 PolarHBondContact O-N 2.87Å; R182-C186 PolarHBondContact O-SG 3.37Å; R182-D204 IonicContact NE-OD2 3.12Å
183	S	92.4	Very high	94.6	Very high	31 Å²	31	43.4 Å²	43.4	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-30.9	-179.3	82.7	0	0	0	0	112.4	L156 S179 A180 L181 R187	L156-S183 PolarHBondContact O-OG 3.32Å; S179-S183 WeakPolarHBondContact O-CB 3.48Å; S179-S183 PolarHBondContact O-N 3.04Å; A180-S183 PolarHBondContact O-N 3.31Å; A180-S183 PolarHBondContact O-OG 3.15Å; L181-S183 VanDerWaalsContact C-N 3.32Å; L181-S183 PolarHBondContact O-N 3.09Å; S183-R187 WeakPolarHBondContact O-CD 3.39Å; S183-R187 WeakPolarHBondContact O-CG 3.29Å
184	V	94.4	Very high	95	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.03	21%	0.214	C	C	.	.	H	α-helix	trans	-81.3	-58.5	173.5	-177.7	0	0	0	0	111.3	L139 L156 L164 L166 L169 A180 L181 R182 C186 R187 C188	L139-V184 HydrophobicContact CD1-CG2 3.85Å; L156-V184 HydrophobicContact CD2-CG2 3.31Å; L164-V184 HydrophobicContact CD1-CG1 3.98Å; L166-V184 HydrophobicContact CD1-CG1 3.96Å; L169-V184 HydrophobicContact CD2-CG1 4.06Å; A180-V184 PolarHBondContact O-N 2.77Å; L181-V184 PolarHBondContact O-N 3.33Å; R182-V184 PolarHBondContact O-N 3.41Å; V184-C186 PolarHBondContact O-N 3.25Å; V184-R187 PolarHBondContact O-N 3.27Å; V184-R187 VanDerWaalsContact O-N 3.13Å; V184-C188 PolarHBondContact O-SG 2.83Å
185	V	95.3	Very high	95.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-41.5	-167.8	175.8	0	0	0	0	111.7	L181 R187 C188 V205 C208 L209	L181-V185 HydrophobicContact CD1-CG2 3.75Å; L181-V185 HydrophobicContact CG-CG2 4.24Å; L181-V185 WeakPolarHBondContact O-CG2 3.49Å; L181-V185 PolarHBondContact O-N 2.99Å; V185-R187 PolarHBondContact O-N 3.38Å; V185-R187 VanDerWaalsContact O-N 3.13Å; V185-C188 WeakPolarHBondContact O-CB 3.28Å; V185-C188 PolarHBondContact O-N 2.67Å; V185-V205 HydrophobicContact CG1-CG1 4.24Å; V185-C208 HydrophobicContact CG1-CB 4.05Å; V185-L209 HydrophobicContact CG1-CD2 3.49Å; V185-L209 VanDerWaalsContact CG1-CD2 3.49Å; V185-L209 HydrophobicContact CG1-CG 3.97Å
186	C	93.6	Very high	95.4	Very high	40 Å²	40	36.7 Å²	36.7	27%	0.27	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.4	-179.3	-63	0	0	0	0	114.5	R182 V184 C208	R182-C186 VanDerWaalsContact CG-SG 3.53Å; R182-C186 VanDerWaalsContact O-CB 3.24Å; R182-C186 WeakPolarHBondContact O-CB 3.46Å; R182-C186 PolarHBondContact O-N 2.87Å; R182-C186 PolarHBondContact O-SG 3.37Å; V184-C186 PolarHBondContact O-N 3.25Å; C186-C208 VanDerWaalsContact CA-SG 3.51Å; C186-C208 HydrophobicContact CB-CB 3.92Å; C186-C208 WeakPolarHBondContact CB-SG 3.33Å; C186-C208 WeakPolarHBondContact SG-CB 3.38Å; C186-C208 CovalentContact SG-SG 2.04Å; C186-C208 PolarHBondContact SG-SG 3.08Å
187	R	94.9	Very high	95.6	Very high	52 Å²	52	38 Å²	38	20%	0.196	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	0	172.7	-64.6	174.1	63.5	157.9	-8.2	112.7	L158 E160 G162 L164 S183 V184 V185	L158-R187 PolarHBondContact O-NH1 2.98Å; L158-R187 VanDerWaalsContact O-NH1 3.16Å; E160-R187 PolarHBondContact O-NH1 3.41Å; E160-R187 PolarHBondContact O-NH2 2.89Å; G162-R187 PolarHBondContact O-NE 3.17Å; G162-R187 PolarHBondContact O-NH2 3.15Å; L164-R187 HydrophobicContact CB-CB 4.47Å; L164-R187 HydrophobicContact CD1-CB 4Å; L164-R187 HydrophobicContact CG-CB 3.85Å; L164-R187 PolarHBondContact N-O 3.2Å; S183-R187 WeakPolarHBondContact O-CD 3.39Å; S183-R187 WeakPolarHBondContact O-CG 3.29Å; V184-R187 PolarHBondContact O-N 3.27Å; V184-R187 VanDerWaalsContact O-N 3.13Å; V185-R187 PolarHBondContact O-N 3.38Å; V185-R187 VanDerWaalsContact O-N 3.13Å
188	C	96.3	Very high	95.7	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-102.7	126.3	-179	-59.3	0	0	0	0	110.6	V184 V185 L191 N212	V184-C188 PolarHBondContact O-SG 2.83Å; V185-C188 WeakPolarHBondContact O-CB 3.28Å; V185-C188 PolarHBondContact O-N 2.67Å; C188-L191 HydrophobicContact CB-CD1 3.67Å; C188-L191 HydrophobicContact CB-CD2 4.21Å; C188-L191 HydrophobicContact CB-CG 3.72Å; C188-N212 PolarHBondContact O-ND2 3.42Å; C188-N212 VanDerWaalsContact O-ND2 3.09Å; C188-N212 PolarHBondContact O-OD1 3.2Å
189	S	95.8	Very high	95.9	Very high	33 Å²	33	35.4 Å²	35.4	23%	0.231	18%	0.178	C	C	.	.	S	Bend	trans	-132.1	14.1	177.5	46.7	0	0	0	0	112.6	R163 N212	R163-S189 PolarHBondContact NH1-OG 2.76Å; S189-N212 WeakPolarHBondContact CA-OD1 3.37Å; S189-N212 PolarHBondContact N-OD1 3.05Å
190	R	97	Very high	96	Very high	136 Å²	136	34.5 Å²	34.5	51%	0.513	17%	0.17	S	C	.	.			trans	-133	13.1	-175.7	-55.7	-176.7	75.7	-176.2	4.5	112.5	L166 R192 N212	L166-R190 CarbonylContact O-C 3.58Å; R190-R192 PolarHBondContact O-N 3.05Å; R190-N212 PolarHBondContact N-OD1 2.81Å
191	L	98.3	Very high	96.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.			trans	-64.1	132.5	-179.5	-65.9	170.5	0	0	0	109.8	L166 L169 C188 L194 L209 N212 L215	L166-L191 HydrophobicContact CB-CD2 3.99Å; L169-L191 HydrophobicContact CB-CD2 4.27Å; C188-L191 HydrophobicContact CB-CD1 3.67Å; C188-L191 HydrophobicContact CB-CD2 4.21Å; C188-L191 HydrophobicContact CB-CG 3.72Å; L191-L194 HydrophobicContact CD1-CD2 4.26Å; L191-L209 HydrophobicContact CD1-CD2 4.36Å; L191-N212 HydrophobicContact CB-CB 4.16Å; L191-N212 WeakPolarHBondContact CB-OD1 3.29Å; L191-N212 PolarHBondContact N-OD1 3.21Å; L191-L215 HydrophobicContact CB-CD1 3.92Å; L191-L215 WeakPolarHBondContact O-CA 3.39Å; L191-L215 PolarHBondContact O-N 3.34Å
192	R	98.3	Very high	96.3	Very high	103 Å²	103	36.9 Å²	36.9	39%	0.389	19%	0.185	S	C	.	.	S	Bend	trans	-115.8	-32.8	173.9	-68.1	-177.5	63.9	-174.7	0.1	111.3	V167 R190 L216 Q217	V167-R192 HydrophobicContact CG1-CB 3.91Å; V167-R192 HydrophobicContact CG1-CG 3.86Å; V167-R192 PolarHBondContact O-N 2.88Å; R190-R192 PolarHBondContact O-N 3.05Å; R192-L216 WeakPolarHBondContact O-CA 3.34Å; R192-L216 WeakPolarHBondContact O-CB 3.29Å; R192-L216 PolarHBondContact O-N 3.44Å; R192-Q217 PolarHBondContact O-N 3.31Å
193	R	98.6	Very high	96.5	Very high	18 Å²	18	33.4 Å²	33.4	7%	0.068	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	123.6	178.9	-63.4	176	-76.9	177.3	0.1	109.9	V167 D168 L169 Q217 W395 R397	V167-R193 PolarHBondContact O-N 3.31Å; V167-R193 VanDerWaalsContact O-N 3.17Å; D168-R193 CarbonylContact C-O 3.53Å; D168-R193 WeakPolarHBondContact CA-O 3.41Å; D168-R193 IonicContact OD1-CZ 2.98Å; D168-R193 IonicContact OD1-NE 2.83Å; D168-R193 PolarHBondContact OD1-NE 3.09Å; D168-R193 IonicContact OD1-NH2 3.18Å; D168-R193 PolarHBondContact OD1-NH2 2.94Å; D168-R193 IonicContact OD2-CZ 3.75Å; D168-R193 IonicContact OD2-NE 2.67Å; D168-R193 IonicContact OD2-NH2 3.62Å; D168-R193 PolarHBondContact OD2-NH2 3.07Å; L169-R193 PolarHBondContact N-O 2.81Å; R193-Q217 VanDerWaalsContact CA-O 3.32Å; R193-Q217 WeakPolarHBondContact CA-O 3.2Å; R193-Q217 HydrophobicContact CB-CB 4.41Å; R193-Q217 HydrophobicContact CG-CB 3.94Å; R193-Q217 HydrophobicContact CG-CG 4.02Å; R193-W395 HydrophobicContact CB-CD2 3.7Å; R193-W395 HydrophobicContact CB-CE3 3.41Å; R193-W395 VanDerWaalsContact CB-CE3 3.41Å; R193-W395 HydrophobicContact CB-CG 4.49Å; R193-W395 HydrophobicContact CB-CH2 3.65Å; R193-W395 HydrophobicContact CB-CZ2 3.91Å; R193-W395 HydrophobicContact CB-CZ3 3.31Å; R193-W395 HydrophobicContact CG-CD2 4.29Å; R193-W395 HydrophobicContact CG-CE3 4.28Å; R193-W395 PolarHBondContact NH1-O 3.03Å; R193-W395 VanDerWaalsContact NH1-O 3.15Å; R193-W395 VanDerWaalsContact O-CH2 3.29Å; R193-W395 WeakPolarHBondContact O-CH2 3.3Å; R193-W395 WeakPolarHBondContact O-CZ3 3.49Å; R193-R397 VanDerWaalsContact NH2-CZ 3.27Å; R193-R397 VanDerWaalsContact NH2-NH1 3.17Å
194	L	98.6	Very high	96.7	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	135.5	-174.6	177.8	66.6	0	0	0	110.5	L169 L191 L196 L209 L215 Q217 L218 N219	L169-L194 HydrophobicContact CB-CD1 3.83Å; L169-L194 HydrophobicContact CD2-CD1 3.85Å; L169-L194 HydrophobicContact CG-CD1 3.96Å; L169-L194 WeakPolarHBondContact O-CA 3.38Å; L191-L194 HydrophobicContact CD1-CD2 4.26Å; L194-L196 HydrophobicContact CD1-CD2 3.87Å; L194-L196 HydrophobicContact CD1-CG 4.01Å; L194-L196 HydrophobicContact CD2-CD1 3.95Å; L194-L196 HydrophobicContact CD2-CG 4Å; L194-L196 HydrophobicContact CG-CD1 4.46Å; L194-L196 HydrophobicContact CG-CD2 4.38Å; L194-L196 HydrophobicContact CG-CG 3.95Å; L194-L209 HydrophobicContact CD2-CD1 4.23Å; L194-L209 HydrophobicContact CD2-CD2 3.22Å; L194-L209 HydrophobicContact CD2-CG 4.37Å; L194-L215 HydrophobicContact CB-CD1 4.23Å; L194-Q217 PolarHBondContact N-O 2.92Å; L194-L218 HydrophobicContact CB-CD1 4.04Å; L194-L218 HydrophobicContact CD2-CD1 3.89Å; L194-L218 HydrophobicContact CG-CD1 4.13Å; L194-L218 WeakPolarHBondContact O-CA 3.18Å; L194-N219 PolarHBondContact O-N 3.18Å
195	S	98.5	Very high	96.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	118.4	168.9	-172.6	0	0	0	0	110.4	L169 L171 N219 P382	L169-S195 PolarHBondContact O-N 2.95Å; L171-S195 PolarHBondContact N-O 2.99Å; S195-N219 PolarHBondContact OG-ND2 2.57Å; S195-N219 VanDerWaalsContact OG-ND2 3.14Å; S195-P382 WeakPolarHBondContact OG-CG 3.26Å
196	L	98	Very high	97	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.			trans	-117.6	19.3	175.2	-61.3	-177.3	0	0	0	111.1	L171 L181 L194 A198 L199 L201 V205 L209 N219 L220 C223	L171-L196 HydrophobicContact CB-CD2 4.25Å; L171-L196 HydrophobicContact CD1-CD2 4.12Å; L181-L196 HydrophobicContact CD1-CD2 3.87Å; L194-L196 HydrophobicContact CD1-CD2 3.87Å; L194-L196 HydrophobicContact CD1-CG 4.01Å; L194-L196 HydrophobicContact CD2-CD1 3.95Å; L194-L196 HydrophobicContact CD2-CG 4Å; L194-L196 HydrophobicContact CG-CD1 4.46Å; L194-L196 HydrophobicContact CG-CD2 4.38Å; L194-L196 HydrophobicContact CG-CG 3.95Å; L196-A198 PolarHBondContact O-N 3.02Å; L196-L199 HydrophobicContact CB-CD1 4.03Å; L196-L199 HydrophobicContact CD2-CD1 3.92Å; L196-L199 VanDerWaalsContact O-CB 3.24Å; L196-L199 WeakPolarHBondContact O-CB 3.47Å; L196-L199 WeakPolarHBondContact O-CG 3.14Å; L196-L199 PolarHBondContact O-N 3.14Å; L196-L201 HydrophobicContact CB-CD2 4.29Å; L196-L201 HydrophobicContact CD1-CD2 3.93Å; L196-V205 HydrophobicContact CD1-CG1 4.48Å; L196-L209 HydrophobicContact CD1-CD1 4.42Å; L196-N219 PolarHBondContact N-O 3.28Å; L196-L220 HydrophobicContact CB-CD2 4.17Å; L196-L220 HydrophobicContact CD1-CD2 4.37Å; L196-C223 PolarHBondContact O-SG 2.79Å
197	E	97.7	Very high	97.2	Very high	38 Å²	38	36.7 Å²	36.7	18%	0.178	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.6	132.4	-175.5	-177	177.3	-173.4	0	0	112.6	G173 L199 N219 G221 R381	G173-E197 PolarHBondContact N-O 3.35Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 3.18Å; E197-N219 PolarHBondContact N-O 3.34Å; E197-N219 PolarHBondContact OE2-ND2 2.95Å; E197-G221 CarbonylContact C-O 3.56Å; E197-G221 VanDerWaalsContact CA-O 3.27Å; E197-G221 WeakPolarHBondContact CA-O 3.43Å; E197-G221 VanDerWaalsContact CG-O 3.32Å; E197-G221 WeakPolarHBondContact CG-O 3.18Å; E197-R381 IonicContact OE1-CZ 2.81Å; E197-R381 VanDerWaalsContact OE1-CZ 3.28Å; E197-R381 IonicContact OE1-NH1 3.82Å; E197-R381 PolarHBondContact OE1-NH1 2.77Å; E197-R381 IonicContact OE1-NH2 3.75Å; E197-R381 PolarHBondContact OE1-NH2 3.11Å; E197-R381 IonicContact OE2-CZ 3.35Å; E197-R381 IonicContact OE2-NH1 3.13Å; E197-R381 PolarHBondContact OE2-NH1 2.82Å
198	A	96.3	Very high	97.3	Very high	59 Å²	59	34.9 Å²	34.9	49%	0.488	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	21.6	-178.7	0	0	0	0	0	115.7	L196 G221	L196-A198 PolarHBondContact O-N 3.02Å; A198-G221 PolarHBondContact N-O 2.98Å
199	L	95.9	Very high	97.3	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.189	C	C	.	.			trans	-95.5	142.9	173	-65.9	175.1	0	0	0	112.5	L171 S174 V176 L181 L196 E197 L201 C223	L171-L199 HydrophobicContact CB-CD1 4.09Å; S174-L199 WeakPolarHBondContact O-CD2 3.28Å; V176-L199 HydrophobicContact CB-CD2 4.26Å; V176-L199 HydrophobicContact CG2-CD2 4.15Å; L181-L199 HydrophobicContact CD1-CD1 4.41Å; L196-L199 HydrophobicContact CB-CD1 4.03Å; L196-L199 HydrophobicContact CD2-CD1 3.92Å; L196-L199 VanDerWaalsContact O-CB 3.24Å; L196-L199 WeakPolarHBondContact O-CB 3.47Å; L196-L199 WeakPolarHBondContact O-CG 3.14Å; L196-L199 PolarHBondContact O-N 3.14Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 3.18Å; L199-L201 HydrophobicContact CB-CD2 4.02Å; L199-L201 PolarHBondContact O-N 3.11Å; L199-C223 WeakPolarHBondContact O-CA 3.49Å
200	P	95.1	Very high	97.4	Very high	68 Å²	68	34 Å²	34	44%	0.442	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-70.6	126.2	164.1	30.4	-32.1	0	0	0	109.1
201	L	96.6	Very high	97.4	Very high	14 Å²	14	33 Å²	33	7%	0.073	19%	0.185	C	C	.	.			trans	-111.6	-172.2	179.9	-48.6	-178.2	0	0	0	110.3	L181 L196 L199 V205 L206 L220 C223 S224 G225 F226	L181-L201 HydrophobicContact CD2-CD2 3.61Å; L196-L201 HydrophobicContact CB-CD2 4.29Å; L196-L201 HydrophobicContact CD1-CD2 3.93Å; L199-L201 HydrophobicContact CB-CD2 4.02Å; L199-L201 PolarHBondContact O-N 3.11Å; L201-V205 HydrophobicContact CD2-CG1 4.41Å; L201-L206 HydrophobicContact CB-CD1 4.22Å; L201-L206 HydrophobicContact CD1-CD1 4.04Å; L201-L220 HydrophobicContact CD1-CD2 3.95Å; L201-C223 HydrophobicContact CD1-CB 3.71Å; L201-C223 HydrophobicContact CG-CB 4.01Å; L201-S224 PolarHBondContact N-O 2.78Å; L201-G225 CarbonylContact O-C 3.43Å; L201-F226 HydrophobicContact CB-CD1 3.99Å; L201-F226 HydrophobicContact CD1-CD1 4.08Å; L201-F226 HydrophobicContact CD1-CE1 3.94Å; L201-F226 HydrophobicContact CG-CD1 4.46Å
202	S	96.6	Very high	97.4	Very high	39 Å²	39	33 Å²	33	27%	0.273	19%	0.185	S	C	.	.			trans	-152	166.1	173.5	66.2	0	0	0	0	110.8	D204 V205 L206 G225	S202-D204 PolarHBondContact O-N 3.41Å; S202-V205 WeakPolarHBondContact O-CB 3.31Å; S202-V205 PolarHBondContact O-N 2.95Å; S202-V205 PolarHBondContact OG-N 3.01Å; S202-L206 WeakPolarHBondContact O-CD1 3.49Å; S202-L206 PolarHBondContact O-N 3.42Å; S202-L206 VanDerWaalsContact O-N 3.08Å; S202-G225 WeakPolarHBondContact CA-O 3.41Å
203	D	97.8	Very high	97.3	Very high	62 Å²	62	31.4 Å²	31.4	33%	0.332	19%	0.188	S	C	.	.	H	α-helix	trans	-57.4	-35.3	174.5	-74	12.3	0	0	0	112.2	L206 S207 F226 S227 A230	D203-L206 PolarHBondContact O-N 2.69Å; D203-S207 WeakPolarHBondContact O-CB 3.37Å; D203-S207 PolarHBondContact O-N 2.7Å; D203-S207 PolarHBondContact O-OG 3.37Å; D203-F226 WeakPolarHBondContact OD1-CA 3.09Å; D203-S227 VanDerWaalsContact CG-OG 3.31Å; D203-S227 PolarHBondContact OD1-N 3.17Å; D203-S227 PolarHBondContact OD1-OG 3.05Å; D203-S227 VanDerWaalsContact OD2-CB 3.32Å; D203-S227 WeakPolarHBondContact OD2-CB 3.33Å; D203-S227 PolarHBondContact OD2-OG 3.46Å; D203-A230 HydrophobicContact CB-CB 3.83Å; D203-A230 VanDerWaalsContact CG-CB 3.46Å; D203-A230 WeakPolarHBondContact OD1-CB 3.11Å
204	D	96.8	Very high	97.3	Very high	85 Å²	85	34 Å²	34	46%	0.455	20%	0.204	S	C	.	.	H	α-helix	trans	-60.9	-45	173.8	-76.5	-2.2	0	0	0	111.6	R182 S202 S207 C208	R182-D204 IonicContact NE-OD2 3.12Å; S202-D204 PolarHBondContact O-N 3.41Å; D204-S207 PolarHBondContact O-N 3.27Å; D204-C208 PolarHBondContact O-N 3.26Å; D204-C208 PolarHBondContact O-SG 2.92Å
205	V	97.6	Very high	97.3	Very high	2 Å²	2	34 Å²	34	1%	0.012	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-45.3	178.5	173.5	0	0	0	0	109.9	L181 V185 L196 L201 S202 S207 C208 L209	L181-V205 HydrophobicContact CD2-CG1 4.41Å; L181-V205 HydrophobicContact CD2-CG2 4.32Å; L181-V205 HydrophobicContact CG-CG2 4.45Å; V185-V205 HydrophobicContact CG1-CG1 4.24Å; L196-V205 HydrophobicContact CD1-CG1 4.48Å; L201-V205 HydrophobicContact CD2-CG1 4.41Å; S202-V205 WeakPolarHBondContact O-CB 3.31Å; S202-V205 PolarHBondContact O-N 2.95Å; S202-V205 PolarHBondContact OG-N 3.01Å; V205-S207 VanDerWaalsContact C-N 3.33Å; V205-S207 PolarHBondContact O-N 2.89Å; V205-C208 WeakPolarHBondContact O-CB 3.36Å; V205-C208 PolarHBondContact O-N 3.13Å; V205-C208 VanDerWaalsContact O-N 3.17Å; V205-L209 WeakPolarHBondContact O-CG 3.45Å; V205-L209 PolarHBondContact O-N 3.32Å
206	L	98.1	Very high	97.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.7	-38.5	177.1	-91.4	72.3	0	0	0	112.6	L201 S202 D203 C208 L209 A210 F226 A230 L231 M234	L201-L206 HydrophobicContact CB-CD1 4.22Å; L201-L206 HydrophobicContact CD1-CD1 4.04Å; S202-L206 WeakPolarHBondContact O-CD1 3.49Å; S202-L206 PolarHBondContact O-N 3.42Å; S202-L206 VanDerWaalsContact O-N 3.08Å; D203-L206 PolarHBondContact O-N 2.69Å; L206-C208 VanDerWaalsContact C-N 3.28Å; L206-C208 PolarHBondContact O-N 3.11Å; L206-L209 WeakPolarHBondContact O-CB 3.47Å; L206-L209 PolarHBondContact O-N 3.36Å; L206-L209 VanDerWaalsContact O-N 3.15Å; L206-A210 PolarHBondContact O-N 3.39Å; L206-F226 HydrophobicContact CD1-CB 3.71Å; L206-F226 HydrophobicContact CD1-CD1 3.92Å; L206-F226 HydrophobicContact CD1-CD2 4.14Å; L206-F226 HydrophobicContact CD1-CG 3.66Å; L206-F226 HydrophobicContact CD2-CB 3.93Å; L206-F226 HydrophobicContact CD2-CD2 3.3Å; L206-F226 HydrophobicContact CD2-CE2 3.84Å; L206-F226 HydrophobicContact CD2-CG 3.69Å; L206-F226 HydrophobicContact CG-CB 4.4Å; L206-F226 HydrophobicContact CG-CD2 4.36Å; L206-F226 HydrophobicContact CG-CG 4.34Å; L206-A230 HydrophobicContact CB-CB 4.12Å; L206-A230 HydrophobicContact CD2-CB 4.07Å; L206-L231 HydrophobicContact CD2-CB 4.19Å; L206-M234 HydrophobicContact CB-CB 4.49Å
207	S	97.8	Very high	97.3	Very high	58 Å²	58	36.1 Å²	36.1	41%	0.406	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-35.7	174.6	-59.9	0	0	0	0	111.7	D203 D204 V205 A210	D203-S207 WeakPolarHBondContact O-CB 3.37Å; D203-S207 PolarHBondContact O-N 2.7Å; D203-S207 PolarHBondContact O-OG 3.37Å; D204-S207 PolarHBondContact O-N 3.27Å; V205-S207 VanDerWaalsContact C-N 3.33Å; V205-S207 PolarHBondContact O-N 2.89Å; S207-A210 WeakPolarHBondContact O-CB 3.08Å; S207-A210 PolarHBondContact O-N 3.26Å
208	C	97.3	Very high	97.4	Very high	14 Å²	14	34.3 Å²	34.3	10%	0.095	21%	0.205	C	C	.	.	H	α-helix	trans	-69.4	-38.8	171.4	-68.7	0	0	0	0	112.2	V185 C186 D204 V205 L206 A210 Q211 N212	V185-C208 HydrophobicContact CG1-CB 4.05Å; C186-C208 VanDerWaalsContact CA-SG 3.51Å; C186-C208 HydrophobicContact CB-CB 3.92Å; C186-C208 WeakPolarHBondContact CB-SG 3.33Å; C186-C208 WeakPolarHBondContact SG-CB 3.38Å; C186-C208 CovalentContact SG-SG 2.04Å; C186-C208 PolarHBondContact SG-SG 3.08Å; D204-C208 PolarHBondContact O-N 3.26Å; D204-C208 PolarHBondContact O-SG 2.92Å; V205-C208 WeakPolarHBondContact O-CB 3.36Å; V205-C208 PolarHBondContact O-N 3.13Å; V205-C208 VanDerWaalsContact O-N 3.17Å; L206-C208 VanDerWaalsContact C-N 3.28Å; L206-C208 PolarHBondContact O-N 3.11Å; C208-A210 VanDerWaalsContact C-N 3.29Å; C208-A210 PolarHBondContact O-N 2.89Å; C208-Q211 WeakPolarHBondContact O-CB 3.4Å; C208-Q211 PolarHBondContact O-N 2.99Å; C208-Q211 VanDerWaalsContact O-N 3.13Å; C208-N212 PolarHBondContact O-ND2 2.95Å
209	L	97.9	Very high	97.5	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-62.2	-36.5	173.9	-67.5	179.4	0	0	0	112.2	V185 L191 L194 L196 V205 L206 Q211 N212 M234	V185-L209 HydrophobicContact CG1-CD2 3.49Å; V185-L209 VanDerWaalsContact CG1-CD2 3.49Å; V185-L209 HydrophobicContact CG1-CG 3.97Å; L191-L209 HydrophobicContact CD1-CD2 4.36Å; L194-L209 HydrophobicContact CD2-CD1 4.23Å; L194-L209 HydrophobicContact CD2-CD2 3.22Å; L194-L209 HydrophobicContact CD2-CG 4.37Å; L196-L209 HydrophobicContact CD1-CD1 4.42Å; V205-L209 WeakPolarHBondContact O-CG 3.45Å; V205-L209 PolarHBondContact O-N 3.32Å; L206-L209 WeakPolarHBondContact O-CB 3.47Å; L206-L209 PolarHBondContact O-N 3.36Å; L206-L209 VanDerWaalsContact O-N 3.15Å; L209-Q211 PolarHBondContact O-N 3.05Å; L209-N212 WeakPolarHBondContact O-CB 3.29Å; L209-N212 PolarHBondContact O-N 3.09Å; L209-N212 PolarHBondContact O-ND2 2.88Å; L209-M234 HydrophobicContact CB-CG 3.96Å
210	A	97.7	Very high	97.6	Very high	16 Å²	16	31.4 Å²	31.4	13%	0.132	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.8	175.4	0	0	0	0	0	113.2	L206 S207 C208 N212 M234 S237	L206-A210 PolarHBondContact O-N 3.39Å; S207-A210 WeakPolarHBondContact O-CB 3.08Å; S207-A210 PolarHBondContact O-N 3.26Å; C208-A210 VanDerWaalsContact C-N 3.29Å; C208-A210 PolarHBondContact O-N 2.89Å; A210-N212 PolarHBondContact O-N 3.2Å; A210-M234 HydrophobicContact CB-CB 4.41Å; A210-S237 VanDerWaalsContact O-CB 3.24Å; A210-S237 WeakPolarHBondContact O-CB 3.47Å
211	Q	96.9	Very high	97.8	Very high	113 Å²	113	28.3 Å²	28.3	53%	0.528	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	5.4	175.1	-53.8	-177.6	14.5	0	0	113.8	C208 L209 P213	C208-Q211 WeakPolarHBondContact O-CB 3.4Å; C208-Q211 PolarHBondContact O-N 2.99Å; C208-Q211 VanDerWaalsContact O-N 3.13Å; L209-Q211 PolarHBondContact O-N 3.05Å; Q211-P213 VanDerWaalsContact C-CD 3.42Å; Q211-P213 VanDerWaalsContact O-CD 3.25Å; Q211-P213 WeakPolarHBondContact O-CD 3.28Å
212	N	97.9	Very high	97.8	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.011	18%	0.175	C	C	.	.			trans	-116.2	71.7	179.8	-62.4	-92.5	0	0	0	110.4	C188 S189 R190 L191 C208 L209 A210 D214 L215	C188-N212 PolarHBondContact O-ND2 3.42Å; C188-N212 VanDerWaalsContact O-ND2 3.09Å; C188-N212 PolarHBondContact O-OD1 3.2Å; S189-N212 WeakPolarHBondContact CA-OD1 3.37Å; S189-N212 PolarHBondContact N-OD1 3.05Å; R190-N212 PolarHBondContact N-OD1 2.81Å; L191-N212 HydrophobicContact CB-CB 4.16Å; L191-N212 WeakPolarHBondContact CB-OD1 3.29Å; L191-N212 PolarHBondContact N-OD1 3.21Å; C208-N212 PolarHBondContact O-ND2 2.95Å; L209-N212 WeakPolarHBondContact O-CB 3.29Å; L209-N212 PolarHBondContact O-N 3.09Å; L209-N212 PolarHBondContact O-ND2 2.88Å; A210-N212 PolarHBondContact O-N 3.2Å; N212-D214 PolarHBondContact O-N 3.13Å; N212-D214 VanDerWaalsContact O-N 3.15Å; N212-L215 VanDerWaalsContact O-CB 3.28Å; N212-L215 WeakPolarHBondContact O-CB 3.36Å; N212-L215 PolarHBondContact O-N 3.31Å; N212-L215 VanDerWaalsContact O-N 3.1Å
213	P	96.9	Very high	97.9	Very high	68 Å²	68	27.4 Å²	27.4	44%	0.442	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-19.9	-175.6	27.5	-36.4	0	0	0	113.8	Q211 L215	Q211-P213 VanDerWaalsContact C-CD 3.42Å; Q211-P213 VanDerWaalsContact O-CD 3.25Å; Q211-P213 WeakPolarHBondContact O-CD 3.28Å; P213-L215 VanDerWaalsContact C-N 3.28Å; P213-L215 PolarHBondContact O-N 2.98Å
214	D	97.6	Very high	97.7	Very high	74 Å²	74	27 Å²	27	40%	0.396	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	10.4	176.5	-74	-49.4	0	0	0	114.1	N212 L216 R240	N212-D214 PolarHBondContact O-N 3.13Å; N212-D214 VanDerWaalsContact O-N 3.15Å; D214-L216 WeakPolarHBondContact O-CG 3.32Å; D214-L216 PolarHBondContact O-N 3.42Å; D214-R240 VanDerWaalsContact OD1-CD 3.24Å; D214-R240 WeakPolarHBondContact OD1-CD 3.49Å; D214-R240 IonicContact OD1-CZ 3.73Å; D214-R240 IonicContact OD1-NE 3.88Å; D214-R240 IonicContact OD1-NH1 2.8Å; D214-R240 PolarHBondContact OD1-NH1 2.98Å
215	L	98.5	Very high	97.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.171	C	C	.	.			trans	-63.1	123.7	177.5	-163.5	71.1	0	0	0	110.6	L191 L194 N212 P213 L218 R240 L241	L191-L215 HydrophobicContact CB-CD1 3.92Å; L191-L215 WeakPolarHBondContact O-CA 3.39Å; L191-L215 PolarHBondContact O-N 3.34Å; L194-L215 HydrophobicContact CB-CD1 4.23Å; N212-L215 VanDerWaalsContact O-CB 3.28Å; N212-L215 WeakPolarHBondContact O-CB 3.36Å; N212-L215 PolarHBondContact O-N 3.31Å; N212-L215 VanDerWaalsContact O-N 3.1Å; P213-L215 VanDerWaalsContact C-N 3.28Å; P213-L215 PolarHBondContact O-N 2.98Å; L215-L218 HydrophobicContact CD2-CB 3.91Å; L215-L218 HydrophobicContact CD2-CD1 4.15Å; L215-L218 HydrophobicContact CD2-CD2 3.85Å; L215-L218 HydrophobicContact CD2-CG 4.17Å; L215-R240 CarbonylContact O-C 3.54Å; L215-R240 VanDerWaalsContact O-C 3.3Å; L215-L241 HydrophobicContact CD2-CD1 4.38Å; L215-L241 HydrophobicContact CG-CD1 4.3Å; L215-L241 VanDerWaalsContact O-CA 3.28Å; L215-L241 WeakPolarHBondContact O-CA 3.38Å; L215-L241 PolarHBondContact O-N 3.06Å
216	L	98.5	Very high	97.7	Very high	15 Å²	15	26.4 Å²	26.4	8%	0.079	17%	0.174	C	C	.	.			trans	-106.9	-38.7	-176.8	-58.5	-177.5	0	0	0	112.3	R192 D214 R240 E242 Q243	R192-L216 WeakPolarHBondContact O-CA 3.34Å; R192-L216 WeakPolarHBondContact O-CB 3.29Å; R192-L216 PolarHBondContact O-N 3.44Å; D214-L216 WeakPolarHBondContact O-CG 3.32Å; D214-L216 PolarHBondContact O-N 3.42Å; L216-R240 HydrophobicContact CD2-CB 3.88Å; L216-R240 VanDerWaalsContact CD2-O 3.25Å; L216-R240 WeakPolarHBondContact CD2-O 3.18Å; L216-E242 PolarHBondContact O-N 2.71Å; L216-Q243 PolarHBondContact O-N 3.12Å
217	Q	98.6	Very high	97.7	Very high	29 Å²	29	28.2 Å²	28.2	14%	0.136	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.6	179.5	-49.5	-174.2	-6.2	0	0	110.6	R192 R193 L194 Q243 A380	R192-Q217 PolarHBondContact O-N 3.31Å; R193-Q217 VanDerWaalsContact CA-O 3.32Å; R193-Q217 WeakPolarHBondContact CA-O 3.2Å; R193-Q217 HydrophobicContact CB-CB 4.41Å; R193-Q217 HydrophobicContact CG-CB 3.94Å; R193-Q217 HydrophobicContact CG-CG 4.02Å; L194-Q217 PolarHBondContact N-O 2.92Å; Q217-Q243 WeakPolarHBondContact CA-O 3.39Å; Q217-Q243 HydrophobicContact CB-CB 4.17Å; Q217-Q243 HydrophobicContact CG-CB 3.94Å; Q217-Q243 HydrophobicContact CG-CG 3.94Å; Q217-A380 HydrophobicContact CB-CB 4.4Å
218	L	98.8	Very high	97.7	Very high	0 Å²	0	26 Å²	26	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	123.6	-178.4	-179.8	57.5	0	0	0	110	L194 L215 L220 M234 L241 Q243 L244 N245 A380	L194-L218 HydrophobicContact CB-CD1 4.04Å; L194-L218 HydrophobicContact CD2-CD1 3.89Å; L194-L218 HydrophobicContact CG-CD1 4.13Å; L194-L218 WeakPolarHBondContact O-CA 3.18Å; L215-L218 HydrophobicContact CD2-CB 3.91Å; L215-L218 HydrophobicContact CD2-CD1 4.15Å; L215-L218 HydrophobicContact CD2-CD2 3.85Å; L215-L218 HydrophobicContact CD2-CG 4.17Å; L218-L220 HydrophobicContact CD1-CD2 3.76Å; L218-L220 HydrophobicContact CD1-CG 3.97Å; L218-L220 HydrophobicContact CD2-CD1 3.94Å; L218-L220 HydrophobicContact CD2-CG 4.08Å; L218-L220 HydrophobicContact CG-CD1 4.28Å; L218-L220 HydrophobicContact CG-CD2 4.22Å; L218-L220 HydrophobicContact CG-CG 3.85Å; L218-M234 HydrophobicContact CD2-CE 3.76Å; L218-M234 HydrophobicContact CD2-SD 4.02Å; L218-L241 HydrophobicContact CB-CD1 3.84Å; L218-Q243 PolarHBondContact N-O 3.28Å; L218-L244 HydrophobicContact CB-CD1 4.06Å; L218-L244 HydrophobicContact CD2-CD1 4.12Å; L218-L244 HydrophobicContact CG-CD1 4.11Å; L218-L244 WeakPolarHBondContact O-CA 3.35Å; L218-N245 PolarHBondContact O-N 2.93Å; L218-A380 VanDerWaalsContact O-CB 3.28Å; L218-A380 WeakPolarHBondContact O-CB 3.45Å
219	N	98.8	Very high	97.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	108	172.8	-177.6	13.7	0	0	0	110	L194 S195 L196 E197 G221 N245 A380	L194-N219 PolarHBondContact O-N 3.18Å; S195-N219 PolarHBondContact OG-ND2 2.57Å; S195-N219 VanDerWaalsContact OG-ND2 3.14Å; L196-N219 PolarHBondContact N-O 3.28Å; E197-N219 PolarHBondContact N-O 3.34Å; E197-N219 PolarHBondContact OE2-ND2 2.95Å; N219-G221 PolarHBondContact OD1-N 3.39Å; N219-N245 CarbonylContact C-O 3.58Å; N219-N245 WeakPolarHBondContact CA-O 3.41Å; N219-N245 HydrophobicContact CB-CB 4.34Å; N219-N245 WeakPolarHBondContact OD1-CB 3.48Å; N219-N245 PolarHBondContact OD1-ND2 3.48Å; N219-N245 VanDerWaalsContact OD1-ND2 3.16Å; N219-A380 HydrophobicContact CB-CB 4.06Å
220	L	98.6	Very high	97.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	20%	0.195	C	C	.	.			trans	-113.7	19.4	173.5	-58.4	-176.8	0	0	0	111.4	L196 L201 L218 G222 C223 M234 N245 I246 C249	L196-L220 HydrophobicContact CB-CD2 4.17Å; L196-L220 HydrophobicContact CD1-CD2 4.37Å; L201-L220 HydrophobicContact CD1-CD2 3.95Å; L218-L220 HydrophobicContact CD1-CD2 3.76Å; L218-L220 HydrophobicContact CD1-CG 3.97Å; L218-L220 HydrophobicContact CD2-CD1 3.94Å; L218-L220 HydrophobicContact CD2-CG 4.08Å; L218-L220 HydrophobicContact CG-CD1 4.28Å; L218-L220 HydrophobicContact CG-CD2 4.22Å; L218-L220 HydrophobicContact CG-CG 3.85Å; L220-G222 PolarHBondContact O-N 3.01Å; L220-C223 VanDerWaalsContact C-SG 3.51Å; L220-C223 HydrophobicContact CB-CB 4.32Å; L220-C223 WeakPolarHBondContact O-CB 3.32Å; L220-C223 PolarHBondContact O-N 3.43Å; L220-C223 VanDerWaalsContact O-N 3.07Å; L220-C223 PolarHBondContact O-SG 3Å; L220-M234 HydrophobicContact CD1-CE 4.4Å; L220-N245 PolarHBondContact N-O 3.49Å; L220-I246 HydrophobicContact CB-CG1 4.26Å; L220-I246 HydrophobicContact CD1-CD1 4.27Å; L220-C249 PolarHBondContact O-SG 3.38Å
221	G	98.2	Very high	97.8	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.021	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	134.5	-179.8	0	0	0	0	0	111.8	E197 A198 N219 C223 N245 S247	E197-G221 CarbonylContact C-O 3.56Å; E197-G221 VanDerWaalsContact CA-O 3.27Å; E197-G221 WeakPolarHBondContact CA-O 3.43Å; E197-G221 VanDerWaalsContact CG-O 3.32Å; E197-G221 WeakPolarHBondContact CG-O 3.18Å; A198-G221 PolarHBondContact N-O 2.98Å; N219-G221 PolarHBondContact OD1-N 3.39Å; G221-C223 PolarHBondContact O-N 2.86Å; G221-C223 VanDerWaalsContact O-N 3.12Å; G221-N245 PolarHBondContact N-O 3.39Å; G221-S247 CarbonylContact C-O 3.6Å; G221-S247 VanDerWaalsContact CA-O 3.25Å; G221-S247 WeakPolarHBondContact CA-O 3.41Å
222	G	97.6	Very high	97.8	Very high	34 Å²	34	23 Å²	23	35%	0.351	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	9.3	179.9	0	0	0	0	0	115.4	L220 S247	L220-G222 PolarHBondContact O-N 3.01Å; G222-S247 PolarHBondContact N-O 2.95Å
223	C	97.6	Very high	97.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	19%	0.189	C	C	.	.			trans	-75.1	157.9	177.4	-65.8	0	0	0	0	111.6	L196 L199 L201 L220 G221 F226 C249	L196-C223 PolarHBondContact O-SG 2.79Å; L199-C223 WeakPolarHBondContact O-CA 3.49Å; L201-C223 HydrophobicContact CD1-CB 3.71Å; L201-C223 HydrophobicContact CG-CB 4.01Å; L220-C223 VanDerWaalsContact C-SG 3.51Å; L220-C223 HydrophobicContact CB-CB 4.32Å; L220-C223 WeakPolarHBondContact O-CB 3.32Å; L220-C223 PolarHBondContact O-N 3.43Å; L220-C223 VanDerWaalsContact O-N 3.07Å; L220-C223 PolarHBondContact O-SG 3Å; G221-C223 PolarHBondContact O-N 2.86Å; G221-C223 VanDerWaalsContact O-N 3.12Å; C223-F226 HydrophobicContact CB-CE1 4.03Å; C223-C249 WeakPolarHBondContact O-CA 3.41Å; C223-C249 WeakPolarHBondContact O-CB 3.42Å; C223-C249 PolarHBondContact O-SG 3.5Å; C223-C249 VanDerWaalsContact O-SG 3.34Å
224	S	95.1	Very high	97.9	Very high	54 Å²	54	23.3 Å²	23.3	38%	0.378	17%	0.168	S	C	.	.	B	Isolated β-bridge	trans	-147.4	176.4	178.7	64.7	0	0	0	0	111.4	L201	L201-S224 PolarHBondContact N-O 2.78Å
225	G	95.5	Very high	98	Very high	59 Å²	59	19.9 Å²	19.9	61%	0.608	15%	0.15	S	C	*	.	S	Bend	trans	90	9.5	169.8	0	0	0	0	0	116.4	L201 S202	L201-G225 CarbonylContact O-C 3.43Å; S202-G225 WeakPolarHBondContact CA-O 3.41Å
226	F	97.2	Very high	97.9	Very high	16 Å²	16	22.3 Å²	22.3	7%	0.07	16%	0.163	C	C	.	.			trans	-125.1	153.6	177.2	60.7	-88.1	0	0	0	112.4	L201 D203 L206 C223 L231 F251 H255	L201-F226 HydrophobicContact CB-CD1 3.99Å; L201-F226 HydrophobicContact CD1-CD1 4.08Å; L201-F226 HydrophobicContact CD1-CE1 3.94Å; L201-F226 HydrophobicContact CG-CD1 4.46Å; D203-F226 WeakPolarHBondContact OD1-CA 3.09Å; L206-F226 HydrophobicContact CD1-CB 3.71Å; L206-F226 HydrophobicContact CD1-CD1 3.92Å; L206-F226 HydrophobicContact CD1-CD2 4.14Å; L206-F226 HydrophobicContact CD1-CG 3.66Å; L206-F226 HydrophobicContact CD2-CB 3.93Å; L206-F226 HydrophobicContact CD2-CD2 3.3Å; L206-F226 HydrophobicContact CD2-CE2 3.84Å; L206-F226 HydrophobicContact CD2-CG 3.69Å; L206-F226 HydrophobicContact CG-CB 4.4Å; L206-F226 HydrophobicContact CG-CD2 4.36Å; L206-F226 HydrophobicContact CG-CG 4.34Å; C223-F226 HydrophobicContact CB-CE1 4.03Å; F226-L231 HydrophobicContact CD2-CB 4.25Å; F226-L231 HydrophobicContact CE2-CB 4.14Å; F226-L231 HydrophobicContact CE2-CD1 4.15Å; F226-L231 HydrophobicContact CE2-CD2 4.34Å; F226-L231 HydrophobicContact CE2-CG 4.44Å; F226-F251 HydrophobicContact CD2-CE1 4.44Å; F226-F251 HydrophobicContact CE1-CE1 4.22Å; F226-F251 AromaticContact CE2-CE1 3.49Å; F226-F251 HydrophobicContact CE2-CE1 3.49Å; F226-F251 VanDerWaalsContact CE2-CE1 3.49Å; F226-F251 AromaticContact CE2-CZ 3.44Å; F226-F251 HydrophobicContact CE2-CZ 3.44Å; F226-F251 VanDerWaalsContact CE2-CZ 3.44Å; F226-F251 AromaticContact CZ-CE1 3.38Å; F226-F251 HydrophobicContact CZ-CE1 3.38Å; F226-F251 AromaticContact CZ-CZ 3.41Å; F226-F251 HydrophobicContact CZ-CZ 3.41Å; F226-F251 VanDerWaalsContact CZ-CZ 3.41Å; F226-H255 PolarHBondContact O-NE2 3.18Å; F226-H255 VanDerWaalsContact O-NE2 3.13Å
227	S	98.2	Very high	97.9	Very high	37 Å²	37	23.7 Å²	23.7	26%	0.259	17%	0.174	S	C	.	.			trans	-87.3	159.1	-176.3	75.5	0	0	0	0	113	D203 A229 A230 L231 H255	D203-S227 VanDerWaalsContact CG-OG 3.31Å; D203-S227 PolarHBondContact OD1-N 3.17Å; D203-S227 PolarHBondContact OD1-OG 3.05Å; D203-S227 VanDerWaalsContact OD2-CB 3.32Å; D203-S227 WeakPolarHBondContact OD2-CB 3.33Å; D203-S227 PolarHBondContact OD2-OG 3.46Å; S227-A229 PolarHBondContact O-N 2.87Å; S227-A230 PolarHBondContact O-N 3.27Å; S227-A230 PolarHBondContact OG-N 3.38Å; S227-L231 PolarHBondContact O-N 3.38Å; S227-H255 VanDerWaalsContact C-NE2 3.34Å
228	A	98.1	Very high	97.8	Very high	13 Å²	13	22.3 Å²	22.3	11%	0.107	17%	0.167	C	C	.	.	H	α-helix	trans	-60.9	-32.4	175.7	0	0	0	0	0	112.1	A232 N254 H255 N258	A228-A232 WeakPolarHBondContact O-CB 3.43Å; A228-A232 PolarHBondContact O-N 3.29Å; A228-N254 HydrophobicContact CB-CB 4.23Å; A228-H255 VanDerWaalsContact CA-CD2 3.5Å; A228-H255 WeakPolarHBondContact CA-CD2 3.5Å; A228-H255 HydrophobicContact CB-CB 4.32Å; A228-H255 PolarHBondContact N-CD2 3.19Å; A228-H255 VanDerWaalsContact N-CD2 3.33Å; A228-H255 PolarHBondContact N-NE2 2.79Å; A228-N258 VanDerWaalsContact C-ND2 3.27Å; A228-N258 PolarHBondContact O-ND2 3.26Å
229	A	98.3	Very high	97.6	Very high	62 Å²	62	28.9 Å²	28.9	51%	0.512	19%	0.192	S	C	.	.	H	α-helix	trans	-71.8	-41.4	178.9	0	0	0	0	0	111.9	S227 L231 A232 T233	S227-A229 PolarHBondContact O-N 2.87Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-A232 PolarHBondContact O-N 3.46Å; A229-T233 PolarHBondContact O-N 2.93Å; A229-T233 PolarHBondContact O-OG1 3.44Å
230	A	98.3	Very high	97.6	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-40.8	173.9	0	0	0	0	0	111.4	D203 L206 S227 T233 M234	D203-A230 HydrophobicContact CB-CB 3.83Å; D203-A230 VanDerWaalsContact CG-CB 3.46Å; D203-A230 WeakPolarHBondContact OD1-CB 3.11Å; L206-A230 HydrophobicContact CB-CB 4.12Å; L206-A230 HydrophobicContact CD2-CB 4.07Å; S227-A230 PolarHBondContact O-N 3.27Å; S227-A230 PolarHBondContact OG-N 3.38Å; A230-T233 PolarHBondContact O-N 3.34Å; A230-M234 WeakPolarHBondContact O-CB 3.24Å; A230-M234 PolarHBondContact O-N 3.48Å
231	L	98.5	Very high	97.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59	-49.6	173.6	179.5	61.2	0	0	0	111.9	L206 F226 S227 A229 T233 M234 L235 I246 F251 L259	L206-L231 HydrophobicContact CD2-CB 4.19Å; F226-L231 HydrophobicContact CD2-CB 4.25Å; F226-L231 HydrophobicContact CE2-CB 4.14Å; F226-L231 HydrophobicContact CE2-CD1 4.15Å; F226-L231 HydrophobicContact CE2-CD2 4.34Å; F226-L231 HydrophobicContact CE2-CG 4.44Å; S227-L231 PolarHBondContact O-N 3.38Å; A229-L231 VanDerWaalsContact C-N 3.34Å; L231-T233 VanDerWaalsContact C-N 3.34Å; L231-T233 PolarHBondContact O-N 3.14Å; L231-M234 HydrophobicContact CD1-CE 3.96Å; L231-M234 PolarHBondContact O-N 3.45Å; L231-L235 HydrophobicContact CD1-CD1 3.96Å; L231-L235 HydrophobicContact CD1-CG 4.13Å; L231-L235 HydrophobicContact CG-CD1 4Å; L231-L235 WeakPolarHBondContact O-CG 3.18Å; L231-L235 PolarHBondContact O-N 2.78Å; L231-I246 HydrophobicContact CD1-CD1 3.68Å; L231-I246 HydrophobicContact CD2-CD1 4.26Å; L231-F251 HydrophobicContact CD2-CE2 3.74Å; L231-F251 HydrophobicContact CD2-CZ 3.85Å; L231-L259 HydrophobicContact CD2-CB 4.15Å; L231-L259 HydrophobicContact CD2-CD1 4.4Å
232	A	98.3	Very high	97.6	Very high	10 Å²	10	39.1 Å²	39.1	8%	0.083	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-48.2	177.1	0	0	0	0	0	111.8	A228 A229 M234 L235 D236 N258 K262	A228-A232 WeakPolarHBondContact O-CB 3.43Å; A228-A232 PolarHBondContact O-N 3.29Å; A229-A232 PolarHBondContact O-N 3.46Å; A232-M234 VanDerWaalsContact C-N 3.34Å; A232-M234 PolarHBondContact O-N 2.86Å; A232-L235 PolarHBondContact O-N 2.77Å; A232-D236 WeakPolarHBondContact O-CB 3.18Å; A232-D236 PolarHBondContact O-N 2.57Å; A232-N258 HydrophobicContact CB-CB 4.12Å; A232-K262 HydrophobicContact CB-CG 3.97Å
233	T	98.4	Very high	97.7	Very high	76 Å²	76	39.2 Å²	39.2	47%	0.466	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-41.5	-179	-56.4	0	0	0	0	112	A229 A230 L231 S237	A229-T233 PolarHBondContact O-N 2.93Å; A229-T233 PolarHBondContact O-OG1 3.44Å; A230-T233 PolarHBondContact O-N 3.34Å; L231-T233 VanDerWaalsContact C-N 3.34Å; L231-T233 PolarHBondContact O-N 3.14Å; T233-S237 PolarHBondContact O-N 3.02Å; T233-S237 PolarHBondContact O-OG 3.06Å
234	M	98.3	Very high	97.7	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-47.3	176.8	-176.6	-78.5	-66.2	0	0	111.4	L206 L209 A210 L218 L220 A230 L231 A232 D236 S237 C238	L206-M234 HydrophobicContact CB-CB 4.49Å; L209-M234 HydrophobicContact CB-CG 3.96Å; A210-M234 HydrophobicContact CB-CB 4.41Å; L218-M234 HydrophobicContact CD2-CE 3.76Å; L218-M234 HydrophobicContact CD2-SD 4.02Å; L220-M234 HydrophobicContact CD1-CE 4.4Å; A230-M234 WeakPolarHBondContact O-CB 3.24Å; A230-M234 PolarHBondContact O-N 3.48Å; L231-M234 HydrophobicContact CD1-CE 3.96Å; L231-M234 PolarHBondContact O-N 3.45Å; A232-M234 VanDerWaalsContact C-N 3.34Å; A232-M234 PolarHBondContact O-N 2.86Å; M234-D236 VanDerWaalsContact C-N 3.33Å; M234-D236 PolarHBondContact O-N 3.31Å; M234-S237 PolarHBondContact O-N 2.85Å; M234-C238 PolarHBondContact O-N 3.1Å; M234-C238 PolarHBondContact O-SG 3.15Å; M234-C238 VanDerWaalsContact O-SG 3.42Å; M234-C238 HydrophobicContact SD-CB 4.27Å; M234-C238 VanDerWaalsContact SD-SG 3.67Å
235	L	98.1	Very high	97.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-37.1	178.4	-68.2	174.9	0	0	0	112.3	L231 A232 S237 C238 L241 L244 L259 K262 L263	L231-L235 HydrophobicContact CD1-CD1 3.96Å; L231-L235 HydrophobicContact CD1-CG 4.13Å; L231-L235 HydrophobicContact CG-CD1 4Å; L231-L235 WeakPolarHBondContact O-CG 3.18Å; L231-L235 PolarHBondContact O-N 2.78Å; A232-L235 PolarHBondContact O-N 2.77Å; L235-S237 PolarHBondContact O-N 3.23Å; L235-C238 PolarHBondContact O-N 2.97Å; L235-L241 HydrophobicContact CD2-CD2 4.3Å; L235-L244 HydrophobicContact CD2-CD2 4.16Å; L235-L259 HydrophobicContact CD1-CB 4.4Å; L235-L259 HydrophobicContact CD1-CG 4.23Å; L235-K262 HydrophobicContact CB-CB 3.88Å; L235-K262 HydrophobicContact CD1-CB 4.36Å; L235-L263 HydrophobicContact CD2-CD1 4.11Å
236	D	97.4	Very high	98	Very high	51 Å²	51	33.9 Å²	33.9	27%	0.273	18%	0.178	S	C	.	.	H	α-helix	trans	-63.1	-24.1	173.8	-95.4	-34.1	0	0	0	112.7	A232 M234 R239 K262	A232-D236 WeakPolarHBondContact O-CB 3.18Å; A232-D236 PolarHBondContact O-N 2.57Å; M234-D236 VanDerWaalsContact C-N 3.33Å; M234-D236 PolarHBondContact O-N 3.31Å; D236-R239 PolarHBondContact O-NE 3.14Å; D236-R239 PolarHBondContact O-NH2 2.82Å; D236-R239 IonicContact OD1-CZ 3.96Å; D236-R239 IonicContact OD1-NH2 3.06Å; D236-R239 PolarHBondContact OD1-NH2 2.75Å; D236-K262 IonicContact OD1-NZ 3.99Å; D236-K262 WeakPolarHBondContact OD2-CD 3.38Å; D236-K262 WeakPolarHBondContact OD2-CE 3.46Å; D236-K262 IonicContact OD2-NZ 3.28Å; D236-K262 PolarHBondContact OD2-NZ 3.12Å
237	S	97.7	Very high	98.1	Very high	44 Å²	44	33.3 Å²	33.3	31%	0.308	18%	0.176	S	C	.	.	H	α-helix	trans	-91.6	-38.2	179.2	-55.4	0	0	0	0	112.3	A210 T233 M234 L235 R239	A210-S237 VanDerWaalsContact O-CB 3.24Å; A210-S237 WeakPolarHBondContact O-CB 3.47Å; T233-S237 PolarHBondContact O-N 3.02Å; T233-S237 PolarHBondContact O-OG 3.06Å; M234-S237 PolarHBondContact O-N 2.85Å; L235-S237 PolarHBondContact O-N 3.23Å; S237-R239 VanDerWaalsContact C-N 3.28Å; S237-R239 PolarHBondContact O-N 3.1Å
238	C	97	Very high	98.1	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.007	19%	0.186	C	C	.	.			trans	-81.5	62	-176.7	-64.8	0	0	0	0	112.8	M234 L235 R240 L241	M234-C238 PolarHBondContact O-N 3.1Å; M234-C238 PolarHBondContact O-SG 3.15Å; M234-C238 VanDerWaalsContact O-SG 3.42Å; M234-C238 HydrophobicContact SD-CB 4.27Å; M234-C238 VanDerWaalsContact SD-SG 3.67Å; L235-C238 PolarHBondContact O-N 2.97Å; C238-R240 VanDerWaalsContact C-N 3.25Å; C238-R240 PolarHBondContact O-N 3.16Å; C238-L241 WeakPolarHBondContact O-CB 3.28Å; C238-L241 PolarHBondContact O-N 2.94Å
239	R	95.6	Very high	98	Very high	138 Å²	138	37 Å²	37	52%	0.521	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-12	-173.3	-63.4	-66.4	178.7	130.3	-5.5	115.2	D236 S237 S264 S266	D236-R239 PolarHBondContact O-NE 3.14Å; D236-R239 PolarHBondContact O-NH2 2.82Å; D236-R239 IonicContact OD1-CZ 3.96Å; D236-R239 IonicContact OD1-NH2 3.06Å; D236-R239 PolarHBondContact OD1-NH2 2.75Å; S237-R239 VanDerWaalsContact C-N 3.28Å; S237-R239 PolarHBondContact O-N 3.1Å; R239-S264 PolarHBondContact O-OG 2.88Å; R239-S266 PolarHBondContact O-OG 3.02Å; R239-S266 VanDerWaalsContact O-OG 3.13Å
240	R	97.8	Very high	97.7	Very high	134 Å²	134	39.4 Å²	39.4	51%	0.506	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	7.7	178.1	-60.7	-170.8	67.6	178.7	6.6	113.6	D214 L215 L216 C238 E242	D214-R240 VanDerWaalsContact OD1-CD 3.24Å; D214-R240 WeakPolarHBondContact OD1-CD 3.49Å; D214-R240 IonicContact OD1-CZ 3.73Å; D214-R240 IonicContact OD1-NE 3.88Å; D214-R240 IonicContact OD1-NH1 2.8Å; D214-R240 PolarHBondContact OD1-NH1 2.98Å; L215-R240 CarbonylContact O-C 3.54Å; L215-R240 VanDerWaalsContact O-C 3.3Å; L216-R240 HydrophobicContact CD2-CB 3.88Å; L216-R240 VanDerWaalsContact CD2-O 3.25Å; L216-R240 WeakPolarHBondContact CD2-O 3.18Å; C238-R240 VanDerWaalsContact C-N 3.25Å; C238-R240 PolarHBondContact O-N 3.16Å; R240-E242 PolarHBondContact O-N 2.77Å
241	L	98.5	Very high	97.5	Very high	1 Å²	1	40 Å²	40	1%	0.005	20%	0.198	C	C	.	.			trans	-62.1	124.7	-176.3	-165	67.7	0	0	0	110.7	L215 L218 L235 C238 L244 L263 S266 V267	L215-L241 HydrophobicContact CD2-CD1 4.38Å; L215-L241 HydrophobicContact CG-CD1 4.3Å; L215-L241 VanDerWaalsContact O-CA 3.28Å; L215-L241 WeakPolarHBondContact O-CA 3.38Å; L215-L241 PolarHBondContact O-N 3.06Å; L218-L241 HydrophobicContact CB-CD1 3.84Å; L235-L241 HydrophobicContact CD2-CD2 4.3Å; C238-L241 WeakPolarHBondContact O-CB 3.28Å; C238-L241 PolarHBondContact O-N 2.94Å; L241-L244 HydrophobicContact CD2-CB 3.92Å; L241-L244 HydrophobicContact CD2-CD1 4.23Å; L241-L244 HydrophobicContact CD2-CD2 4.16Å; L241-L244 HydrophobicContact CD2-CG 4.33Å; L241-L263 HydrophobicContact CD2-CD1 4.44Å; L241-S266 CarbonylContact O-C 3.6Å; L241-S266 VanDerWaalsContact O-C 3.29Å; L241-S266 PolarHBondContact O-OG 3.33Å; L241-V267 HydrophobicContact CB-CG2 4.28Å; L241-V267 HydrophobicContact CD2-CG2 4.47Å; L241-V267 HydrophobicContact CG-CG2 4.36Å; L241-V267 WeakPolarHBondContact O-CA 3.31Å; L241-V267 WeakPolarHBondContact O-CG2 3.35Å; L241-V267 PolarHBondContact O-N 2.85Å
242	E	98.5	Very high	97.3	Very high	81 Å²	81	42.7 Å²	42.7	38%	0.379	22%	0.216	S	C	.	.			trans	-107.7	-36.1	-179.5	-68.3	172.2	-167.9	0	0	111.3	L216 R240 T268 H269	L216-E242 PolarHBondContact O-N 2.71Å; R240-E242 PolarHBondContact O-N 2.77Å; E242-T268 PolarHBondContact O-N 3.2Å; E242-T268 PolarHBondContact O-OG1 2.79Å; E242-H269 PolarHBondContact O-N 2.86Å; E242-H269 VanDerWaalsContact O-N 3.09Å
243	Q	98.8	Very high	97.1	Very high	37 Å²	37	48.1 Å²	48.1	17%	0.173	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.4	179.4	-47.9	-164.6	4.3	0	0	111.4	L216 Q217 L218 H269 A380	L216-Q243 PolarHBondContact O-N 3.12Å; Q217-Q243 WeakPolarHBondContact CA-O 3.39Å; Q217-Q243 HydrophobicContact CB-CB 4.17Å; Q217-Q243 HydrophobicContact CG-CB 3.94Å; Q217-Q243 HydrophobicContact CG-CG 3.94Å; L218-Q243 PolarHBondContact N-O 3.28Å; Q243-H269 CarbonylContact C-O 3.47Å; Q243-H269 VanDerWaalsContact CA-O 3.29Å; Q243-H269 WeakPolarHBondContact CA-O 3.25Å; Q243-H269 HydrophobicContact CB-CB 4.14Å; Q243-H269 HydrophobicContact CG-CB 3.86Å; Q243-A380 HydrophobicContact CB-CB 4.05Å; Q243-A380 VanDerWaalsContact OE1-N 3.11Å
244	L	98.8	Very high	97	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	119.9	176.1	179.2	59.9	0	0	0	109.9	L218 L235 L241 I246 L263 H269 L270 N271 V379	L218-L244 HydrophobicContact CB-CD1 4.06Å; L218-L244 HydrophobicContact CD2-CD1 4.12Å; L218-L244 HydrophobicContact CG-CD1 4.11Å; L218-L244 WeakPolarHBondContact O-CA 3.35Å; L235-L244 HydrophobicContact CD2-CD2 4.16Å; L241-L244 HydrophobicContact CD2-CB 3.92Å; L241-L244 HydrophobicContact CD2-CD1 4.23Å; L241-L244 HydrophobicContact CD2-CD2 4.16Å; L241-L244 HydrophobicContact CD2-CG 4.33Å; L244-I246 HydrophobicContact CD1-CB 4.19Å; L244-I246 HydrophobicContact CD2-CG2 4.08Å; L244-I246 HydrophobicContact CG-CB 4.21Å; L244-I246 HydrophobicContact CG-CG2 4.06Å; L244-L263 HydrophobicContact CD2-CD1 3.44Å; L244-L263 VanDerWaalsContact CD2-CD1 3.44Å; L244-H269 PolarHBondContact N-O 3.32Å; L244-L270 HydrophobicContact CB-CD1 3.93Å; L244-L270 HydrophobicContact CD2-CD1 4.1Å; L244-L270 HydrophobicContact CG-CD1 4.15Å; L244-L270 WeakPolarHBondContact O-CA 3.47Å; L244-N271 PolarHBondContact O-N 3.03Å; L244-V379 VanDerWaalsContact O-CG1 3.31Å; L244-V379 WeakPolarHBondContact O-CG1 3.21Å
245	N	98.8	Very high	97	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	118.2	161.5	-179.9	1.5	0	0	0	108.3	L218 N219 L220 G221 S247 N271 V379 A380	L218-N245 PolarHBondContact O-N 2.93Å; N219-N245 CarbonylContact C-O 3.58Å; N219-N245 WeakPolarHBondContact CA-O 3.41Å; N219-N245 HydrophobicContact CB-CB 4.34Å; N219-N245 WeakPolarHBondContact OD1-CB 3.48Å; N219-N245 PolarHBondContact OD1-ND2 3.48Å; N219-N245 VanDerWaalsContact OD1-ND2 3.16Å; L220-N245 PolarHBondContact N-O 3.49Å; G221-N245 PolarHBondContact N-O 3.39Å; N245-S247 WeakPolarHBondContact OD1-CB 3.36Å; N245-S247 PolarHBondContact OD1-N 3.41Å; N245-S247 VanDerWaalsContact OD1-N 3.11Å; N245-S247 PolarHBondContact OD1-OG 2.95Å; N245-N271 HydrophobicContact CB-CB 4.27Å; N245-V379 HydrophobicContact CB-CG1 4.26Å; N245-V379 WeakPolarHBondContact CB-O 3.49Å; N245-A380 HydrophobicContact CB-CB 4.09Å
246	I	98.3	Very high	97	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.244	C	C	.	.			trans	-134.8	21.9	177.3	-166.9	162.2	0	0	0	110.2	L220 L231 L244 C249 F251 L259 N271 L272 Y275	L220-I246 HydrophobicContact CB-CG1 4.26Å; L220-I246 HydrophobicContact CD1-CD1 4.27Å; L231-I246 HydrophobicContact CD1-CD1 3.68Å; L231-I246 HydrophobicContact CD2-CD1 4.26Å; L244-I246 HydrophobicContact CD1-CB 4.19Å; L244-I246 HydrophobicContact CD2-CG2 4.08Å; L244-I246 HydrophobicContact CG-CB 4.21Å; L244-I246 HydrophobicContact CG-CG2 4.06Å; I246-C249 PolarHBondContact O-SG 2.89Å; I246-F251 HydrophobicContact CD1-CE2 3.82Å; I246-F251 HydrophobicContact CD1-CZ 3.78Å; I246-F251 HydrophobicContact CG1-CE2 3.84Å; I246-F251 HydrophobicContact CG1-CZ 3.83Å; I246-L259 HydrophobicContact CD1-CD1 3.99Å; I246-L259 HydrophobicContact CG1-CD1 4.48Å; I246-L259 HydrophobicContact CG2-CD1 3.58Å; I246-N271 PolarHBondContact N-O 2.78Å; I246-N271 VanDerWaalsContact N-O 3.13Å; I246-L272 HydrophobicContact CG2-CD2 3.44Å; I246-L272 VanDerWaalsContact CG2-CD2 3.44Å; I246-Y275 PolarHBondContact O-OH 2.92Å
247	S	98.3	Very high	97	Very high	5 Å²	5	51.5 Å²	51.5	4%	0.035	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	154.8	-179.4	58.4	0	0	0	0	113.5	G221 G222 N245 C249 N271 S273	G221-S247 CarbonylContact C-O 3.6Å; G221-S247 VanDerWaalsContact CA-O 3.25Å; G221-S247 WeakPolarHBondContact CA-O 3.41Å; G222-S247 PolarHBondContact N-O 2.95Å; N245-S247 WeakPolarHBondContact OD1-CB 3.36Å; N245-S247 PolarHBondContact OD1-N 3.41Å; N245-S247 VanDerWaalsContact OD1-N 3.11Å; N245-S247 PolarHBondContact OD1-OG 2.95Å; S247-C249 PolarHBondContact O-N 2.97Å; S247-N271 WeakPolarHBondContact CB-OD1 3.49Å; S247-N271 PolarHBondContact N-O 3.22Å; S247-S273 CarbonylContact C-O 3.57Å; S247-S273 VanDerWaalsContact CA-O 3.24Å; S247-S273 WeakPolarHBondContact CA-O 3.22Å; S247-S273 WeakPolarHBondContact CB-O 3.44Å; S247-S273 WeakPolarHBondContact CB-OG 3.19Å
248	W	97.6	Very high	97	Very high	119 Å²	119	51.3 Å²	51.3	45%	0.451	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	22.3	171.1	-58.6	97	0	0	0	115.7	S273 D301	W248-S273 PolarHBondContact N-O 3.32Å; W248-S273 PolarHBondContact NE1-OG 3.29Å; W248-S273 VanDerWaalsContact NE1-OG 3.14Å; W248-D301 HydrophobicContact CH2-CB 3.88Å; W248-D301 VanDerWaalsContact CH2-CG 3.4Å; W248-D301 WeakPolarHBondContact CH2-OD1 3.43Å; W248-D301 HydrophobicContact CZ2-CB 4.06Å; W248-D301 VanDerWaalsContact CZ2-OD2 3.31Å; W248-D301 WeakPolarHBondContact CZ2-OD2 3.24Å
249	C	96.8	Very high	97.1	Very high	8 Å²	8	51.3 Å²	51.3	5%	0.054	24%	0.242	C	C	.	.			trans	-77.2	147	168.4	-61	0	0	0	0	110.5	L220 C223 I246 S247 F251 Y275	L220-C249 PolarHBondContact O-SG 3.38Å; C223-C249 WeakPolarHBondContact O-CA 3.41Å; C223-C249 WeakPolarHBondContact O-CB 3.42Å; C223-C249 PolarHBondContact O-SG 3.5Å; C223-C249 VanDerWaalsContact O-SG 3.34Å; I246-C249 PolarHBondContact O-SG 2.89Å; S247-C249 PolarHBondContact O-N 2.97Å; C249-F251 HydrophobicContact CB-CD1 3.4Å; C249-F251 VanDerWaalsContact CB-CD1 3.4Å; C249-F251 HydrophobicContact CB-CD2 4.26Å; C249-F251 HydrophobicContact CB-CE1 3.28Å; C249-F251 HydrophobicContact CB-CE2 4.15Å; C249-F251 HydrophobicContact CB-CG 3.91Å; C249-F251 HydrophobicContact CB-CZ 3.67Å; C249-F251 PolarHBondContact O-N 2.9Å; C249-Y275 HydrophobicContact CB-CE1 4.35Å; C249-Y275 WeakPolarHBondContact O-CE1 3.32Å
250	S	92.1	Very high	97.2	Very high	112 Å²	112	44.9 Å²	44.9	78%	0.783	22%	0.218	S	C	*	.			trans	-75.4	73.8	175.3	-168.3	0	0	0	0	110.6
251	F	94	Very high	97.2	Very high	21 Å²	21	43.1 Å²	43.1	9%	0.092	22%	0.215	C	C	.	.			trans	-99.3	140.3	-173	-82.3	9.7	0	0	0	112.1	F226 L231 I246 C249 H255 L259 Y275	F226-F251 HydrophobicContact CD2-CE1 4.44Å; F226-F251 HydrophobicContact CE1-CE1 4.22Å; F226-F251 AromaticContact CE2-CE1 3.49Å; F226-F251 HydrophobicContact CE2-CE1 3.49Å; F226-F251 VanDerWaalsContact CE2-CE1 3.49Å; F226-F251 AromaticContact CE2-CZ 3.44Å; F226-F251 HydrophobicContact CE2-CZ 3.44Å; F226-F251 VanDerWaalsContact CE2-CZ 3.44Å; F226-F251 AromaticContact CZ-CE1 3.38Å; F226-F251 HydrophobicContact CZ-CE1 3.38Å; F226-F251 AromaticContact CZ-CZ 3.41Å; F226-F251 HydrophobicContact CZ-CZ 3.41Å; F226-F251 VanDerWaalsContact CZ-CZ 3.41Å; L231-F251 HydrophobicContact CD2-CE2 3.74Å; L231-F251 HydrophobicContact CD2-CZ 3.85Å; I246-F251 HydrophobicContact CD1-CE2 3.82Å; I246-F251 HydrophobicContact CD1-CZ 3.78Å; I246-F251 HydrophobicContact CG1-CE2 3.84Å; I246-F251 HydrophobicContact CG1-CZ 3.83Å; C249-F251 HydrophobicContact CB-CD1 3.4Å; C249-F251 VanDerWaalsContact CB-CD1 3.4Å; C249-F251 HydrophobicContact CB-CD2 4.26Å; C249-F251 HydrophobicContact CB-CE1 3.28Å; C249-F251 HydrophobicContact CB-CE2 4.15Å; C249-F251 HydrophobicContact CB-CG 3.91Å; C249-F251 HydrophobicContact CB-CZ 3.67Å; C249-F251 PolarHBondContact O-N 2.9Å; F251-H255 HydrophobicContact CB-CB 3.71Å; F251-H255 HydrophobicContact CD1-CB 4.07Å; F251-H255 AromaticContact CD1-CD2 3.9Å; F251-H255 HydrophobicContact CD2-CB 3.62Å; F251-H255 HydrophobicContact CE2-CB 4.23Å; F251-H255 HydrophobicContact CG-CB 3.53Å; F251-H255 AromaticContact CG-CG 3.96Å; F251-L259 HydrophobicContact CE2-CD1 4.16Å; F251-Y275 HydrophobicContact CB-CD1 4.07Å; F251-Y275 HydrophobicContact CB-CE1 3.72Å; F251-Y275 AromaticContact CD2-CE1 3.59Å; F251-Y275 HydrophobicContact CD2-CE1 3.59Å; F251-Y275 AromaticContact CD2-CZ 3.57Å; F251-Y275 WeakPolarHBondContact CD2-OH 3.24Å; F251-Y275 HydrophobicContact CE2-CE1 4.41Å; F251-Y275 WeakPolarHBondContact CE2-OH 3.37Å; F251-Y275 AromaticContact CG-CE1 3.82Å; F251-Y275 HydrophobicContact CG-CE1 3.82Å
252	S	94.3	Very high	97.1	Very high	55 Å²	55	46.1 Å²	46.1	39%	0.385	23%	0.229	S	C	.	.			trans	-84.6	169.4	165.1	70.7	0	0	0	0	111.2	N254 H255 V256	S252-N254 PolarHBondContact O-N 3.48Å; S252-H255 PolarHBondContact N-ND1 3.07Å; S252-H255 WeakPolarHBondContact O-CB 3.33Å; S252-H255 PolarHBondContact O-N 2.74Å; S252-H255 PolarHBondContact OG-ND1 3.36Å; S252-V256 PolarHBondContact O-N 3.03Å
253	R	94.4	Very high	97.1	Very high	125 Å²	125	42.3 Å²	42.3	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-52.9	-38.3	174.2	-176.7	167.7	-75.7	172.7	-0.2	113.1	H255 V256 Q257	R253-H255 VanDerWaalsContact C-N 3.28Å; R253-H255 PolarHBondContact O-N 3.06Å; R253-V256 PolarHBondContact O-N 2.89Å; R253-Q257 HydrophobicContact CG-CG 4.34Å; R253-Q257 WeakPolarHBondContact O-CG 3.31Å; R253-Q257 PolarHBondContact O-N 3.4Å
254	N	96.8	Very high	96.9	Very high	101 Å²	101	40.8 Å²	40.8	54%	0.54	20%	0.204	S	C	.	.	H	α-helix	trans	-63.1	-33.5	176.8	-65.3	1.5	0	0	0	112.6	A228 S252 N258	A228-N254 HydrophobicContact CB-CB 4.23Å; S252-N254 PolarHBondContact O-N 3.48Å; N254-N258 VanDerWaalsContact O-CB 3.31Å; N254-N258 WeakPolarHBondContact O-CB 3.21Å; N254-N258 VanDerWaalsContact O-CG 3.31Å; N254-N258 PolarHBondContact O-N 2.58Å
255	H	97.8	Very high	96.9	Very high	25 Å²	25	44.4 Å²	44.4	12%	0.116	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-44.1	175.3	-67.3	80.1	0	0	0	110.8	F226 S227 A228 F251 S252 R253 L259	F226-H255 PolarHBondContact O-NE2 3.18Å; F226-H255 VanDerWaalsContact O-NE2 3.13Å; S227-H255 VanDerWaalsContact C-NE2 3.34Å; A228-H255 VanDerWaalsContact CA-CD2 3.5Å; A228-H255 WeakPolarHBondContact CA-CD2 3.5Å; A228-H255 HydrophobicContact CB-CB 4.32Å; A228-H255 PolarHBondContact N-CD2 3.19Å; A228-H255 VanDerWaalsContact N-CD2 3.33Å; A228-H255 PolarHBondContact N-NE2 2.79Å; F251-H255 HydrophobicContact CB-CB 3.71Å; F251-H255 HydrophobicContact CD1-CB 4.07Å; F251-H255 AromaticContact CD1-CD2 3.9Å; F251-H255 HydrophobicContact CD2-CB 3.62Å; F251-H255 HydrophobicContact CE2-CB 4.23Å; F251-H255 HydrophobicContact CG-CB 3.53Å; F251-H255 AromaticContact CG-CG 3.96Å; S252-H255 PolarHBondContact N-ND1 3.07Å; S252-H255 WeakPolarHBondContact O-CB 3.33Å; S252-H255 PolarHBondContact O-N 2.74Å; S252-H255 PolarHBondContact OG-ND1 3.36Å; R253-H255 VanDerWaalsContact C-N 3.28Å; R253-H255 PolarHBondContact O-N 3.06Å; H255-L259 VanDerWaalsContact O-CB 3.22Å; H255-L259 WeakPolarHBondContact O-CB 3.35Å; H255-L259 PolarHBondContact O-N 3.34Å
256	V	97.8	Very high	96.8	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-46.7	178.3	176	0	0	0	0	111	S252 R253 L259 V260 Y275 L279 D283	S252-V256 PolarHBondContact O-N 3.03Å; R253-V256 PolarHBondContact O-N 2.89Å; V256-L259 WeakPolarHBondContact O-CB 2.81Å; V256-L259 PolarHBondContact O-N 3.25Å; V256-V260 WeakPolarHBondContact O-CG2 3.29Å; V256-V260 PolarHBondContact O-N 2.82Å; V256-Y275 HydrophobicContact CG2-CD2 4.36Å; V256-Y275 HydrophobicContact CG2-CG 4.25Å; V256-L279 HydrophobicContact CG1-CB 4.39Å; V256-L279 HydrophobicContact CG1-CD1 3.46Å; V256-L279 VanDerWaalsContact CG1-CD1 3.46Å; V256-D283 HydrophobicContact CG1-CB 4.22Å
257	Q	97.6	Very high	96.8	Very high	71 Å²	71	46.3 Å²	46.3	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-59	-53.6	176.9	-74.2	177.3	-21	0	0	111.7	R253 L259 V260 E261	R253-Q257 HydrophobicContact CG-CG 4.34Å; R253-Q257 WeakPolarHBondContact O-CG 3.31Å; R253-Q257 PolarHBondContact O-N 3.4Å; Q257-L259 PolarHBondContact O-N 3.3Å; Q257-V260 VanDerWaalsContact O-CG2 3.31Å; Q257-V260 WeakPolarHBondContact O-CG2 3.42Å; Q257-V260 PolarHBondContact O-N 3.34Å; Q257-E261 WeakPolarHBondContact O-CB 3.2Å; Q257-E261 VanDerWaalsContact O-CG 3.28Å; Q257-E261 WeakPolarHBondContact O-CG 3.44Å; Q257-E261 PolarHBondContact O-N 3.09Å
258	N	98.1	Very high	96.8	Very high	41 Å²	41	47.4 Å²	47.4	22%	0.219	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-36.6	177.5	-79.4	9.7	0	0	0	112.2	A228 A232 N254 K262	A228-N258 VanDerWaalsContact C-ND2 3.27Å; A228-N258 PolarHBondContact O-ND2 3.26Å; A232-N258 HydrophobicContact CB-CB 4.12Å; N254-N258 VanDerWaalsContact O-CB 3.31Å; N254-N258 WeakPolarHBondContact O-CB 3.21Å; N254-N258 VanDerWaalsContact O-CG 3.31Å; N254-N258 PolarHBondContact O-N 2.58Å; N258-K262 WeakPolarHBondContact O-CB 3.34Å; N258-K262 WeakPolarHBondContact O-CG 3.28Å; N258-K262 PolarHBondContact O-N 3.41Å; N258-K262 VanDerWaalsContact O-N 3.1Å
259	L	97.8	Very high	96.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-56.9	176.7	-174.6	163.9	0	0	0	110.9	L231 L235 I246 F251 H255 V256 Q257 E261 K262 L263 L272	L231-L259 HydrophobicContact CD2-CB 4.15Å; L231-L259 HydrophobicContact CD2-CD1 4.4Å; L235-L259 HydrophobicContact CD1-CB 4.4Å; L235-L259 HydrophobicContact CD1-CG 4.23Å; I246-L259 HydrophobicContact CD1-CD1 3.99Å; I246-L259 HydrophobicContact CG1-CD1 4.48Å; I246-L259 HydrophobicContact CG2-CD1 3.58Å; F251-L259 HydrophobicContact CE2-CD1 4.16Å; H255-L259 VanDerWaalsContact O-CB 3.22Å; H255-L259 WeakPolarHBondContact O-CB 3.35Å; H255-L259 PolarHBondContact O-N 3.34Å; V256-L259 WeakPolarHBondContact O-CB 2.81Å; V256-L259 PolarHBondContact O-N 3.25Å; Q257-L259 PolarHBondContact O-N 3.3Å; L259-E261 VanDerWaalsContact C-N 3.27Å; L259-E261 PolarHBondContact O-N 3.27Å; L259-K262 PolarHBondContact O-N 3.49Å; L259-L263 WeakPolarHBondContact O-CB 3.5Å; L259-L263 PolarHBondContact O-N 2.92Å; L259-L272 HydrophobicContact CD1-CD2 3.45Å; L259-L272 VanDerWaalsContact CD1-CD2 3.45Å; L259-L272 HydrophobicContact CD2-CD1 3.97Å; L259-L272 HydrophobicContact CD2-CD2 3.56Å; L259-L272 HydrophobicContact CD2-CG 4.38Å; L259-L272 HydrophobicContact CG-CD2 4.18Å
260	V	97.9	Very high	97	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-32	-175.5	-60.9	0	0	0	0	112	V256 Q257 L272 D283 V286 L287 R290	V256-V260 WeakPolarHBondContact O-CG2 3.29Å; V256-V260 PolarHBondContact O-N 2.82Å; Q257-V260 VanDerWaalsContact O-CG2 3.31Å; Q257-V260 WeakPolarHBondContact O-CG2 3.42Å; Q257-V260 PolarHBondContact O-N 3.34Å; V260-L272 HydrophobicContact CG1-CD1 4.48Å; V260-D283 HydrophobicContact CG1-CB 4.29Å; V260-D283 HydrophobicContact CG2-CB 4.22Å; V260-V286 HydrophobicContact CB-CG1 4.29Å; V260-V286 HydrophobicContact CG2-CB 4.14Å; V260-V286 HydrophobicContact CG2-CG1 3.98Å; V260-L287 HydrophobicContact CB-CB 4.31Å; V260-L287 HydrophobicContact CG1-CB 4.15Å; V260-R290 WeakPolarHBondContact O-CD 3.35Å; V260-R290 PolarHBondContact O-NH1 2.99Å
261	E	97.9	Very high	97.3	Very high	97 Å²	97	38.1 Å²	38.1	45%	0.453	20%	0.196	S	C	.	.	H	α-helix	trans	-75.8	-25	178	-72.2	178.2	-177.5	0	0	114.4	Q257 L259 V286 R290	Q257-E261 WeakPolarHBondContact O-CB 3.2Å; Q257-E261 VanDerWaalsContact O-CG 3.28Å; Q257-E261 WeakPolarHBondContact O-CG 3.44Å; Q257-E261 PolarHBondContact O-N 3.09Å; L259-E261 VanDerWaalsContact C-N 3.27Å; L259-E261 PolarHBondContact O-N 3.27Å; E261-V286 HydrophobicContact CG-CG1 4.21Å; E261-R290 VanDerWaalsContact C-NH1 3.26Å; E261-R290 PolarHBondContact O-NE 2.84Å; E261-R290 PolarHBondContact O-NH1 2.95Å; E261-R290 PolarHBondContact O-NH2 3.29Å
262	K	97.8	Very high	97.5	Very high	65 Å²	65	37.2 Å²	37.2	28%	0.283	19%	0.192	S	C	.	.	H	α-helix	trans	-110.2	-15.8	-174	-58.9	-57.7	-166	151.1	0	114.8	A232 L235 D236 N258 L259	A232-K262 HydrophobicContact CB-CG 3.97Å; L235-K262 HydrophobicContact CB-CB 3.88Å; L235-K262 HydrophobicContact CD1-CB 4.36Å; D236-K262 IonicContact OD1-NZ 3.99Å; D236-K262 WeakPolarHBondContact OD2-CD 3.38Å; D236-K262 WeakPolarHBondContact OD2-CE 3.46Å; D236-K262 IonicContact OD2-NZ 3.28Å; D236-K262 PolarHBondContact OD2-NZ 3.12Å; N258-K262 WeakPolarHBondContact O-CB 3.34Å; N258-K262 WeakPolarHBondContact O-CG 3.28Å; N258-K262 PolarHBondContact O-N 3.41Å; N258-K262 VanDerWaalsContact O-N 3.1Å; L259-K262 PolarHBondContact O-N 3.49Å
263	L	97.2	Very high	97.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	S	Bend	trans	-51.9	139.4	179.6	-164	63.1	0	0	0	113.3	L235 L241 L244 L259 V267 L270 L287 R290	L235-L263 HydrophobicContact CD2-CD1 4.11Å; L241-L263 HydrophobicContact CD2-CD1 4.44Å; L244-L263 HydrophobicContact CD2-CD1 3.44Å; L244-L263 VanDerWaalsContact CD2-CD1 3.44Å; L259-L263 WeakPolarHBondContact O-CB 3.5Å; L259-L263 PolarHBondContact O-N 2.92Å; L263-V267 HydrophobicContact CD1-CG2 3.85Å; L263-V267 HydrophobicContact CD2-CB 4.3Å; L263-V267 HydrophobicContact CD2-CG1 4.22Å; L263-V267 HydrophobicContact CD2-CG2 4.27Å; L263-V267 HydrophobicContact CG-CB 4.3Å; L263-V267 HydrophobicContact CG-CG2 3.8Å; L263-L270 HydrophobicContact CD2-CD1 4.08Å; L263-L270 HydrophobicContact CD2-CD2 3.69Å; L263-L287 HydrophobicContact CD2-CD1 3.73Å; L263-R290 PolarHBondContact O-NH1 2.63Å; L263-R290 PolarHBondContact O-NH2 3.17Å
264	S	95.8	Very high	97.8	Very high	6 Å²	6	29.7 Å²	29.7	4%	0.042	16%	0.161	C	C	.	.			trans	-69.5	142	-179.5	-173.8	0	0	0	0	112.5	R239 S266 V267	R239-S264 PolarHBondContact O-OG 2.88Å; S264-S266 WeakPolarHBondContact CB-OG 3.29Å; S264-S266 PolarHBondContact O-N 3.15Å; S264-S266 VanDerWaalsContact O-N 3.11Å; S264-S266 PolarHBondContact OG-N 3.44Å; S264-S266 PolarHBondContact OG-OG 3.29Å; S264-V267 WeakPolarHBondContact O-CB 3.47Å; S264-V267 WeakPolarHBondContact O-CG2 3.42Å; S264-V267 PolarHBondContact O-N 2.94Å; S264-V267 VanDerWaalsContact O-N 3.1Å
265	P	97.3	Very high	97.8	Very high	75 Å²	75	25.2 Å²	25.2	49%	0.487	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.3	171.3	26.5	-36.5	0	0	0	113.9	V267 R290	P265-V267 PolarHBondContact O-N 2.89Å; P265-R290 WeakPolarHBondContact CA-O 3.46Å; P265-R290 VanDerWaalsContact CB-O 3.29Å; P265-R290 WeakPolarHBondContact CB-O 3.5Å
266	S	97.8	Very high	97.7	Very high	41 Å²	41	29.5 Å²	29.5	29%	0.287	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-9.9	173.8	57.9	0	0	0	0	114	R239 L241 S264 T268	R239-S266 PolarHBondContact O-OG 3.02Å; R239-S266 VanDerWaalsContact O-OG 3.13Å; L241-S266 CarbonylContact O-C 3.6Å; L241-S266 VanDerWaalsContact O-C 3.29Å; L241-S266 PolarHBondContact O-OG 3.33Å; S264-S266 WeakPolarHBondContact CB-OG 3.29Å; S264-S266 PolarHBondContact O-N 3.15Å; S264-S266 VanDerWaalsContact O-N 3.11Å; S264-S266 PolarHBondContact OG-N 3.44Å; S264-S266 PolarHBondContact OG-OG 3.29Å; S266-T268 PolarHBondContact O-N 3.13Å
267	V	98.6	Very high	97.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.			trans	-69	124.5	-177.9	175.2	0	0	0	0	110.3	L241 L263 S264 P265 L270 L294	L241-V267 HydrophobicContact CB-CG2 4.28Å; L241-V267 HydrophobicContact CD2-CG2 4.47Å; L241-V267 HydrophobicContact CG-CG2 4.36Å; L241-V267 WeakPolarHBondContact O-CA 3.31Å; L241-V267 WeakPolarHBondContact O-CG2 3.35Å; L241-V267 PolarHBondContact O-N 2.85Å; L263-V267 HydrophobicContact CD1-CG2 3.85Å; L263-V267 HydrophobicContact CD2-CB 4.3Å; L263-V267 HydrophobicContact CD2-CG1 4.22Å; L263-V267 HydrophobicContact CD2-CG2 4.27Å; L263-V267 HydrophobicContact CG-CB 4.3Å; L263-V267 HydrophobicContact CG-CG2 3.8Å; S264-V267 WeakPolarHBondContact O-CB 3.47Å; S264-V267 WeakPolarHBondContact O-CG2 3.42Å; S264-V267 PolarHBondContact O-N 2.94Å; S264-V267 VanDerWaalsContact O-N 3.1Å; P265-V267 PolarHBondContact O-N 2.89Å; V267-L270 HydrophobicContact CG1-CB 4.09Å; V267-L294 HydrophobicContact CG1-CD2 4.04Å
268	T	98.7	Very high	97.3	Very high	28 Å²	28	32.6 Å²	32.6	17%	0.172	17%	0.173	C	C	.	.			trans	-114.8	-23.2	178.4	56	0	0	0	0	112.2	E242 S266 Q295 T296	E242-T268 PolarHBondContact O-N 3.2Å; E242-T268 PolarHBondContact O-OG1 2.79Å; S266-T268 PolarHBondContact O-N 3.13Å; T268-Q295 WeakPolarHBondContact O-CA 3.29Å; T268-Q295 PolarHBondContact O-N 2.96Å; T268-T296 PolarHBondContact O-N 2.94Å
269	H	98.8	Very high	97.2	Very high	40 Å²	40	30.7 Å²	30.7	19%	0.185	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	118.1	179	-60.4	64.4	0	0	0	109.6	E242 Q243 L244 T296 V379	E242-H269 PolarHBondContact O-N 2.86Å; E242-H269 VanDerWaalsContact O-N 3.09Å; Q243-H269 CarbonylContact C-O 3.47Å; Q243-H269 VanDerWaalsContact CA-O 3.29Å; Q243-H269 WeakPolarHBondContact CA-O 3.25Å; Q243-H269 HydrophobicContact CB-CB 4.14Å; Q243-H269 HydrophobicContact CG-CB 3.86Å; L244-H269 PolarHBondContact N-O 3.32Å; H269-T296 WeakPolarHBondContact CA-O 3.46Å; H269-T296 VanDerWaalsContact CD2-CB 3.5Å; H269-T296 WeakPolarHBondContact CD2-CB 3.46Å; H269-T296 PolarHBondContact CD2-OG1 2.63Å; H269-V379 HydrophobicContact CB-CG1 4.02Å; H269-V379 HydrophobicContact CB-CG2 4.27Å; H269-V379 WeakPolarHBondContact O-CG1 3.48Å
270	L	98.9	Very high	97.1	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.5	-174.1	-179.6	62.2	0	0	0	111	L244 L263 V267 L272 L287 L294 T296 L297 D298	L244-L270 HydrophobicContact CB-CD1 3.93Å; L244-L270 HydrophobicContact CD2-CD1 4.1Å; L244-L270 HydrophobicContact CG-CD1 4.15Å; L244-L270 WeakPolarHBondContact O-CA 3.47Å; L263-L270 HydrophobicContact CD2-CD1 4.08Å; L263-L270 HydrophobicContact CD2-CD2 3.69Å; V267-L270 HydrophobicContact CG1-CB 4.09Å; L270-L272 HydrophobicContact CD1-CD1 4.45Å; L270-L272 HydrophobicContact CD1-CD2 4.17Å; L270-L272 HydrophobicContact CD1-CG 3.94Å; L270-L272 HydrophobicContact CD2-CD1 3.67Å; L270-L272 HydrophobicContact CD2-CG 3.95Å; L270-L272 HydrophobicContact CG-CD1 4.14Å; L270-L272 HydrophobicContact CG-CG 3.83Å; L270-L287 HydrophobicContact CD2-CD1 3.5Å; L270-L287 VanDerWaalsContact CD2-CD1 3.5Å; L270-L287 HydrophobicContact CD2-CD2 3.79Å; L270-L287 HydrophobicContact CD2-CG 4.23Å; L270-L294 HydrophobicContact CB-CD2 3.83Å; L270-T296 PolarHBondContact N-O 2.86Å; L270-L297 HydrophobicContact CB-CD1 4.15Å; L270-L297 HydrophobicContact CD2-CD1 4.02Å; L270-L297 HydrophobicContact CG-CD1 4.23Å; L270-L297 WeakPolarHBondContact O-CA 3.29Å; L270-D298 PolarHBondContact O-N 2.87Å
271	N	98.8	Very high	97.1	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	111.5	168.7	-170.2	-15.7	0	0	0	110.7	L244 N245 I246 S247 S273 D298 S377 V379	L244-N271 PolarHBondContact O-N 3.03Å; N245-N271 HydrophobicContact CB-CB 4.27Å; I246-N271 PolarHBondContact N-O 2.78Å; I246-N271 VanDerWaalsContact N-O 3.13Å; S247-N271 WeakPolarHBondContact CB-OD1 3.49Å; S247-N271 PolarHBondContact N-O 3.22Å; N271-S273 WeakPolarHBondContact OD1-CB 3.33Å; N271-S273 PolarHBondContact OD1-N 3.28Å; N271-S273 PolarHBondContact OD1-OG 2.66Å; N271-S273 VanDerWaalsContact OD1-OG 3.07Å; N271-D298 HydrophobicContact CB-CB 4.1Å; N271-D298 PolarHBondContact ND2-OD2 3.37Å; N271-D298 VanDerWaalsContact ND2-OD2 3.09Å; N271-S377 VanDerWaalsContact ND2-CB 3.29Å; N271-S377 WeakPolarHBondContact ND2-CB 3.32Å; N271-S377 PolarHBondContact ND2-OG 3.18Å; N271-V379 HydrophobicContact CB-CB 4.09Å; N271-V379 HydrophobicContact CB-CG1 4.26Å; N271-V379 HydrophobicContact CB-CG2 4.32Å
272	L	98	Very high	97.1	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.187	C	C	.	.			trans	-118.2	28.4	175.5	-67.9	177.6	0	0	0	111.8	I246 L259 V260 L270 Y275 L287 D298 L299	I246-L272 HydrophobicContact CG2-CD2 3.44Å; I246-L272 VanDerWaalsContact CG2-CD2 3.44Å; L259-L272 HydrophobicContact CD1-CD2 3.45Å; L259-L272 VanDerWaalsContact CD1-CD2 3.45Å; L259-L272 HydrophobicContact CD2-CD1 3.97Å; L259-L272 HydrophobicContact CD2-CD2 3.56Å; L259-L272 HydrophobicContact CD2-CG 4.38Å; L259-L272 HydrophobicContact CG-CD2 4.18Å; V260-L272 HydrophobicContact CG1-CD1 4.48Å; L270-L272 HydrophobicContact CD1-CD1 4.45Å; L270-L272 HydrophobicContact CD1-CD2 4.17Å; L270-L272 HydrophobicContact CD1-CG 3.94Å; L270-L272 HydrophobicContact CD2-CD1 3.67Å; L270-L272 HydrophobicContact CD2-CG 3.95Å; L270-L272 HydrophobicContact CG-CD1 4.14Å; L270-L272 HydrophobicContact CG-CG 3.83Å; L272-Y275 HydrophobicContact CB-CD2 4.27Å; L272-Y275 HydrophobicContact CB-CE2 4.03Å; L272-Y275 HydrophobicContact CD2-CE2 3.81Å; L272-Y275 WeakPolarHBondContact O-CD2 3.36Å; L272-L287 HydrophobicContact CD1-CD2 4Å; L272-D298 CarbonylContact C-O 3.28Å; L272-D298 PolarHBondContact N-O 3.06Å; L272-L299 HydrophobicContact CB-CD2 4.31Å
273	S	98	Very high	97.1	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.035	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	151.7	179	72.5	0	0	0	0	112.6	S247 W248 N271 D298 S300	S247-S273 CarbonylContact C-O 3.57Å; S247-S273 VanDerWaalsContact CA-O 3.24Å; S247-S273 WeakPolarHBondContact CA-O 3.22Å; S247-S273 WeakPolarHBondContact CB-O 3.44Å; S247-S273 WeakPolarHBondContact CB-OG 3.19Å; W248-S273 PolarHBondContact N-O 3.32Å; W248-S273 PolarHBondContact NE1-OG 3.29Å; W248-S273 VanDerWaalsContact NE1-OG 3.14Å; N271-S273 WeakPolarHBondContact OD1-CB 3.33Å; N271-S273 PolarHBondContact OD1-N 3.28Å; N271-S273 PolarHBondContact OD1-OG 2.66Å; N271-S273 VanDerWaalsContact OD1-OG 3.07Å; S273-D298 PolarHBondContact N-O 3.11Å; S273-S300 CarbonylContact C-O 3.55Å; S273-S300 WeakPolarHBondContact CA-O 3.46Å; S273-S300 WeakPolarHBondContact CB-O 3.25Å
274	G	97.3	Very high	97.2	Very high	16 Å²	16	31.7 Å²	31.7	17%	0.165	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	100	-0.2	169.7	0	0	0	0	0	115.4	R276 S300	G274-R276 VanDerWaalsContact C-N 3.34Å; G274-R276 PolarHBondContact O-N 3.41Å; G274-S300 PolarHBondContact N-O 3.12Å
275	Y	96.7	Very high	97.3	Very high	8 Å²	8	35.2 Å²	35.2	3%	0.031	19%	0.192	C	C	.	.			trans	-94.1	54.8	-178.7	-54.3	-52.9	0	0	0	113.2	I246 C249 F251 V256 L272 D277 S278 L279	I246-Y275 PolarHBondContact O-OH 2.92Å; C249-Y275 HydrophobicContact CB-CE1 4.35Å; C249-Y275 WeakPolarHBondContact O-CE1 3.32Å; F251-Y275 HydrophobicContact CB-CD1 4.07Å; F251-Y275 HydrophobicContact CB-CE1 3.72Å; F251-Y275 AromaticContact CD2-CE1 3.59Å; F251-Y275 HydrophobicContact CD2-CE1 3.59Å; F251-Y275 AromaticContact CD2-CZ 3.57Å; F251-Y275 WeakPolarHBondContact CD2-OH 3.24Å; F251-Y275 HydrophobicContact CE2-CE1 4.41Å; F251-Y275 WeakPolarHBondContact CE2-OH 3.37Å; F251-Y275 AromaticContact CG-CE1 3.82Å; F251-Y275 HydrophobicContact CG-CE1 3.82Å; V256-Y275 HydrophobicContact CG2-CD2 4.36Å; V256-Y275 HydrophobicContact CG2-CG 4.25Å; L272-Y275 HydrophobicContact CB-CD2 4.27Å; L272-Y275 HydrophobicContact CB-CE2 4.03Å; L272-Y275 HydrophobicContact CD2-CE2 3.81Å; L272-Y275 WeakPolarHBondContact O-CD2 3.36Å; Y275-D277 PolarHBondContact O-N 3.22Å; Y275-S278 PolarHBondContact O-N 2.85Å; Y275-S278 VanDerWaalsContact O-N 3.09Å; Y275-L279 PolarHBondContact O-N 3.01Å
276	R	94.8	Very high	97.4	Very high	115 Å²	115	33.9 Å²	33.9	43%	0.434	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-35	-65.5	-171.8	-67.7	-179.1	178	-176.6	-0.6	114.2	G274 D301 T303	G274-R276 VanDerWaalsContact C-N 3.34Å; G274-R276 PolarHBondContact O-N 3.41Å; R276-D301 WeakPolarHBondContact CA-O 3.18Å; R276-D301 HydrophobicContact CG-CB 4.39Å; R276-D301 WeakPolarHBondContact CG-O 3.4Å; R276-D301 IonicContact CZ-OD1 2.78Å; R276-D301 PolarHBondContact N-O 2.92Å; R276-D301 IonicContact NE-OD1 2.79Å; R276-D301 IonicContact NH2-OD1 3.19Å; R276-D301 PolarHBondContact NH2-OD1 3.15Å; R276-T303 WeakPolarHBondContact CA-OG1 3.41Å; R276-T303 HydrophobicContact CB-CG2 4.2Å; R276-T303 HydrophobicContact CG-CG2 4.14Å; R276-T303 PolarHBondContact O-N 2.65Å; R276-T303 PolarHBondContact O-OG1 3.02Å
277	D	92.4	Very high	97.4	Very high	113 Å²	113	32 Å²	32	60%	0.604	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	3.3	-172.9	-48.9	-50.8	0	0	0	113.4	Y275 T303 L304	Y275-D277 PolarHBondContact O-N 3.22Å; D277-T303 PolarHBondContact OD1-OG1 3.13Å; D277-L304 WeakPolarHBondContact O-CD1 3.5Å
278	S	94.8	Very high	97.4	Very high	26 Å²	26	32.1 Å²	32.1	18%	0.182	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-28.8	-175.3	-67.3	0	0	0	0	113.6	Y275	Y275-S278 PolarHBondContact O-N 2.85Å; Y275-S278 VanDerWaalsContact O-N 3.09Å
279	L	96.5	Very high	97.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.185	C	C	.	.			trans	-95.8	112.3	179.5	-174.8	70.2	0	0	0	111.1	V256 Y275 D283 L299 S302	V256-L279 HydrophobicContact CG1-CB 4.39Å; V256-L279 HydrophobicContact CG1-CD1 3.46Å; V256-L279 VanDerWaalsContact CG1-CD1 3.46Å; Y275-L279 PolarHBondContact O-N 3.01Å; L279-D283 HydrophobicContact CD1-CB 3.68Å; L279-L299 HydrophobicContact CD2-CD2 3.81Å; L279-S302 WeakPolarHBondContact CD2-OG 3.23Å
280	A	96.1	Very high	97.3	Very high	25 Å²	25	36.5 Å²	36.5	21%	0.207	19%	0.188	C	C	.	.			trans	-108.3	172.9	-179.7	0	0	0	0	0	112.4	D282 D283 V284 L304	A280-D282 VanDerWaalsContact C-N 3.28Å; A280-D282 PolarHBondContact O-N 3.29Å; A280-D283 PolarHBondContact N-OD2 3.23Å; A280-D283 WeakPolarHBondContact O-CB 3.16Å; A280-D283 PolarHBondContact O-N 2.77Å; A280-V284 PolarHBondContact O-N 3.32Å; A280-L304 HydrophobicContact CB-CD1 4.48Å
281	L	97.2	Very high	97.3	Very high	44 Å²	44	36.5 Å²	36.5	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-59.1	-36.8	179.7	178.3	60.3	0	0	0	113.1	D283 V284 K285 D308 V312	L281-D283 VanDerWaalsContact C-N 3.33Å; L281-D283 PolarHBondContact O-N 2.95Å; L281-V284 WeakPolarHBondContact O-CB 3.43Å; L281-V284 PolarHBondContact O-N 3.43Å; L281-K285 WeakPolarHBondContact O-CG 3.17Å; L281-K285 PolarHBondContact O-N 2.78Å; L281-D308 HydrophobicContact CD2-CB 4.01Å; L281-V312 HydrophobicContact CD1-CG2 3.97Å
282	D	97.9	Very high	97.2	Very high	102 Å²	102	39.4 Å²	39.4	55%	0.545	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-34.1	179.9	-68.9	-30.4	0	0	0	112.3	A280 V284 K285 V286	A280-D282 VanDerWaalsContact C-N 3.28Å; A280-D282 PolarHBondContact O-N 3.29Å; D282-V284 VanDerWaalsContact C-N 3.3Å; D282-V284 PolarHBondContact O-N 2.73Å; D282-K285 WeakPolarHBondContact O-CB 3.2Å; D282-K285 PolarHBondContact O-N 2.79Å; D282-K285 IonicContact OD1-NZ 2.73Å; D282-K285 PolarHBondContact OD1-NZ 2.64Å; D282-V286 WeakPolarHBondContact O-CG2 3.33Å; D282-V286 PolarHBondContact O-N 2.65Å
283	D	98.1	Very high	97.2	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.07	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-39.7	173.5	-53.9	-57.5	0	0	0	110.8	V256 V260 L279 A280 L281 K285 V286 L287	V256-D283 HydrophobicContact CG1-CB 4.22Å; V260-D283 HydrophobicContact CG1-CB 4.29Å; V260-D283 HydrophobicContact CG2-CB 4.22Å; L279-D283 HydrophobicContact CD1-CB 3.68Å; A280-D283 PolarHBondContact N-OD2 3.23Å; A280-D283 WeakPolarHBondContact O-CB 3.16Å; A280-D283 PolarHBondContact O-N 2.77Å; L281-D283 VanDerWaalsContact C-N 3.33Å; L281-D283 PolarHBondContact O-N 2.95Å; D283-K285 VanDerWaalsContact C-N 3.34Å; D283-K285 PolarHBondContact O-N 2.61Å; D283-V286 PolarHBondContact O-N 3.17Å; D283-L287 VanDerWaalsContact O-CB 3.31Å; D283-L287 WeakPolarHBondContact O-CB 3.48Å; D283-L287 PolarHBondContact O-N 3.17Å
284	V	98.3	Very high	97.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-36.6	175	180	0	0	0	0	111.2	A280 L281 D282 L287 V288 L299 L305 V312 L313	A280-V284 PolarHBondContact O-N 3.32Å; L281-V284 WeakPolarHBondContact O-CB 3.43Å; L281-V284 PolarHBondContact O-N 3.43Å; D282-V284 VanDerWaalsContact C-N 3.3Å; D282-V284 PolarHBondContact O-N 2.73Å; V284-L287 PolarHBondContact O-N 3.27Å; V284-V288 HydrophobicContact CG1-CG2 4.3Å; V284-V288 WeakPolarHBondContact O-CB 3.46Å; V284-V288 VanDerWaalsContact O-CG2 3.29Å; V284-V288 WeakPolarHBondContact O-CG2 3.33Å; V284-V288 PolarHBondContact O-N 3.31Å; V284-L299 HydrophobicContact CG2-CD1 4.4Å; V284-L305 HydrophobicContact CG2-CD1 4.29Å; V284-L305 HydrophobicContact CG2-CD2 3.87Å; V284-V312 HydrophobicContact CG1-CG1 4.33Å; V284-L313 HydrophobicContact CG1-CD2 4.02Å; V284-L313 HydrophobicContact CG1-CG 4.45Å
285	K	98.5	Very high	97.3	Very high	81 Å²	81	44.5 Å²	44.5	35%	0.352	23%	0.228	S	C	.	.	H	α-helix	trans	-61.1	-51.5	174	-68.5	172.5	-170.2	157.5	0	111.1	L281 D282 D283 L287 V288 D289 V312	L281-K285 WeakPolarHBondContact O-CG 3.17Å; L281-K285 PolarHBondContact O-N 2.78Å; D282-K285 WeakPolarHBondContact O-CB 3.2Å; D282-K285 PolarHBondContact O-N 2.79Å; D282-K285 IonicContact OD1-NZ 2.73Å; D282-K285 PolarHBondContact OD1-NZ 2.64Å; D283-K285 VanDerWaalsContact C-N 3.34Å; D283-K285 PolarHBondContact O-N 2.61Å; K285-L287 VanDerWaalsContact C-N 3.29Å; K285-L287 PolarHBondContact O-N 3.18Å; K285-V288 PolarHBondContact O-N 2.64Å; K285-D289 VanDerWaalsContact O-CG 3.22Å; K285-D289 PolarHBondContact O-N 2.84Å; K285-V312 HydrophobicContact CB-CG1 4.34Å; K285-V312 HydrophobicContact CG-CB 4.48Å; K285-V312 HydrophobicContact CG-CG1 3.91Å; K285-V312 HydrophobicContact CG-CG2 3.7Å
286	V	98.6	Very high	97.4	Very high	47 Å²	47	44.8 Å²	44.8	29%	0.285	23%	0.231	S	C	.	.	H	α-helix	trans	-58.1	-44.5	177.6	175.5	0	0	0	0	110.7	V260 E261 D282 D283 V288 D289 R290	V260-V286 HydrophobicContact CB-CG1 4.29Å; V260-V286 HydrophobicContact CG2-CB 4.14Å; V260-V286 HydrophobicContact CG2-CG1 3.98Å; E261-V286 HydrophobicContact CG-CG1 4.21Å; D282-V286 WeakPolarHBondContact O-CG2 3.33Å; D282-V286 PolarHBondContact O-N 2.65Å; D283-V286 PolarHBondContact O-N 3.17Å; V286-V288 PolarHBondContact O-N 3.47Å; V286-D289 PolarHBondContact O-N 2.98Å; V286-R290 WeakPolarHBondContact O-CB 3.39Å; V286-R290 WeakPolarHBondContact O-CG 3.36Å; V286-R290 PolarHBondContact O-N 2.89Å
287	L	98.3	Very high	97.5	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-48.2	178	175.5	65.3	0	0	0	112.1	V260 L263 L270 L272 D283 V284 K285 D289 R290 C291 L294 L297	V260-L287 HydrophobicContact CB-CB 4.31Å; V260-L287 HydrophobicContact CG1-CB 4.15Å; L263-L287 HydrophobicContact CD2-CD1 3.73Å; L270-L287 HydrophobicContact CD2-CD1 3.5Å; L270-L287 VanDerWaalsContact CD2-CD1 3.5Å; L270-L287 HydrophobicContact CD2-CD2 3.79Å; L270-L287 HydrophobicContact CD2-CG 4.23Å; L272-L287 HydrophobicContact CD1-CD2 4Å; D283-L287 VanDerWaalsContact O-CB 3.31Å; D283-L287 WeakPolarHBondContact O-CB 3.48Å; D283-L287 PolarHBondContact O-N 3.17Å; V284-L287 PolarHBondContact O-N 3.27Å; K285-L287 VanDerWaalsContact C-N 3.29Å; K285-L287 PolarHBondContact O-N 3.18Å; L287-D289 VanDerWaalsContact C-N 3.34Å; L287-R290 PolarHBondContact O-N 2.8Å; L287-C291 HydrophobicContact CD1-CB 4.48Å; L287-C291 WeakPolarHBondContact O-CB 3.44Å; L287-C291 PolarHBondContact O-N 2.93Å; L287-L294 HydrophobicContact CD1-CD1 4.48Å; L287-L294 HydrophobicContact CG-CD1 4.27Å; L287-L297 HydrophobicContact CD2-CD1 4.03Å
288	V	98.1	Very high	97.8	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-35.7	-179.6	167.4	0	0	0	0	111.9	V284 K285 V286 R290 V312 L313 R315 L316	V284-V288 HydrophobicContact CG1-CG2 4.3Å; V284-V288 WeakPolarHBondContact O-CB 3.46Å; V284-V288 VanDerWaalsContact O-CG2 3.29Å; V284-V288 WeakPolarHBondContact O-CG2 3.33Å; V284-V288 PolarHBondContact O-N 3.31Å; K285-V288 PolarHBondContact O-N 2.64Å; V286-V288 PolarHBondContact O-N 3.47Å; V288-R290 VanDerWaalsContact C-N 3.33Å; V288-V312 HydrophobicContact CB-CG1 3.98Å; V288-V312 HydrophobicContact CG1-CG1 4.22Å; V288-V312 HydrophobicContact CG2-CG1 3.97Å; V288-L313 HydrophobicContact CG2-CD2 4.41Å; V288-R315 HydrophobicContact CG1-CB 3.8Å; V288-L316 HydrophobicContact CB-CD2 4.3Å; V288-L316 HydrophobicContact CG1-CD2 3.9Å; V288-L316 HydrophobicContact CG1-CG 4.12Å; V288-L316 HydrophobicContact CG2-CD1 3.95Å; V288-L316 HydrophobicContact CG2-CD2 4.08Å; V288-L316 HydrophobicContact CG2-CG 3.94Å
289	D	98.2	Very high	98	Very high	91 Å²	91	33.5 Å²	33.5	49%	0.487	18%	0.177	S	C	.	.	H	α-helix	trans	-62.7	-41.4	174.4	-70.9	-23.8	0	0	0	111.7	K285 V286 L287 R315	K285-D289 VanDerWaalsContact O-CG 3.22Å; K285-D289 PolarHBondContact O-N 2.84Å; V286-D289 PolarHBondContact O-N 2.98Å; L287-D289 VanDerWaalsContact C-N 3.34Å; D289-R315 IonicContact OD1-CZ 3.05Å; D289-R315 IonicContact OD1-NH1 2.67Å; D289-R315 PolarHBondContact OD1-NH1 3.38Å; D289-R315 IonicContact OD1-NH2 2.6Å; D289-R315 PolarHBondContact OD1-NH2 3.01Å
290	R	97.8	Very high	98.1	Very high	68 Å²	68	33.7 Å²	33.7	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-86	-31.6	-174.7	-66.1	-173.3	70	-97.7	-8.3	113.4	V260 E261 L263 P265 V286 L287 V288 P292	V260-R290 WeakPolarHBondContact O-CD 3.35Å; V260-R290 PolarHBondContact O-NH1 2.99Å; E261-R290 VanDerWaalsContact C-NH1 3.26Å; E261-R290 PolarHBondContact O-NE 2.84Å; E261-R290 PolarHBondContact O-NH1 2.95Å; E261-R290 PolarHBondContact O-NH2 3.29Å; L263-R290 PolarHBondContact O-NH1 2.63Å; L263-R290 PolarHBondContact O-NH2 3.17Å; P265-R290 WeakPolarHBondContact CA-O 3.46Å; P265-R290 VanDerWaalsContact CB-O 3.29Å; P265-R290 WeakPolarHBondContact CB-O 3.5Å; V286-R290 WeakPolarHBondContact O-CB 3.39Å; V286-R290 WeakPolarHBondContact O-CG 3.36Å; V286-R290 PolarHBondContact O-N 2.89Å; L287-R290 PolarHBondContact O-N 2.8Å; V288-R290 VanDerWaalsContact C-N 3.33Å; R290-P292 VanDerWaalsContact O-CD 3.28Å; R290-P292 WeakPolarHBondContact O-CD 3.42Å
291	C	98.1	Very high	98.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.			trans	-120.7	66.7	-176.9	-53.6	0	0	0	0	111.1	L287 D293 L294 L316	L287-C291 HydrophobicContact CD1-CB 4.48Å; L287-C291 WeakPolarHBondContact O-CB 3.44Å; L287-C291 PolarHBondContact O-N 2.93Å; C291-D293 PolarHBondContact O-N 3.35Å; C291-L294 HydrophobicContact CB-CD1 3.88Å; C291-L294 HydrophobicContact CB-CD2 4.48Å; C291-L294 HydrophobicContact CB-CG 3.83Å; C291-L294 WeakPolarHBondContact O-CG 3.43Å; C291-L294 PolarHBondContact O-N 2.8Å; C291-L316 WeakPolarHBondContact O-CD2 3.36Å
292	P	97.3	Very high	98.2	Very high	65 Å²	65	30.5 Å²	30.5	42%	0.422	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-18.6	-175.3	28.5	-36.7	0	0	0	113.6	R290	R290-P292 VanDerWaalsContact O-CD 3.28Å; R290-P292 WeakPolarHBondContact O-CD 3.42Å
293	D	97.9	Very high	98	Very high	65 Å²	65	26.5 Å²	26.5	35%	0.348	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	12.5	-175.2	-81	-7.3	0	0	0	114	C291 Q295 K318	C291-D293 PolarHBondContact O-N 3.35Å; D293-Q295 PolarHBondContact O-N 2.96Å; D293-K318 HydrophobicContact CB-CD 4.2Å; D293-K318 WeakPolarHBondContact OD1-CD 3.27Å; D293-K318 VanDerWaalsContact OD1-CE 3.26Å; D293-K318 WeakPolarHBondContact OD1-CE 3.4Å; D293-K318 IonicContact OD1-NZ 2.73Å; D293-K318 PolarHBondContact OD1-NZ 3.38Å; D293-K318 IonicContact OD2-NZ 2.87Å; D293-K318 PolarHBondContact OD2-NZ 3.49Å
294	L	98.7	Very high	97.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.			trans	-54.9	129.4	174.9	-78.5	168.7	0	0	0	111.7	V267 L270 L287 C291 L297 L316 K318 L319	V267-L294 HydrophobicContact CG1-CD2 4.04Å; L270-L294 HydrophobicContact CB-CD2 3.83Å; L287-L294 HydrophobicContact CD1-CD1 4.48Å; L287-L294 HydrophobicContact CG-CD1 4.27Å; C291-L294 HydrophobicContact CB-CD1 3.88Å; C291-L294 HydrophobicContact CB-CD2 4.48Å; C291-L294 HydrophobicContact CB-CG 3.83Å; C291-L294 WeakPolarHBondContact O-CG 3.43Å; C291-L294 PolarHBondContact O-N 2.8Å; L294-L297 HydrophobicContact CD1-CD1 4.41Å; L294-L297 HydrophobicContact CD1-CD2 4.41Å; L294-L316 HydrophobicContact CB-CD1 4Å; L294-L316 HydrophobicContact CB-CD2 4.14Å; L294-L316 HydrophobicContact CD1-CD1 4.07Å; L294-L316 HydrophobicContact CD1-CD2 4.37Å; L294-K318 CarbonylContact O-C 3.35Å; L294-K318 VanDerWaalsContact O-C 3.28Å; L294-L319 WeakPolarHBondContact O-CA 3.43Å; L294-L319 PolarHBondContact O-N 3.29Å
295	Q	98.5	Very high	97.8	Very high	65 Å²	65	29.1 Å²	29.1	30%	0.304	15%	0.151	S	C	.	.	S	Bend	trans	-109.7	-37.5	177.9	-62.4	177.2	20.1	0	0	111.7	T268 D293 K318 L320 H321	T268-Q295 WeakPolarHBondContact O-CA 3.29Å; T268-Q295 PolarHBondContact O-N 2.96Å; D293-Q295 PolarHBondContact O-N 2.96Å; Q295-K318 WeakPolarHBondContact CA-O 3.24Å; Q295-K318 HydrophobicContact CG-CB 4.31Å; Q295-L320 WeakPolarHBondContact O-CA 3.24Å; Q295-L320 PolarHBondContact O-N 3.04Å; Q295-H321 PolarHBondContact O-N 3.36Å
296	T	98.6	Very high	97.7	Very high	14 Å²	14	27.5 Å²	27.5	9%	0.086	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	124.6	174.3	-59.2	0	0	0	0	109	T268 H269 L270 H321 V379	T268-T296 PolarHBondContact O-N 2.94Å; H269-T296 WeakPolarHBondContact CA-O 3.46Å; H269-T296 VanDerWaalsContact CD2-CB 3.5Å; H269-T296 WeakPolarHBondContact CD2-CB 3.46Å; H269-T296 PolarHBondContact CD2-OG1 2.63Å; L270-T296 PolarHBondContact N-O 2.86Å; T296-H321 CarbonylContact C-O 3.15Å; T296-H321 WeakPolarHBondContact CA-O 3.42Å; T296-H321 HydrophobicContact CG2-CB 4.03Å; T296-V379 HydrophobicContact CG2-CG2 3.73Å
297	L	98.8	Very high	97.5	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.2	177.8	-179.5	58.9	0	0	0	110	L270 L287 L294 L299 L313 L316 L319 H321 L322 S323	L270-L297 HydrophobicContact CB-CD1 4.15Å; L270-L297 HydrophobicContact CD2-CD1 4.02Å; L270-L297 HydrophobicContact CG-CD1 4.23Å; L270-L297 WeakPolarHBondContact O-CA 3.29Å; L287-L297 HydrophobicContact CD2-CD1 4.03Å; L294-L297 HydrophobicContact CD1-CD1 4.41Å; L294-L297 HydrophobicContact CD1-CD2 4.41Å; L297-L299 HydrophobicContact CD1-CD2 3.97Å; L297-L299 HydrophobicContact CD1-CG 4.17Å; L297-L299 HydrophobicContact CD2-CD1 3.94Å; L297-L299 HydrophobicContact CD2-CG 4.21Å; L297-L299 HydrophobicContact CG-CD1 4.18Å; L297-L299 HydrophobicContact CG-CD2 4.25Å; L297-L299 HydrophobicContact CG-CG 3.9Å; L297-L313 HydrophobicContact CD2-CD2 3.64Å; L297-L316 HydrophobicContact CD2-CD1 4.05Å; L297-L319 HydrophobicContact CB-CD1 3.82Å; L297-H321 PolarHBondContact N-O 3.1Å; L297-L322 HydrophobicContact CB-CD1 4.37Å; L297-L322 HydrophobicContact CD2-CD1 4.49Å; L297-L322 HydrophobicContact CG-CD1 4.42Å; L297-L322 WeakPolarHBondContact O-CA 3.48Å; L297-S323 PolarHBondContact O-N 3.24Å
298	D	98.8	Very high	97.3	Very high	16 Å²	16	31.5 Å²	31.5	9%	0.086	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	113.8	175.9	-173.8	-7.3	0	0	0	109.6	L270 N271 L272 S273 S300 S323	L270-D298 PolarHBondContact O-N 2.87Å; N271-D298 HydrophobicContact CB-CB 4.1Å; N271-D298 PolarHBondContact ND2-OD2 3.37Å; N271-D298 VanDerWaalsContact ND2-OD2 3.09Å; L272-D298 CarbonylContact C-O 3.28Å; L272-D298 PolarHBondContact N-O 3.06Å; S273-D298 PolarHBondContact N-O 3.11Å; D298-S300 VanDerWaalsContact OD1-CB 3.29Å; D298-S300 WeakPolarHBondContact OD1-CB 3.45Å; D298-S300 PolarHBondContact OD1-N 2.83Å; D298-S300 PolarHBondContact OD1-OG 3.42Å; D298-S323 WeakPolarHBondContact OD1-CB 3.22Å
299	L	98.4	Very high	97.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.			trans	-117.8	21.7	178.7	-60.2	174.3	0	0	0	110.7	L272 L279 V284 L297 S302 L305 L313 S323 L324 C327	L272-L299 HydrophobicContact CB-CD2 4.31Å; L279-L299 HydrophobicContact CD2-CD2 3.81Å; V284-L299 HydrophobicContact CG2-CD1 4.4Å; L297-L299 HydrophobicContact CD1-CD2 3.97Å; L297-L299 HydrophobicContact CD1-CG 4.17Å; L297-L299 HydrophobicContact CD2-CD1 3.94Å; L297-L299 HydrophobicContact CD2-CG 4.21Å; L297-L299 HydrophobicContact CG-CD1 4.18Å; L297-L299 HydrophobicContact CG-CD2 4.25Å; L297-L299 HydrophobicContact CG-CG 3.9Å; L299-S302 VanDerWaalsContact O-CB 3.24Å; L299-S302 WeakPolarHBondContact O-CB 3.34Å; L299-S302 PolarHBondContact O-N 2.92Å; L299-S302 PolarHBondContact O-OG 3.38Å; L299-L305 HydrophobicContact CB-CD1 4.08Å; L299-L305 HydrophobicContact CD1-CD1 3.95Å; L299-L313 HydrophobicContact CD1-CD2 4.32Å; L299-S323 PolarHBondContact N-O 2.8Å; L299-L324 HydrophobicContact CB-CD2 4.13Å; L299-L324 HydrophobicContact CD1-CD2 4.37Å; L299-C327 PolarHBondContact O-SG 3.27Å; L299-C327 VanDerWaalsContact O-SG 3.36Å
300	S	98.4	Very high	97.1	Very high	6 Å²	6	27.8 Å²	27.8	4%	0.042	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	150.9	-178.5	-49.7	0	0	0	0	111.8	S273 G274 D298 S302 S323 S325	S273-S300 CarbonylContact C-O 3.55Å; S273-S300 WeakPolarHBondContact CA-O 3.46Å; S273-S300 WeakPolarHBondContact CB-O 3.25Å; G274-S300 PolarHBondContact N-O 3.12Å; D298-S300 VanDerWaalsContact OD1-CB 3.29Å; D298-S300 WeakPolarHBondContact OD1-CB 3.45Å; D298-S300 PolarHBondContact OD1-N 2.83Å; D298-S300 PolarHBondContact OD1-OG 3.42Å; S300-S302 PolarHBondContact O-N 3.13Å; S300-S323 PolarHBondContact N-O 3.04Å; S300-S323 PolarHBondContact OG-OG 3.23Å; S300-S325 CarbonylContact C-O 3.29Å; S300-S325 WeakPolarHBondContact CA-O 3.32Å; S300-S325 WeakPolarHBondContact CB-O 3.42Å
301	D	97.6	Very high	97	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	30.5	-178.3	-65.3	-100.7	0	0	0	113.7	W248 R276 S325 R326	W248-D301 HydrophobicContact CH2-CB 3.88Å; W248-D301 VanDerWaalsContact CH2-CG 3.4Å; W248-D301 WeakPolarHBondContact CH2-OD1 3.43Å; W248-D301 HydrophobicContact CZ2-CB 4.06Å; W248-D301 VanDerWaalsContact CZ2-OD2 3.31Å; W248-D301 WeakPolarHBondContact CZ2-OD2 3.24Å; R276-D301 WeakPolarHBondContact CA-O 3.18Å; R276-D301 HydrophobicContact CG-CB 4.39Å; R276-D301 WeakPolarHBondContact CG-O 3.4Å; R276-D301 IonicContact CZ-OD1 2.78Å; R276-D301 PolarHBondContact N-O 2.92Å; R276-D301 IonicContact NE-OD1 2.79Å; R276-D301 IonicContact NH2-OD1 3.19Å; R276-D301 PolarHBondContact NH2-OD1 3.15Å; D301-S325 PolarHBondContact N-O 2.95Å; D301-R326 VanDerWaalsContact CG-NE 3.28Å; D301-R326 IonicContact OD1-CZ 2.76Å; D301-R326 IonicContact OD1-NE 2.75Å; D301-R326 PolarHBondContact OD1-NE 3.18Å; D301-R326 VanDerWaalsContact OD1-NE 3.12Å; D301-R326 IonicContact OD2-CZ 3.97Å; D301-R326 IonicContact OD2-NE 2.82Å; D301-R326 PolarHBondContact OD2-NE 3.08Å; D301-R326 IonicContact OD2-NH2 3.28Å; D301-R326 PolarHBondContact OD2-NH2 3.26Å
302	S	96.9	Very high	96.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.17	C	C	.	.			trans	-99.1	87.2	171.7	-53.3	0	0	0	0	109.4	L279 L299 S300 L304 L305 C327	L279-S302 WeakPolarHBondContact CD2-OG 3.23Å; L299-S302 VanDerWaalsContact O-CB 3.24Å; L299-S302 WeakPolarHBondContact O-CB 3.34Å; L299-S302 PolarHBondContact O-N 2.92Å; L299-S302 PolarHBondContact O-OG 3.38Å; S300-S302 PolarHBondContact O-N 3.13Å; S302-L304 VanDerWaalsContact C-N 3.27Å; S302-L304 PolarHBondContact O-N 3.04Å; S302-L305 PolarHBondContact O-N 2.04Å; S302-C327 PolarHBondContact O-SG 3.35Å
303	T	95.1	Very high	96.9	Very high	19 Å²	19	27.1 Å²	27.1	12%	0.117	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-22.8	-168.6	47.9	0	0	0	0	113.5	R276 D277 L305 Y328 H329	R276-T303 WeakPolarHBondContact CA-OG1 3.41Å; R276-T303 HydrophobicContact CB-CG2 4.2Å; R276-T303 HydrophobicContact CG-CG2 4.14Å; R276-T303 PolarHBondContact O-N 2.65Å; R276-T303 PolarHBondContact O-OG1 3.02Å; D277-T303 PolarHBondContact OD1-OG1 3.13Å; T303-L305 VanDerWaalsContact C-N 3.28Å; T303-L305 PolarHBondContact O-N 3.49Å; T303-Y328 HydrophobicContact CG2-CD2 3.94Å; T303-Y328 HydrophobicContact CG2-CE2 4.35Å; T303-H329 PolarHBondContact O-CD2 2.71Å
304	L	95.6	Very high	96.9	Very high	68 Å²	68	28.2 Å²	28.2	36%	0.356	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.3	175.4	-60.5	-179.5	0	0	0	114	D277 A280 S302	D277-L304 WeakPolarHBondContact O-CD1 3.5Å; A280-L304 HydrophobicContact CB-CD1 4.48Å; S302-L304 VanDerWaalsContact C-N 3.27Å; S302-L304 PolarHBondContact O-N 3.04Å
305	L	96.5	Very high	96.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.173	C	C	.	.			trans	-81.4	130.5	179.5	-62.3	-175.2	0	0	0	111.2	V284 L299 S302 T303	V284-L305 HydrophobicContact CG2-CD1 4.29Å; V284-L305 HydrophobicContact CG2-CD2 3.87Å; L299-L305 HydrophobicContact CB-CD1 4.08Å; L299-L305 HydrophobicContact CD1-CD1 3.95Å; S302-L305 PolarHBondContact O-N 2.04Å; T303-L305 VanDerWaalsContact C-N 3.28Å; T303-L305 PolarHBondContact O-N 3.49Å
306	T	95.6	Very high	96.7	Very high	46 Å²	46	30.8 Å²	30.8	28%	0.282	16%	0.159	S	C	.	.			trans	-113.9	-179	174.7	66	0	0	0	0	110.4	D308 S309 H329	T306-D308 PolarHBondContact O-N 3.45Å; T306-D308 VanDerWaalsContact O-N 3.13Å; T306-D308 PolarHBondContact OG1-N 3.17Å; T306-D308 PolarHBondContact OG1-OD2 3.08Å; T306-S309 WeakPolarHBondContact O-CB 3.48Å; T306-S309 PolarHBondContact O-N 3.04Å; T306-S309 VanDerWaalsContact O-N 3.13Å; T306-S309 PolarHBondContact O-OG 3.38Å; T306-H329 HydrophobicContact CG2-CB 4.18Å
307	A	94.6	Very high	96.6	Very high	36 Å²	36	37 Å²	37	30%	0.298	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.4	174.7	0	0	0	0	0	114	S309 F310 A334	A307-S309 PolarHBondContact O-N 3.37Å; A307-F310 HydrophobicContact CB-CD2 4.37Å; A307-F310 HydrophobicContact CB-CE2 4.31Å; A307-F310 VanDerWaalsContact O-CB 3.28Å; A307-F310 WeakPolarHBondContact O-CB 3.5Å; A307-F310 VanDerWaalsContact O-CG 3.26Å; A307-F310 WeakPolarHBondContact O-CG 3.14Å; A307-F310 PolarHBondContact O-N 3.28Å; A307-A334 HydrophobicContact CB-CB 3.57Å
308	D	94.8	Very high	96.6	Very high	96 Å²	96	41.7 Å²	41.7	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.6	177	-61.3	-39.9	0	0	0	112.5	L281 T306 F310 L311	L281-D308 HydrophobicContact CD2-CB 4.01Å; T306-D308 PolarHBondContact O-N 3.45Å; T306-D308 VanDerWaalsContact O-N 3.13Å; T306-D308 PolarHBondContact OG1-N 3.17Å; T306-D308 PolarHBondContact OG1-OD2 3.08Å; D308-F310 PolarHBondContact O-N 3.28Å; D308-L311 WeakPolarHBondContact O-CB 3.35Å; D308-L311 PolarHBondContact O-N 2.72Å
309	S	95.5	Very high	96.6	Very high	1 Å²	1	41 Å²	41	1%	0.007	20%	0.201	C	C	.	.	H	α-helix	trans	-58.4	-26.1	173.5	65.6	0	0	0	0	113	T306 A307 L311 V312 L313	T306-S309 WeakPolarHBondContact O-CB 3.48Å; T306-S309 PolarHBondContact O-N 3.04Å; T306-S309 VanDerWaalsContact O-N 3.13Å; T306-S309 PolarHBondContact O-OG 3.38Å; A307-S309 PolarHBondContact O-N 3.37Å; S309-L311 VanDerWaalsContact C-N 3.27Å; S309-L311 PolarHBondContact O-N 3.47Å; S309-V312 WeakPolarHBondContact O-CB 3.17Å; S309-V312 PolarHBondContact O-N 3.35Å; S309-L313 WeakPolarHBondContact O-CG 3.38Å; S309-L313 PolarHBondContact O-N 3.26Å
310	F	95.7	Very high	96.5	Very high	15 Å²	15	44.4 Å²	44.4	7%	0.066	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-29.8	-178.4	-57.3	-12.7	0	0	0	112.2	A307 D308 V312 L313 K314 L324 I330 A334 L335 L338	A307-F310 HydrophobicContact CB-CD2 4.37Å; A307-F310 HydrophobicContact CB-CE2 4.31Å; A307-F310 VanDerWaalsContact O-CB 3.28Å; A307-F310 WeakPolarHBondContact O-CB 3.5Å; A307-F310 VanDerWaalsContact O-CG 3.26Å; A307-F310 WeakPolarHBondContact O-CG 3.14Å; A307-F310 PolarHBondContact O-N 3.28Å; D308-F310 PolarHBondContact O-N 3.28Å; F310-V312 PolarHBondContact O-N 3.25Å; F310-L313 HydrophobicContact CD1-CD1 4.32Å; F310-L313 PolarHBondContact O-N 3.42Å; F310-K314 WeakPolarHBondContact O-CB 3.47Å; F310-K314 PolarHBondContact O-N 3.22Å; F310-L324 HydrophobicContact CE1-CD1 3.57Å; F310-L324 HydrophobicContact CZ-CD1 4.1Å; F310-I330 HydrophobicContact CE1-CD1 4.09Å; F310-I330 HydrophobicContact CE2-CG2 4.33Å; F310-I330 HydrophobicContact CZ-CD1 4.18Å; F310-I330 HydrophobicContact CZ-CG2 3.65Å; F310-A334 HydrophobicContact CD2-CB 4.39Å; F310-A334 HydrophobicContact CE2-CB 3.75Å; F310-A334 VanDerWaalsContact CE2-O 3.3Å; F310-A334 WeakPolarHBondContact CE2-O 3.35Å; F310-L335 HydrophobicContact CZ-CD2 4.03Å; F310-L338 HydrophobicContact CB-CD1 4.05Å; F310-L338 HydrophobicContact CD1-CD1 3.67Å; F310-L338 HydrophobicContact CD2-CB 4.17Å; F310-L338 HydrophobicContact CD2-CD1 4.04Å; F310-L338 HydrophobicContact CE1-CD1 4.08Å; F310-L338 HydrophobicContact CE1-CD2 4.1Å; F310-L338 HydrophobicContact CE2-CB 4.1Å; F310-L338 HydrophobicContact CE2-CD1 4.4Å; F310-L338 HydrophobicContact CE2-CD2 4.44Å; F310-L338 HydrophobicContact CG-CD1 3.66Å; F310-L338 HydrophobicContact CZ-CD1 4.41Å; F310-L338 HydrophobicContact CZ-CD2 4.04Å
311	L	95.4	Very high	96.5	Very high	107 Å²	107	44.9 Å²	44.9	56%	0.56	22%	0.221	S	C	*	.	H	α-helix	trans	-65.1	-28.7	174.3	-60.1	177.7	0	0	0	112.2	D308 S309 K314	D308-L311 WeakPolarHBondContact O-CB 3.35Å; D308-L311 PolarHBondContact O-N 2.72Å; S309-L311 VanDerWaalsContact C-N 3.27Å; S309-L311 PolarHBondContact O-N 3.47Å; L311-K314 VanDerWaalsContact O-CE 3.27Å; L311-K314 WeakPolarHBondContact O-CE 3.23Å; L311-K314 WeakPolarHBondContact O-CG 3.37Å
312	V	97.3	Very high	96.5	Very high	13 Å²	13	44.8 Å²	44.8	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-85.6	-50	176.5	-174.2	0	0	0	0	109.7	L281 V284 K285 V288 S309 F310 K314 R315	L281-V312 HydrophobicContact CD1-CG2 3.97Å; V284-V312 HydrophobicContact CG1-CG1 4.33Å; K285-V312 HydrophobicContact CB-CG1 4.34Å; K285-V312 HydrophobicContact CG-CB 4.48Å; K285-V312 HydrophobicContact CG-CG1 3.91Å; K285-V312 HydrophobicContact CG-CG2 3.7Å; V288-V312 HydrophobicContact CB-CG1 3.98Å; V288-V312 HydrophobicContact CG1-CG1 4.22Å; V288-V312 HydrophobicContact CG2-CG1 3.97Å; S309-V312 WeakPolarHBondContact O-CB 3.17Å; S309-V312 PolarHBondContact O-N 3.35Å; F310-V312 PolarHBondContact O-N 3.25Å; V312-K314 VanDerWaalsContact C-N 3.28Å; V312-K314 PolarHBondContact O-N 3.22Å; V312-R315 VanDerWaalsContact O-CB 3.22Å; V312-R315 WeakPolarHBondContact O-CB 3.32Å; V312-R315 WeakPolarHBondContact O-CD 3.25Å; V312-R315 VanDerWaalsContact O-CG 3.25Å; V312-R315 WeakPolarHBondContact O-CG 3.43Å; V312-R315 PolarHBondContact O-N 3.33Å
313	L	97.4	Very high	96.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-31.2	-176.3	-68.4	171.5	0	0	0	113.2	V284 V288 L297 L299 S309 F310 R315 L316 L322 I342	V284-L313 HydrophobicContact CG1-CD2 4.02Å; V284-L313 HydrophobicContact CG1-CG 4.45Å; V288-L313 HydrophobicContact CG2-CD2 4.41Å; L297-L313 HydrophobicContact CD2-CD2 3.64Å; L299-L313 HydrophobicContact CD1-CD2 4.32Å; S309-L313 WeakPolarHBondContact O-CG 3.38Å; S309-L313 PolarHBondContact O-N 3.26Å; F310-L313 HydrophobicContact CD1-CD1 4.32Å; F310-L313 PolarHBondContact O-N 3.42Å; L313-R315 PolarHBondContact O-N 2.88Å; L313-L316 HydrophobicContact CD2-CD1 4.26Å; L313-L316 WeakPolarHBondContact O-CB 3.3Å; L313-L316 PolarHBondContact O-N 3.12Å; L313-L322 HydrophobicContact CD1-CD1 4.34Å; L313-L322 HydrophobicContact CD1-CD2 4.04Å; L313-I342 HydrophobicContact CB-CD1 4.02Å
314	K	96.4	Very high	96.7	Very high	87 Å²	87	44.2 Å²	44.2	38%	0.378	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-12.8	174.9	73.5	-178.1	-177.8	-177.6	0	114.8	F310 L311 V312 L316 K317 I342	F310-K314 WeakPolarHBondContact O-CB 3.47Å; F310-K314 PolarHBondContact O-N 3.22Å; L311-K314 VanDerWaalsContact O-CE 3.27Å; L311-K314 WeakPolarHBondContact O-CE 3.23Å; L311-K314 WeakPolarHBondContact O-CG 3.37Å; V312-K314 VanDerWaalsContact C-N 3.28Å; V312-K314 PolarHBondContact O-N 3.22Å; K314-L316 VanDerWaalsContact C-N 3.31Å; K314-K317 PolarHBondContact O-NZ 2.82Å; K314-I342 HydrophobicContact CB-CG1 4.23Å
315	R	96.9	Very high	96.8	Very high	119 Å²	119	41.3 Å²	41.3	45%	0.449	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-24.2	174.9	-60.2	168.7	60.5	-156.4	-4.6	111.7	V288 D289 V312 L313 K317	V288-R315 HydrophobicContact CG1-CB 3.8Å; D289-R315 IonicContact OD1-CZ 3.05Å; D289-R315 IonicContact OD1-NH1 2.67Å; D289-R315 PolarHBondContact OD1-NH1 3.38Å; D289-R315 IonicContact OD1-NH2 2.6Å; D289-R315 PolarHBondContact OD1-NH2 3.01Å; V312-R315 VanDerWaalsContact O-CB 3.22Å; V312-R315 WeakPolarHBondContact O-CB 3.32Å; V312-R315 WeakPolarHBondContact O-CD 3.25Å; V312-R315 VanDerWaalsContact O-CG 3.25Å; V312-R315 WeakPolarHBondContact O-CG 3.43Å; V312-R315 PolarHBondContact O-N 3.33Å; L313-R315 PolarHBondContact O-N 2.88Å; R315-K317 PolarHBondContact O-N 2.78Å
316	L	97.6	Very high	96.8	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.			trans	-75.4	88	175.8	-60.6	178.7	0	0	0	110.6	V288 C291 L294 L297 L313 K314 K318 L319	V288-L316 HydrophobicContact CB-CD2 4.3Å; V288-L316 HydrophobicContact CG1-CD2 3.9Å; V288-L316 HydrophobicContact CG1-CG 4.12Å; V288-L316 HydrophobicContact CG2-CD1 3.95Å; V288-L316 HydrophobicContact CG2-CD2 4.08Å; V288-L316 HydrophobicContact CG2-CG 3.94Å; C291-L316 WeakPolarHBondContact O-CD2 3.36Å; L294-L316 HydrophobicContact CB-CD1 4Å; L294-L316 HydrophobicContact CB-CD2 4.14Å; L294-L316 HydrophobicContact CD1-CD1 4.07Å; L294-L316 HydrophobicContact CD1-CD2 4.37Å; L297-L316 HydrophobicContact CD2-CD1 4.05Å; L313-L316 HydrophobicContact CD2-CD1 4.26Å; L313-L316 WeakPolarHBondContact O-CB 3.3Å; L313-L316 PolarHBondContact O-N 3.12Å; K314-L316 VanDerWaalsContact C-N 3.31Å; L316-K318 PolarHBondContact O-N 2.8Å; L316-L319 HydrophobicContact CB-CB 3.85Å; L316-L319 HydrophobicContact CB-CD2 4.46Å; L316-L319 HydrophobicContact CD1-CD1 4.28Å; L316-L319 HydrophobicContact CD1-CD2 4.24Å; L316-L319 WeakPolarHBondContact O-CB 3.42Å; L316-L319 PolarHBondContact O-N 3.37Å
317	K	96.4	Very high	96.8	Very high	146 Å²	146	43.9 Å²	43.9	64%	0.635	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.7	-174.5	-57.8	-50.6	-176.4	-172.6	0	114.5	K314 R315 S344	K314-K317 PolarHBondContact O-NZ 2.82Å; R315-K317 PolarHBondContact O-N 2.78Å; K317-S344 VanDerWaalsContact O-CB 3.31Å; K317-S344 WeakPolarHBondContact O-CB 3.43Å; K317-S344 PolarHBondContact O-OG 3.2Å
318	K	97.8	Very high	96.8	Very high	99 Å²	99	47.7 Å²	47.7	43%	0.43	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	3.6	178.4	-63.1	-178.7	-176.4	164	0	112.7	D293 L294 Q295 L316 L320	D293-K318 HydrophobicContact CB-CD 4.2Å; D293-K318 WeakPolarHBondContact OD1-CD 3.27Å; D293-K318 VanDerWaalsContact OD1-CE 3.26Å; D293-K318 WeakPolarHBondContact OD1-CE 3.4Å; D293-K318 IonicContact OD1-NZ 2.73Å; D293-K318 PolarHBondContact OD1-NZ 3.38Å; D293-K318 IonicContact OD2-NZ 2.87Å; D293-K318 PolarHBondContact OD2-NZ 3.49Å; L294-K318 CarbonylContact O-C 3.35Å; L294-K318 VanDerWaalsContact O-C 3.28Å; Q295-K318 WeakPolarHBondContact CA-O 3.24Å; Q295-K318 HydrophobicContact CG-CB 4.31Å; L316-K318 PolarHBondContact O-N 2.8Å; K318-L320 WeakPolarHBondContact O-CG 3.04Å; K318-L320 PolarHBondContact O-N 3.16Å
319	L	98.3	Very high	96.8	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	21%	0.214	C	C	.	.			trans	-68.8	116.1	-175.7	-170	67.5	0	0	0	110.6	L294 L297 L316 L322 I342 S344 L345	L294-L319 WeakPolarHBondContact O-CA 3.43Å; L294-L319 PolarHBondContact O-N 3.29Å; L297-L319 HydrophobicContact CB-CD1 3.82Å; L316-L319 HydrophobicContact CB-CB 3.85Å; L316-L319 HydrophobicContact CB-CD2 4.46Å; L316-L319 HydrophobicContact CD1-CD1 4.28Å; L316-L319 HydrophobicContact CD1-CD2 4.24Å; L316-L319 WeakPolarHBondContact O-CB 3.42Å; L316-L319 PolarHBondContact O-N 3.37Å; L319-L322 HydrophobicContact CD2-CB 4.15Å; L319-L322 HydrophobicContact CD2-CD1 4.49Å; L319-L322 HydrophobicContact CD2-CD2 4.29Å; L319-I342 HydrophobicContact CB-CG2 4.38Å; L319-I342 HydrophobicContact CD2-CD1 4.22Å; L319-I342 HydrophobicContact CD2-CG2 4.49Å; L319-S344 CarbonylContact O-C 3.59Å; L319-S344 VanDerWaalsContact O-CB 3.3Å; L319-S344 WeakPolarHBondContact O-CB 3.28Å; L319-S344 PolarHBondContact O-OG 3.18Å; L319-L345 HydrophobicContact CD2-CD1 4.4Å; L319-L345 HydrophobicContact CG-CD1 4.21Å; L319-L345 WeakPolarHBondContact O-CA 3.38Å; L319-L345 PolarHBondContact O-N 3.4Å
320	L	97.4	Very high	96.7	Very high	73 Å²	73	48.5 Å²	48.5	38%	0.382	22%	0.215	S	C	.	.			trans	-105	-33.7	-179.5	-59	-180	0	0	0	111.8	Q295 K318 S344 R346 F347	Q295-L320 WeakPolarHBondContact O-CA 3.24Å; Q295-L320 PolarHBondContact O-N 3.04Å; K318-L320 WeakPolarHBondContact O-CG 3.04Å; K318-L320 PolarHBondContact O-N 3.16Å; L320-S344 WeakPolarHBondContact CD2-O 3.47Å; L320-R346 HydrophobicContact CD2-CG 4.39Å; L320-R346 WeakPolarHBondContact O-CA 3.28Å; L320-R346 PolarHBondContact O-N 3.02Å; L320-F347 PolarHBondContact O-N 3.37Å
321	H	97.9	Very high	96.4	Very high	15 Å²	15	54.5 Å²	54.5	7%	0.069	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	122	-177.6	-178.2	-169.9	0	0	0	110.2	Q295 T296 L297 F347 D349	Q295-H321 PolarHBondContact O-N 3.36Å; T296-H321 CarbonylContact C-O 3.15Å; T296-H321 WeakPolarHBondContact CA-O 3.42Å; T296-H321 HydrophobicContact CG2-CB 4.03Å; L297-H321 PolarHBondContact N-O 3.1Å; H321-F347 WeakPolarHBondContact CA-O 3.12Å; H321-F347 HydrophobicContact CB-CB 4.02Å; H321-F347 HydrophobicContact CB-CD2 4.43Å; H321-D349 IonicContact CD2-OD2 3.7Å; H321-D349 IonicContact CE1-OD2 3.5Å; H321-D349 PolarHBondContact CE1-OD2 3.35Å; H321-D349 IonicContact NE2-OD2 2.67Å; H321-D349 PolarHBondContact NE2-OD2 2.82Å
322	L	98	Very high	96.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.5	174.6	178.7	58.1	0	0	0	109.3	L297 L313 L319 L324 L338 L345 F347 L348 D349	L297-L322 HydrophobicContact CB-CD1 4.37Å; L297-L322 HydrophobicContact CD2-CD1 4.49Å; L297-L322 HydrophobicContact CG-CD1 4.42Å; L297-L322 WeakPolarHBondContact O-CA 3.48Å; L313-L322 HydrophobicContact CD1-CD1 4.34Å; L313-L322 HydrophobicContact CD1-CD2 4.04Å; L319-L322 HydrophobicContact CD2-CB 4.15Å; L319-L322 HydrophobicContact CD2-CD1 4.49Å; L319-L322 HydrophobicContact CD2-CD2 4.29Å; L322-L324 HydrophobicContact CD1-CD2 4.37Å; L322-L324 HydrophobicContact CD1-CG 4.24Å; L322-L324 HydrophobicContact CD2-CD1 3.96Å; L322-L324 HydrophobicContact CD2-CG 4.32Å; L322-L324 HydrophobicContact CG-CD1 4.21Å; L322-L324 HydrophobicContact CG-CG 4.05Å; L322-L338 HydrophobicContact CD2-CD1 4.37Å; L322-L338 HydrophobicContact CD2-CD2 4.04Å; L322-L345 HydrophobicContact CB-CD1 3.68Å; L322-F347 PolarHBondContact N-O 3.39Å; L322-L348 HydrophobicContact CB-CD1 4.42Å; L322-L348 HydrophobicContact CG-CD1 4.45Å; L322-L348 WeakPolarHBondContact O-CA 3.13Å; L322-D349 PolarHBondContact O-N 3.28Å
323	S	98.1	Very high	95.6	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127	168.9	-173.3	0	0	0	0	110.7	L297 D298 L299 S300 S325 D349	L297-S323 PolarHBondContact O-N 3.24Å; D298-S323 WeakPolarHBondContact OD1-CB 3.22Å; L299-S323 PolarHBondContact N-O 2.8Å; S300-S323 PolarHBondContact N-O 3.04Å; S300-S323 PolarHBondContact OG-OG 3.23Å; S323-S325 PolarHBondContact OG-OG 3.11Å; S323-D349 CarbonylContact C-O 3.17Å; S323-D349 WeakPolarHBondContact CA-O 3.16Å; S323-D349 PolarHBondContact OG-O 3.2Å
324	L	97.2	Very high	95.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.261	C	S	.	.			trans	-127.5	22.8	177.1	-65.6	168.8	0	0	0	110.5	L299 F310 L322 R326 C327 I330 L338 D349 V350 L353	L299-L324 HydrophobicContact CB-CD2 4.13Å; L299-L324 HydrophobicContact CD1-CD2 4.37Å; F310-L324 HydrophobicContact CE1-CD1 3.57Å; F310-L324 HydrophobicContact CZ-CD1 4.1Å; L322-L324 HydrophobicContact CD1-CD2 4.37Å; L322-L324 HydrophobicContact CD1-CG 4.24Å; L322-L324 HydrophobicContact CD2-CD1 3.96Å; L322-L324 HydrophobicContact CD2-CG 4.32Å; L322-L324 HydrophobicContact CG-CD1 4.21Å; L322-L324 HydrophobicContact CG-CG 4.05Å; L324-R326 PolarHBondContact O-N 3.49Å; L324-C327 WeakPolarHBondContact O-CB 3.42Å; L324-C327 PolarHBondContact O-N 3.46Å; L324-C327 VanDerWaalsContact O-N 3.15Å; L324-C327 PolarHBondContact O-SG 3.29Å; L324-C327 VanDerWaalsContact O-SG 3.38Å; L324-I330 HydrophobicContact CB-CD1 4.43Å; L324-I330 HydrophobicContact CD1-CD1 4.11Å; L324-I330 HydrophobicContact CD2-CD1 4.26Å; L324-L338 HydrophobicContact CD1-CD2 4.05Å; L324-D349 PolarHBondContact N-O 3.03Å; L324-V350 HydrophobicContact CB-CG1 4.34Å; L324-L353 VanDerWaalsContact O-CD1 3.27Å; L324-L353 WeakPolarHBondContact O-CD1 3.21Å
325	S	97.4	Very high	95	Very high	7 Å²	7	51.5 Å²	51.5	5%	0.049	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	134.9	-178.6	-61	0	0	0	0	110.4	S300 D301 S323 C327 D349 F351	S300-S325 CarbonylContact C-O 3.29Å; S300-S325 WeakPolarHBondContact CA-O 3.32Å; S300-S325 WeakPolarHBondContact CB-O 3.42Å; D301-S325 PolarHBondContact N-O 2.95Å; S323-S325 PolarHBondContact OG-OG 3.11Å; S325-C327 PolarHBondContact O-N 2.84Å; S325-D349 PolarHBondContact N-O 3.08Å; S325-D349 PolarHBondContact OG-O 2.66Å; S325-F351 CarbonylContact C-O 3.58Å; S325-F351 WeakPolarHBondContact CA-O 3.4Å; S325-F351 WeakPolarHBondContact OG-CD2 3.43Å; S325-F351 PolarHBondContact OG-N 3.24Å; S325-F351 VanDerWaalsContact OG-N 3.08Å
326	R	96.6	Very high	94.4	Very high	101 Å²	101	46.9 Å²	46.9	38%	0.381	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	20.8	-179.9	-58.4	177.1	-69.3	-135.2	-1.4	115.6	D301 L324 Y328 F351	D301-R326 VanDerWaalsContact CG-NE 3.28Å; D301-R326 IonicContact OD1-CZ 2.76Å; D301-R326 IonicContact OD1-NE 2.75Å; D301-R326 PolarHBondContact OD1-NE 3.18Å; D301-R326 VanDerWaalsContact OD1-NE 3.12Å; D301-R326 IonicContact OD2-CZ 3.97Å; D301-R326 IonicContact OD2-NE 2.82Å; D301-R326 PolarHBondContact OD2-NE 3.08Å; D301-R326 IonicContact OD2-NH2 3.28Å; D301-R326 PolarHBondContact OD2-NH2 3.26Å; L324-R326 PolarHBondContact O-N 3.49Å; R326-Y328 VanDerWaalsContact C-N 3.31Å; R326-Y328 HydrophobicContact CB-CE1 4.07Å; R326-Y328 HydrophobicContact CB-CE2 4.24Å; R326-Y328 HydrophobicContact CG-CE1 4.3Å; R326-Y328 WeakPolarHBondContact O-CD2 3.16Å; R326-Y328 WeakPolarHBondContact O-CE2 3.22Å; R326-Y328 PolarHBondContact O-N 3.26Å; R326-Y328 VanDerWaalsContact O-N 3.11Å; R326-F351 PolarHBondContact N-O 3.34Å
327	C	96.6	Very high	93.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.254	C	S	.	.			trans	-78.5	77	162.8	-63.2	0	0	0	0	110.8	L299 S302 L324 S325 H329 I330 L353	L299-C327 PolarHBondContact O-SG 3.27Å; L299-C327 VanDerWaalsContact O-SG 3.36Å; S302-C327 PolarHBondContact O-SG 3.35Å; L324-C327 WeakPolarHBondContact O-CB 3.42Å; L324-C327 PolarHBondContact O-N 3.46Å; L324-C327 VanDerWaalsContact O-N 3.15Å; L324-C327 PolarHBondContact O-SG 3.29Å; L324-C327 VanDerWaalsContact O-SG 3.38Å; S325-C327 PolarHBondContact O-N 2.84Å; C327-H329 PolarHBondContact O-N 3.44Å; C327-I330 HydrophobicContact CB-CD1 3.73Å; C327-I330 HydrophobicContact CB-CG1 4.15Å; C327-I330 WeakPolarHBondContact O-CB 3.35Å; C327-I330 PolarHBondContact O-N 2.89Å; C327-L353 VanDerWaalsContact C-CD2 3.46Å; C327-L353 HydrophobicContact CB-CD1 4.43Å; C327-L353 VanDerWaalsContact O-CD2 3.29Å; C327-L353 WeakPolarHBondContact O-CD2 3.46Å
328	Y	94.9	Very high	93.5	Very high	117 Å²	117	44.6 Å²	44.6	46%	0.459	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-11.8	-165	-57	-64.5	0	0	0	116.5	T303 R326 I330 L353	T303-Y328 HydrophobicContact CG2-CD2 3.94Å; T303-Y328 HydrophobicContact CG2-CE2 4.35Å; R326-Y328 VanDerWaalsContact C-N 3.31Å; R326-Y328 HydrophobicContact CB-CE1 4.07Å; R326-Y328 HydrophobicContact CB-CE2 4.24Å; R326-Y328 HydrophobicContact CG-CE1 4.3Å; R326-Y328 WeakPolarHBondContact O-CD2 3.16Å; R326-Y328 WeakPolarHBondContact O-CE2 3.22Å; R326-Y328 PolarHBondContact O-N 3.26Å; R326-Y328 VanDerWaalsContact O-N 3.11Å; Y328-I330 VanDerWaalsContact C-N 3.34Å; Y328-L353 HydrophobicContact CD1-CD2 4.2Å
329	H	94.1	Very high	92.7	Very high	109 Å²	109	40.2 Å²	40.2	51%	0.505	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	6	178.5	-63	9	0	0	0	112.7	T303 T306 C327	T303-H329 PolarHBondContact O-CD2 2.71Å; T306-H329 HydrophobicContact CG2-CB 4.18Å; C327-H329 PolarHBondContact O-N 3.44Å
330	I	94	Very high	92.2	Very high	5 Å²	5	47 Å²	47	3%	0.026	24%	0.237	C	C	.	.			trans	-100.2	114.3	173.7	-59.6	-179.5	0	0	0	108.7	F310 L324 C327 Y328 L335 L353	F310-I330 HydrophobicContact CE1-CD1 4.09Å; F310-I330 HydrophobicContact CE2-CG2 4.33Å; F310-I330 HydrophobicContact CZ-CD1 4.18Å; F310-I330 HydrophobicContact CZ-CG2 3.65Å; L324-I330 HydrophobicContact CB-CD1 4.43Å; L324-I330 HydrophobicContact CD1-CD1 4.11Å; L324-I330 HydrophobicContact CD2-CD1 4.26Å; C327-I330 HydrophobicContact CB-CD1 3.73Å; C327-I330 HydrophobicContact CB-CG1 4.15Å; C327-I330 WeakPolarHBondContact O-CB 3.35Å; C327-I330 PolarHBondContact O-N 2.89Å; Y328-I330 VanDerWaalsContact C-N 3.34Å; I330-L335 HydrophobicContact CG2-CD2 3.71Å; I330-L335 HydrophobicContact CG2-CG 4.11Å; I330-L353 HydrophobicContact CB-CD1 4.32Å
331	H	89.5	Confident	91.8	Very high	140 Å²	140	45.4 Å²	45.4	65%	0.648	23%	0.234	S	C	*	.			trans	-87.5	155.5	179	-59.2	-65.2	0	0	0	112.5	A333 A334	H331-A333 VanDerWaalsContact C-N 3.31Å; H331-A333 PolarHBondContact O-N 3.22Å; H331-A334 PolarHBondContact O-N 2.92Å; H331-A334 VanDerWaalsContact O-N 3.09Å
332	L	87.6	Confident	91.6	Very high	48 Å²	48	44.8 Å²	44.8	25%	0.251	23%	0.231	S	C	.	.	H	α-helix	trans	-52.9	-42.4	-177.6	-179	64.1	0	0	0	113.8	A334 L335 C336 V354 Q358 L362	L332-A334 PolarHBondContact O-N 3.44Å; L332-L335 HydrophobicContact CD1-CD1 4.49Å; L332-L335 WeakPolarHBondContact O-CB 3.48Å; L332-L335 PolarHBondContact O-N 2.91Å; L332-C336 PolarHBondContact O-N 3.47Å; L332-V354 HydrophobicContact CD1-CG1 3.9Å; L332-V354 HydrophobicContact CD1-CG2 3.87Å; L332-Q358 HydrophobicContact CD2-CB 3.79Å; L332-Q358 HydrophobicContact CD2-CG 4.06Å; L332-L362 HydrophobicContact CD1-CB 4.35Å; L332-L362 HydrophobicContact CD1-CD1 4.21Å; L332-L362 HydrophobicContact CD1-CD2 4.16Å; L332-L362 HydrophobicContact CD1-CG 4.47Å
333	A	87.3	Confident	91.2	Very high	76 Å²	76	48.8 Å²	48.8	63%	0.628	26%	0.258	S	S	*	.	H	α-helix	trans	-56.9	-37.8	-179.3	0	0	0	0	0	112.6	H331 L335 C336	H331-A333 VanDerWaalsContact C-N 3.31Å; H331-A333 PolarHBondContact O-N 3.22Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.18Å; A333-C336 PolarHBondContact O-N 3.25Å
334	A	90.6	Very high	91.1	Very high	18 Å²	18	49.5 Å²	49.5	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-28.9	178.2	0	0	0	0	0	112.4	A307 F310 H331 L332 D337 L338	A307-A334 HydrophobicContact CB-CB 3.57Å; F310-A334 HydrophobicContact CD2-CB 4.39Å; F310-A334 HydrophobicContact CE2-CB 3.75Å; F310-A334 VanDerWaalsContact CE2-O 3.3Å; F310-A334 WeakPolarHBondContact CE2-O 3.35Å; H331-A334 PolarHBondContact O-N 2.92Å; H331-A334 VanDerWaalsContact O-N 3.09Å; L332-A334 PolarHBondContact O-N 3.44Å; A334-D337 PolarHBondContact O-N 3.47Å; A334-L338 PolarHBondContact O-N 2.7Å
335	L	90.8	Very high	91	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-68.7	-33.6	178.5	-63.3	176.4	0	0	0	112.1	F310 I330 L332 A333 D337 L338 V350 V354 L362	F310-L335 HydrophobicContact CZ-CD2 4.03Å; I330-L335 HydrophobicContact CG2-CD2 3.71Å; I330-L335 HydrophobicContact CG2-CG 4.11Å; L332-L335 HydrophobicContact CD1-CD1 4.49Å; L332-L335 WeakPolarHBondContact O-CB 3.48Å; L332-L335 PolarHBondContact O-N 2.91Å; A333-L335 VanDerWaalsContact C-N 3.32Å; A333-L335 PolarHBondContact O-N 3.18Å; L335-D337 PolarHBondContact O-N 2.82Å; L335-L338 HydrophobicContact CD2-CD2 4.31Å; L335-L338 WeakPolarHBondContact O-CB 3.15Å; L335-L338 PolarHBondContact O-N 2.73Å; L335-V350 HydrophobicContact CD1-CB 4.25Å; L335-V350 HydrophobicContact CD1-CG1 4.05Å; L335-V350 HydrophobicContact CD1-CG2 4.33Å; L335-V350 HydrophobicContact CD2-CG1 3.91Å; L335-V354 HydrophobicContact CD1-CG2 3.84Å; L335-L362 HydrophobicContact CB-CD1 4.03Å; L335-L362 HydrophobicContact CB-CD2 4.31Å; L335-L362 HydrophobicContact CD1-CD2 4.34Å
336	C	84.6	Confident	90.9	Very high	23 Å²	23	54.6 Å²	54.6	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-35.6	173.7	-67.2	0	0	0	0	111.9	L332 A333 D365	L332-C336 PolarHBondContact O-N 3.47Å; A333-C336 PolarHBondContact O-N 3.25Å; C336-D365 PolarHBondContact SG-OD2 3.5Å
337	D	84.9	Confident	90.9	Very high	97 Å²	97	52.5 Å²	52.5	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-78.2	-28.1	178.9	-68.2	-27	0	0	0	112.8	A334 L335 G339 K340 A341	A334-D337 PolarHBondContact O-N 3.47Å; L335-D337 PolarHBondContact O-N 2.82Å; D337-G339 PolarHBondContact O-N 3.04Å; D337-K340 PolarHBondContact O-N 2.94Å; D337-A341 WeakPolarHBondContact O-CB 3.43Å; D337-A341 PolarHBondContact O-N 2.74Å
338	L	89	Confident	90.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.3	-45	-178.8	-178	63.7	0	0	0	112.5	F310 L322 L324 A334 L335 K340 A341 I342 L348	F310-L338 HydrophobicContact CB-CD1 4.05Å; F310-L338 HydrophobicContact CD1-CD1 3.67Å; F310-L338 HydrophobicContact CD2-CB 4.17Å; F310-L338 HydrophobicContact CD2-CD1 4.04Å; F310-L338 HydrophobicContact CE1-CD1 4.08Å; F310-L338 HydrophobicContact CE1-CD2 4.1Å; F310-L338 HydrophobicContact CE2-CB 4.1Å; F310-L338 HydrophobicContact CE2-CD1 4.4Å; F310-L338 HydrophobicContact CE2-CD2 4.44Å; F310-L338 HydrophobicContact CG-CD1 3.66Å; F310-L338 HydrophobicContact CZ-CD1 4.41Å; F310-L338 HydrophobicContact CZ-CD2 4.04Å; L322-L338 HydrophobicContact CD2-CD1 4.37Å; L322-L338 HydrophobicContact CD2-CD2 4.04Å; L324-L338 HydrophobicContact CD1-CD2 4.05Å; A334-L338 PolarHBondContact O-N 2.7Å; L335-L338 HydrophobicContact CD2-CD2 4.31Å; L335-L338 WeakPolarHBondContact O-CB 3.15Å; L335-L338 PolarHBondContact O-N 2.73Å; L338-K340 PolarHBondContact O-N 3Å; L338-A341 PolarHBondContact O-N 2.75Å; L338-I342 HydrophobicContact CD1-CD1 3.61Å; L338-I342 HydrophobicContact CD1-CG1 4.06Å; L338-I342 PolarHBondContact O-N 3.16Å; L338-L348 HydrophobicContact CD2-CD1 3.89Å; L338-L348 HydrophobicContact CD2-CD2 4.17Å
339	G	82.9	Confident	90.9	Very high	8 Å²	8	47.1 Å²	47.1	8%	0.082	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-29.9	179	0	0	0	0	0	113.4	D337	D337-G339 PolarHBondContact O-N 3.04Å
340	K	86.1	Confident	91	Very high	141 Å²	141	41.9 Å²	41.9	61%	0.613	23%	0.23	S	C	*	.	H	α-helix	trans	-78.3	-38.5	174.2	-61	172.1	-171.2	163.3	0	111.2	D337 L338	D337-K340 PolarHBondContact O-N 2.94Å; L338-K340 PolarHBondContact O-N 3Å
341	A	90.1	Very high	91	Very high	40 Å²	40	45 Å²	45	33%	0.331	24%	0.243	S	C	.	.	H	α-helix	trans	-69.6	-30.6	-178.9	0	0	0	0	0	113.5	D337 L338 P343	D337-A341 WeakPolarHBondContact O-CB 3.43Å; D337-A341 PolarHBondContact O-N 2.74Å; L338-A341 PolarHBondContact O-N 2.75Å; A341-P343 WeakPolarHBondContact O-CD 3.47Å
342	I	92.9	Very high	91.2	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	24%	0.242	C	C	.	.			trans	-119.3	83.2	-177.6	-44.8	-170.8	0	0	0	110.3	L313 K314 L319 L338 S344 L345	L313-I342 HydrophobicContact CB-CD1 4.02Å; K314-I342 HydrophobicContact CB-CG1 4.23Å; L319-I342 HydrophobicContact CB-CG2 4.38Å; L319-I342 HydrophobicContact CD2-CD1 4.22Å; L319-I342 HydrophobicContact CD2-CG2 4.49Å; L338-I342 HydrophobicContact CD1-CD1 3.61Å; L338-I342 HydrophobicContact CD1-CG1 4.06Å; L338-I342 PolarHBondContact O-N 3.16Å; I342-S344 PolarHBondContact O-N 2.87Å; I342-L345 HydrophobicContact CB-CB 4.2Å; I342-L345 HydrophobicContact CG2-CB 4.03Å; I342-L345 VanDerWaalsContact O-CB 3.25Å; I342-L345 WeakPolarHBondContact O-CB 3.41Å; I342-L345 PolarHBondContact O-N 3.25Å; I342-L345 VanDerWaalsContact O-N 3.08Å
343	P	90.6	Very high	91.4	Very high	85 Å²	85	40.6 Å²	40.6	55%	0.552	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.6	-172.2	26.8	-35.7	0	0	0	114.6	A341 L345 R346	A341-P343 WeakPolarHBondContact O-CD 3.47Å; P343-L345 VanDerWaalsContact C-N 3.29Å; P343-R346 PolarHBondContact O-NH1 3.09Å
344	S	94.7	Very high	91.3	Very high	21 Å²	21	37.8 Å²	37.8	15%	0.147	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-20.2	175.1	55.5	0	0	0	0	112.8	K317 L319 L320 I342 R346	K317-S344 VanDerWaalsContact O-CB 3.31Å; K317-S344 WeakPolarHBondContact O-CB 3.43Å; K317-S344 PolarHBondContact O-OG 3.2Å; L319-S344 CarbonylContact O-C 3.59Å; L319-S344 VanDerWaalsContact O-CB 3.3Å; L319-S344 WeakPolarHBondContact O-CB 3.28Å; L319-S344 PolarHBondContact O-OG 3.18Å; L320-S344 WeakPolarHBondContact CD2-O 3.47Å; I342-S344 PolarHBondContact O-N 2.87Å; S344-R346 PolarHBondContact O-NH1 2.98Å
345	L	96.3	Very high	91.1	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	24%	0.24	C	C	.	.			trans	-62.6	141.7	-173.2	-163.7	68.9	0	0	0	110.8	L319 L322 I342 P343 L348 L369	L319-L345 HydrophobicContact CD2-CD1 4.4Å; L319-L345 HydrophobicContact CG-CD1 4.21Å; L319-L345 WeakPolarHBondContact O-CA 3.38Å; L319-L345 PolarHBondContact O-N 3.4Å; L322-L345 HydrophobicContact CB-CD1 3.68Å; I342-L345 HydrophobicContact CB-CB 4.2Å; I342-L345 HydrophobicContact CG2-CB 4.03Å; I342-L345 VanDerWaalsContact O-CB 3.25Å; I342-L345 WeakPolarHBondContact O-CB 3.41Å; I342-L345 PolarHBondContact O-N 3.25Å; I342-L345 VanDerWaalsContact O-N 3.08Å; P343-L345 VanDerWaalsContact C-N 3.29Å; L345-L348 HydrophobicContact CD2-CB 4.3Å; L345-L348 HydrophobicContact CD2-CD1 4.48Å; L345-L369 HydrophobicContact CB-CD2 3.85Å; L345-L369 HydrophobicContact CD2-CD1 4.3Å; L345-L369 HydrophobicContact CD2-CD2 4.15Å; L345-L369 HydrophobicContact CG-CD2 3.88Å; L345-L369 WeakPolarHBondContact O-CD2 3.34Å
346	R	95.5	Very high	90.6	Very high	112 Å²	112	51 Å²	51	42%	0.423	28%	0.277	S	S	.	.			trans	-131.2	-34.2	-178.8	-64.3	-63.6	-179.6	-97.2	0.3	112.2	L320 P343 S344 A370	L320-R346 HydrophobicContact CD2-CG 4.39Å; L320-R346 WeakPolarHBondContact O-CA 3.28Å; L320-R346 PolarHBondContact O-N 3.02Å; P343-R346 PolarHBondContact O-NH1 3.09Å; S344-R346 PolarHBondContact O-NH1 2.98Å; R346-A370 PolarHBondContact O-N 2.8Å
347	F	96.2	Very high	90.5	Very high	56 Å²	56	53.3 Å²	53.3	25%	0.246	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.4	179.1	-58	-83.8	0	0	0	109.3	L320 H321 L322 A370 R374	L320-F347 PolarHBondContact O-N 3.37Å; H321-F347 WeakPolarHBondContact CA-O 3.12Å; H321-F347 HydrophobicContact CB-CB 4.02Å; H321-F347 HydrophobicContact CB-CD2 4.43Å; L322-F347 PolarHBondContact N-O 3.39Å; F347-A370 WeakPolarHBondContact CA-O 3.47Å; F347-A370 HydrophobicContact CD1-CB 3.63Å; F347-A370 HydrophobicContact CE1-CB 3.83Å; F347-R374 HydrophobicContact CD1-CG 4.49Å
348	L	96.1	Very high	90.5	Very high	1 Å²	1	53 Å²	53	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	113.5	176.7	176.3	61.5	0	0	0	109.3	L322 L338 L345 V350 L369 A370 I371 N372	L322-L348 HydrophobicContact CB-CD1 4.42Å; L322-L348 HydrophobicContact CG-CD1 4.45Å; L322-L348 WeakPolarHBondContact O-CA 3.13Å; L338-L348 HydrophobicContact CD2-CD1 3.89Å; L338-L348 HydrophobicContact CD2-CD2 4.17Å; L345-L348 HydrophobicContact CD2-CB 4.3Å; L345-L348 HydrophobicContact CD2-CD1 4.48Å; L348-V350 HydrophobicContact CD1-CG1 3.88Å; L348-V350 HydrophobicContact CD2-CG1 4.34Å; L348-V350 HydrophobicContact CG-CG1 3.93Å; L348-L369 HydrophobicContact CD2-CD1 4.42Å; L348-A370 PolarHBondContact N-O 3.46Å; L348-I371 HydrophobicContact CB-CG1 4.33Å; L348-I371 CarbonylContact O-C 3.58Å; L348-I371 WeakPolarHBondContact O-CA 3.35Å; L348-N372 PolarHBondContact O-N 3.15Å
349	D	95.8	Very high	90.4	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.016	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.8	175.8	-61.4	-52.3	0	0	0	109.7	H321 L322 S323 L324 S325 F351 N372 A373 R374	H321-D349 IonicContact CD2-OD2 3.7Å; H321-D349 IonicContact CE1-OD2 3.5Å; H321-D349 PolarHBondContact CE1-OD2 3.35Å; H321-D349 IonicContact NE2-OD2 2.67Å; H321-D349 PolarHBondContact NE2-OD2 2.82Å; L322-D349 PolarHBondContact O-N 3.28Å; S323-D349 CarbonylContact C-O 3.17Å; S323-D349 WeakPolarHBondContact CA-O 3.16Å; S323-D349 PolarHBondContact OG-O 3.2Å; L324-D349 PolarHBondContact N-O 3.03Å; S325-D349 PolarHBondContact N-O 3.08Å; S325-D349 PolarHBondContact OG-O 2.66Å; D349-F351 HydrophobicContact CB-CD2 3.99Å; D349-F351 HydrophobicContact CB-CE2 3.92Å; D349-N372 WeakPolarHBondContact OD1-CA 3.48Å; D349-A373 PolarHBondContact OD1-N 2.73Å; D349-R374 PolarHBondContact OD1-N 2.93Å
350	V	95.8	Very high	90.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.323	C	S	.	.			trans	-132.9	36.9	-176.6	-71.3	0	0	0	0	110.4	L324 L335 L348 G352 L353 V354 L362 I371 N372	L324-V350 HydrophobicContact CB-CG1 4.34Å; L335-V350 HydrophobicContact CD1-CB 4.25Å; L335-V350 HydrophobicContact CD1-CG1 4.05Å; L335-V350 HydrophobicContact CD1-CG2 4.33Å; L335-V350 HydrophobicContact CD2-CG1 3.91Å; L348-V350 HydrophobicContact CD1-CG1 3.88Å; L348-V350 HydrophobicContact CD2-CG1 4.34Å; L348-V350 HydrophobicContact CG-CG1 3.93Å; V350-G352 PolarHBondContact O-N 2.77Å; V350-L353 HydrophobicContact CB-CB 4.44Å; V350-L353 HydrophobicContact CB-CD1 4.23Å; V350-L353 HydrophobicContact CG1-CD1 4.38Å; V350-L353 WeakPolarHBondContact O-CB 3.17Å; V350-L353 PolarHBondContact O-N 3.32Å; V350-L353 VanDerWaalsContact O-N 3.15Å; V350-V354 HydrophobicContact CG2-CG2 4.17Å; V350-L362 HydrophobicContact CG2-CD2 4.48Å; V350-I371 HydrophobicContact CG2-CG2 3.92Å; V350-N372 PolarHBondContact N-OD1 3Å
351	F	94.7	Very high	90.6	Very high	70 Å²	70	52.3 Å²	52.3	31%	0.307	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	136.7	179.6	-66.1	-84.2	0	0	0	110.8	S325 R326 D349 L353 N372 P375	S325-F351 CarbonylContact C-O 3.58Å; S325-F351 WeakPolarHBondContact CA-O 3.4Å; S325-F351 WeakPolarHBondContact OG-CD2 3.43Å; S325-F351 PolarHBondContact OG-N 3.24Å; S325-F351 VanDerWaalsContact OG-N 3.08Å; R326-F351 PolarHBondContact N-O 3.34Å; D349-F351 HydrophobicContact CB-CD2 3.99Å; D349-F351 HydrophobicContact CB-CE2 3.92Å; F351-L353 VanDerWaalsContact C-N 3.26Å; F351-L353 PolarHBondContact O-N 2.97Å; F351-N372 HydrophobicContact CD1-CB 4.13Å; F351-N372 HydrophobicContact CE1-CB 3.59Å; F351-N372 HydrophobicContact CE2-CB 4.06Å; F351-N372 HydrophobicContact CZ-CB 3.57Å; F351-N372 WeakPolarHBondContact CZ-O 3.44Å; F351-N372 PolarHBondContact N-OD1 3.01Å; F351-P375 HydrophobicContact CE2-CB 4.38Å; F351-P375 HydrophobicContact CZ-CB 4.05Å
352	G	92.8	Very high	90.4	Very high	60 Å²	60	50.5 Å²	50.5	62%	0.619	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	0.1	-179.6	0	0	0	0	0	115.6	V350	V350-G352 PolarHBondContact O-N 2.77Å
353	L	91.2	Very high	90.2	Very high	35 Å²	35	54.1 Å²	54.1	18%	0.183	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-28.1	174.4	-59.6	-171.6	0	0	0	113.8	L324 C327 Y328 I330 V350 F351	L324-L353 VanDerWaalsContact O-CD1 3.27Å; L324-L353 WeakPolarHBondContact O-CD1 3.21Å; C327-L353 VanDerWaalsContact C-CD2 3.46Å; C327-L353 HydrophobicContact CB-CD1 4.43Å; C327-L353 VanDerWaalsContact O-CD2 3.29Å; C327-L353 WeakPolarHBondContact O-CD2 3.46Å; Y328-L353 HydrophobicContact CD1-CD2 4.2Å; I330-L353 HydrophobicContact CB-CD1 4.32Å; V350-L353 HydrophobicContact CB-CB 4.44Å; V350-L353 HydrophobicContact CB-CD1 4.23Å; V350-L353 HydrophobicContact CG1-CD1 4.38Å; V350-L353 WeakPolarHBondContact O-CB 3.17Å; V350-L353 PolarHBondContact O-N 3.32Å; V350-L353 VanDerWaalsContact O-N 3.15Å; F351-L353 VanDerWaalsContact C-N 3.26Å; F351-L353 PolarHBondContact O-N 2.97Å
354	V	87	Confident	90.1	Very high	17 Å²	17	56.2 Å²	56.2	10%	0.103	32%	0.324	C	S	.	.	S	Bend	trans	-123.7	132.9	-172.3	-171.3	0	0	0	0	108.8	L332 L335 V350 Q358 L359 L362	L332-V354 HydrophobicContact CD1-CG1 3.9Å; L332-V354 HydrophobicContact CD1-CG2 3.87Å; L335-V354 HydrophobicContact CD1-CG2 3.84Å; V350-V354 HydrophobicContact CG2-CG2 4.17Å; V354-Q358 HydrophobicContact CG1-CB 3.63Å; V354-L359 HydrophobicContact CG1-CB 4.28Å; V354-L362 HydrophobicContact CG2-CD2 4.44Å
355	Q	85.1	Confident	89.7	Confident	152 Å²	152	59.9 Å²	59.9	71%	0.71	34%	0.342	S	S	*	.			trans	-76.3	153.1	172.8	-62.6	-176.1	8.5	0	0	110.6	G357 Q358 L359	Q355-G357 VanDerWaalsContact C-N 3.25Å; Q355-G357 PolarHBondContact O-N 3.25Å; Q355-G357 VanDerWaalsContact O-N 3.11Å; Q355-Q358 PolarHBondContact O-N 2.87Å; Q355-L359 PolarHBondContact O-N 3.23Å; Q355-L359 VanDerWaalsContact O-N 3.1Å
356	D	80.9	Confident	89.1	Confident	146 Å²	146	60.3 Å²	60.3	78%	0.781	35%	0.345	S	S	*	.	H	α-helix	trans	-54.2	-38	-174	-64.4	-25.3	0	0	0	113.6	Q358 L359	D356-Q358 VanDerWaalsContact C-N 3.3Å; D356-Q358 PolarHBondContact O-N 2.78Å; D356-L359 WeakPolarHBondContact O-CB 3.4Å; D356-L359 PolarHBondContact O-N 2.93Å
357	G	81.3	Confident	88.7	Confident	72 Å²	72	60.2 Å²	60.2	74%	0.742	36%	0.359	S	S	*	.	H	α-helix	trans	-67.2	-26.8	177.9	0	0	0	0	0	114.5	Q355	Q355-G357 VanDerWaalsContact C-N 3.25Å; Q355-G357 PolarHBondContact O-N 3.25Å; Q355-G357 VanDerWaalsContact O-N 3.11Å
358	Q	85.4	Confident	88.4	Confident	91 Å²	91	66.2 Å²	66.2	43%	0.425	38%	0.38	S	S	.	.	H	α-helix	trans	-90.9	-19.1	178.3	-68.2	176.8	-38.7	0	0	112.5	L332 V354 Q355 D356 A360 A361 L362	L332-Q358 HydrophobicContact CD2-CB 3.79Å; L332-Q358 HydrophobicContact CD2-CG 4.06Å; V354-Q358 HydrophobicContact CG1-CB 3.63Å; Q355-Q358 PolarHBondContact O-N 2.87Å; D356-Q358 VanDerWaalsContact C-N 3.3Å; D356-Q358 PolarHBondContact O-N 2.78Å; Q358-A360 VanDerWaalsContact C-N 3.34Å; Q358-A361 PolarHBondContact O-N 3.5Å; Q358-L362 PolarHBondContact O-N 3.11Å
359	L	87.4	Confident	88.3	Confident	28 Å²	28	67 Å²	67	15%	0.147	38%	0.384	C	S	.	.	H	α-helix	trans	-65	-39.7	-179.9	-174.8	64.2	0	0	0	111.6	V354 Q355 D356 L362 Q363 I371	V354-L359 HydrophobicContact CG1-CB 4.28Å; Q355-L359 PolarHBondContact O-N 3.23Å; Q355-L359 VanDerWaalsContact O-N 3.1Å; D356-L359 WeakPolarHBondContact O-CB 3.4Å; D356-L359 PolarHBondContact O-N 2.93Å; L359-L362 PolarHBondContact O-N 3.03Å; L359-Q363 WeakPolarHBondContact O-CG 3.03Å; L359-Q363 PolarHBondContact O-N 2.76Å; L359-I371 HydrophobicContact CD1-CG2 3.64Å
360	A	86.2	Confident	88.2	Confident	49 Å²	49	68.5 Å²	68.5	41%	0.405	40%	0.397	S	S	.	.	H	α-helix	trans	-59.9	-46	176.9	0	0	0	0	0	111.6	Q358 L362 Q363 D364	Q358-A360 VanDerWaalsContact C-N 3.34Å; A360-L362 VanDerWaalsContact C-N 3.31Å; A360-L362 PolarHBondContact O-N 2.92Å; A360-Q363 WeakPolarHBondContact O-CB 3.02Å; A360-Q363 PolarHBondContact O-N 2.91Å; A360-Q363 VanDerWaalsContact O-N 3.13Å; A360-D364 PolarHBondContact O-N 2.93Å
361	A	86.8	Confident	88.1	Confident	56 Å²	56	69 Å²	69	46%	0.463	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-39.6	176.7	0	0	0	0	0	112.3	Q358 Q363 D364 D365	Q358-A361 PolarHBondContact O-N 3.5Å; A361-Q363 VanDerWaalsContact C-N 3.35Å; A361-D364 PolarHBondContact O-N 2.8Å; A361-D365 WeakPolarHBondContact O-CB 3.43Å; A361-D365 PolarHBondContact O-N 3.26Å
362	L	86.6	Confident	88.1	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	39%	0.393	C	S	.	.	H	α-helix	trans	-67.3	-35.7	176.4	-171.7	67.4	0	0	0	112.3	L332 L335 V350 V354 Q358 L359 A360 S366 I371	L332-L362 HydrophobicContact CD1-CB 4.35Å; L332-L362 HydrophobicContact CD1-CD1 4.21Å; L332-L362 HydrophobicContact CD1-CD2 4.16Å; L332-L362 HydrophobicContact CD1-CG 4.47Å; L335-L362 HydrophobicContact CB-CD1 4.03Å; L335-L362 HydrophobicContact CB-CD2 4.31Å; L335-L362 HydrophobicContact CD1-CD2 4.34Å; V350-L362 HydrophobicContact CG2-CD2 4.48Å; V354-L362 HydrophobicContact CG2-CD2 4.44Å; Q358-L362 PolarHBondContact O-N 3.11Å; L359-L362 PolarHBondContact O-N 3.03Å; A360-L362 VanDerWaalsContact C-N 3.31Å; A360-L362 PolarHBondContact O-N 2.92Å; L362-S366 PolarHBondContact O-N 3.14Å; L362-I371 HydrophobicContact CB-CD1 4.34Å; L362-I371 HydrophobicContact CD2-CD1 3.98Å; L362-I371 HydrophobicContact CD2-CG2 4.39Å; L362-I371 HydrophobicContact CG-CD1 3.72Å
363	Q	88.9	Confident	88	Confident	78 Å²	78	67 Å²	67	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-68.1	-41.1	174.3	-72.6	173.2	-16.8	0	0	111.7	L359 A360 A361 S366 P367 I371	L359-Q363 WeakPolarHBondContact O-CG 3.03Å; L359-Q363 PolarHBondContact O-N 2.76Å; A360-Q363 WeakPolarHBondContact O-CB 3.02Å; A360-Q363 PolarHBondContact O-N 2.91Å; A360-Q363 VanDerWaalsContact O-N 3.13Å; A361-Q363 VanDerWaalsContact C-N 3.35Å; Q363-S366 CarbonylContact O-C 3.51Å; Q363-S366 PolarHBondContact O-N 3.27Å; Q363-P367 WeakPolarHBondContact O-CA 3.28Å; Q363-I371 HydrophobicContact CG-CB 4.18Å; Q363-I371 HydrophobicContact CG-CD1 3.93Å
364	D	87.2	Confident	87.9	Confident	130 Å²	130	70.4 Å²	70.4	70%	0.695	40%	0.397	S	S	*	.	H	α-helix	trans	-65.3	-39.5	176.7	-71.9	-18	0	0	0	112	A360 A361 S366	A360-D364 PolarHBondContact O-N 2.93Å; A361-D364 PolarHBondContact O-N 2.8Å; D364-S366 PolarHBondContact O-N 3.1Å
365	D	86.2	Confident	88.1	Confident	97 Å²	97	73.7 Å²	73.7	52%	0.519	42%	0.418	S	S	.	.	H	α-helix	trans	-67.4	-23.8	175.4	-92.3	5.5	0	0	0	113	C336 A361	C336-D365 PolarHBondContact SG-OD2 3.5Å; A361-D365 WeakPolarHBondContact O-CB 3.43Å; A361-D365 PolarHBondContact O-N 3.26Å
366	S	85.3	Confident	88.3	Confident	11 Å²	11	73 Å²	73	8%	0.077	41%	0.413	C	S	.	.			trans	-137.8	64.6	-174.8	-71.2	0	0	0	0	112.7	L362 Q363 D364 R368 L369	L362-S366 PolarHBondContact O-N 3.14Å; Q363-S366 CarbonylContact O-C 3.51Å; Q363-S366 PolarHBondContact O-N 3.27Å; D364-S366 PolarHBondContact O-N 3.1Å; S366-R368 PolarHBondContact O-N 3.25Å; S366-L369 PolarHBondContact O-N 2.68Å
367	P	86.2	Confident	88.9	Confident	111 Å²	111	66.9 Å²	66.9	72%	0.721	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.3	-172.2	27.5	-36.3	0	0	0	113.9	Q363 L369	Q363-P367 WeakPolarHBondContact O-CA 3.28Å; P367-L369 VanDerWaalsContact C-N 3.35Å
368	R	90.6	Very high	89.5	Confident	181 Å²	181	65.8 Å²	65.8	68%	0.683	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-16.2	174.7	-64.9	-177.1	-69.1	-174.4	-1.4	113.1	S366	S366-R368 PolarHBondContact O-N 3.25Å
369	L	92.3	Very high	90	Very high	17 Å²	17	61.6 Å²	61.6	9%	0.089	35%	0.346	C	S	.	.	S	Bend	trans	-98.9	124.4	-177.3	-62.8	-176.5	0	0	0	110.3	L345 L348 S366 P367 I371	L345-L369 HydrophobicContact CB-CD2 3.85Å; L345-L369 HydrophobicContact CD2-CD1 4.3Å; L345-L369 HydrophobicContact CD2-CD2 4.15Å; L345-L369 HydrophobicContact CG-CD2 3.88Å; L345-L369 WeakPolarHBondContact O-CD2 3.34Å; L348-L369 HydrophobicContact CD2-CD1 4.42Å; S366-L369 PolarHBondContact O-N 2.68Å; P367-L369 VanDerWaalsContact C-N 3.35Å; L369-I371 HydrophobicContact CB-CD1 4.49Å; L369-I371 HydrophobicContact CB-CG1 4.04Å; L369-I371 PolarHBondContact O-N 3.19Å
370	A	94.1	Very high	90.5	Very high	36 Å²	36	60.2 Å²	60.2	30%	0.298	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	101.3	163.4	0	0	0	0	0	108.3	R346 F347 L348 A373	R346-A370 PolarHBondContact O-N 2.8Å; F347-A370 WeakPolarHBondContact CA-O 3.47Å; F347-A370 HydrophobicContact CD1-CB 3.63Å; F347-A370 HydrophobicContact CE1-CB 3.83Å; L348-A370 PolarHBondContact N-O 3.46Å; A370-A373 HydrophobicContact CB-CB 3.97Å
371	I	94.1	Very high	90.9	Very high	9 Å²	9	61.1 Å²	61.1	5%	0.046	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.7	-178.9	-60.1	161.9	0	0	0	110.2	L348 V350 L359 L362 Q363 L369 A373	L348-I371 HydrophobicContact CB-CG1 4.33Å; L348-I371 CarbonylContact O-C 3.58Å; L348-I371 WeakPolarHBondContact O-CA 3.35Å; V350-I371 HydrophobicContact CG2-CG2 3.92Å; L359-I371 HydrophobicContact CD1-CG2 3.64Å; L362-I371 HydrophobicContact CB-CD1 4.34Å; L362-I371 HydrophobicContact CD2-CD1 3.98Å; L362-I371 HydrophobicContact CD2-CG2 4.39Å; L362-I371 HydrophobicContact CG-CD1 3.72Å; Q363-I371 HydrophobicContact CG-CB 4.18Å; Q363-I371 HydrophobicContact CG-CD1 3.93Å; L369-I371 HydrophobicContact CB-CD1 4.49Å; L369-I371 HydrophobicContact CB-CG1 4.04Å; L369-I371 PolarHBondContact O-N 3.19Å; I371-A373 PolarHBondContact O-N 2.78Å
372	N	94.3	Very high	91.2	Very high	31 Å²	31	58.6 Å²	58.6	17%	0.166	31%	0.311	C	S	.	.	S	Bend	trans	55.3	32.2	179.1	-69.4	-8.9	0	0	0	113.4	L348 D349 V350 F351	L348-N372 PolarHBondContact O-N 3.15Å; D349-N372 WeakPolarHBondContact OD1-CA 3.48Å; V350-N372 PolarHBondContact N-OD1 3Å; F351-N372 HydrophobicContact CD1-CB 4.13Å; F351-N372 HydrophobicContact CE1-CB 3.59Å; F351-N372 HydrophobicContact CE2-CB 4.06Å; F351-N372 HydrophobicContact CZ-CB 3.57Å; F351-N372 WeakPolarHBondContact CZ-O 3.44Å; F351-N372 PolarHBondContact N-OD1 3.01Å
373	A	90.8	Very high	91.3	Very high	59 Å²	59	61.5 Å²	61.5	49%	0.488	33%	0.329	S	S	.	.			trans	-86.6	-14.6	-179.3	0	0	0	0	0	112.9	D349 A370 I371	D349-A373 PolarHBondContact OD1-N 2.73Å; A370-A373 HydrophobicContact CB-CB 3.97Å; I371-A373 PolarHBondContact O-N 2.78Å
374	R	90.6	Very high	91	Very high	105 Å²	105	59.1 Å²	59.1	40%	0.396	32%	0.32	S	S	.	.			trans	-130.6	84.3	-172.4	-64.9	-176.2	177.1	-166	-2.4	111	F347 D349 F376	F347-R374 HydrophobicContact CD1-CG 4.49Å; D349-R374 PolarHBondContact OD1-N 2.93Å; R374-F376 PolarHBondContact O-N 2.77Å
375	P	89.1	Confident	90.4	Very high	86 Å²	86	55.8 Å²	55.8	56%	0.558	31%	0.31	S	S	*	.	S	Bend	trans	-68	-16.3	-179.3	27.5	-34.7	0	0	0	113.6	F351	F351-P375 HydrophobicContact CE2-CB 4.38Å; F351-P375 HydrophobicContact CZ-CB 4.05Å
376	F	90.7	Very high	89.2	Confident	139 Å²	139	55.3 Å²	55.3	61%	0.61	33%	0.329	S	S	*	.	S	Bend	trans	-121.6	131.8	-179.3	-54.4	-67.3	0	0	0	111.2	R374 A385	R374-F376 PolarHBondContact O-N 2.77Å; F376-A385 HydrophobicContact CB-CB 3.91Å; F376-A385 HydrophobicContact CD2-CB 3.64Å; F376-A385 HydrophobicContact CE2-CB 4.47Å; F376-A385 HydrophobicContact CG-CB 3.97Å
377	S	92.5	Very high	87.8	Confident	17 Å²	17	57.1 Å²	57.1	12%	0.119	34%	0.344	C	S	.	.			trans	-68.8	131.3	173.9	-173.4	0	0	0	0	111.2	N271 R381	N271-S377 VanDerWaalsContact ND2-CB 3.29Å; N271-S377 WeakPolarHBondContact ND2-CB 3.32Å; N271-S377 PolarHBondContact ND2-OG 3.18Å; S377-R381 WeakPolarHBondContact O-CD 3.44Å; S377-R381 PolarHBondContact O-NE 3.47Å
378	A	93.5	Very high	86	Confident	48 Å²	48	57.2 Å²	57.2	40%	0.397	35%	0.354	S	S	.	.			trans	-90.2	-8.2	175.2	0	0	0	0	0	113.5	A380 R381 P384	A378-A380 PolarHBondContact O-N 3.29Å; A378-R381 PolarHBondContact O-N 3.47Å; A378-P384 HydrophobicContact CB-CB 3.78Å; A378-P384 HydrophobicContact CB-CG 4.27Å
379	V	97.3	Very high	84.4	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.018	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	123	-170.6	-179.7	0	0	0	0	110.8	L244 N245 H269 N271 T296 R381	L244-V379 VanDerWaalsContact O-CG1 3.31Å; L244-V379 WeakPolarHBondContact O-CG1 3.21Å; N245-V379 HydrophobicContact CB-CG1 4.26Å; N245-V379 WeakPolarHBondContact CB-O 3.49Å; H269-V379 HydrophobicContact CB-CG1 4.02Å; H269-V379 HydrophobicContact CB-CG2 4.27Å; H269-V379 WeakPolarHBondContact O-CG1 3.48Å; N271-V379 HydrophobicContact CB-CB 4.09Å; N271-V379 HydrophobicContact CB-CG1 4.26Å; N271-V379 HydrophobicContact CB-CG2 4.32Å; T296-V379 HydrophobicContact CG2-CG2 3.73Å; V379-R381 PolarHBondContact O-N 3.01Å
380	A	96.8	Very high	82.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	7.8	179.1	0	0	0	0	0	116.1	Q217 L218 N219 Q243 N245 A378 W395	Q217-A380 HydrophobicContact CB-CB 4.4Å; L218-A380 VanDerWaalsContact O-CB 3.28Å; L218-A380 WeakPolarHBondContact O-CB 3.45Å; N219-A380 HydrophobicContact CB-CB 4.06Å; Q243-A380 HydrophobicContact CB-CB 4.05Å; Q243-A380 VanDerWaalsContact OE1-N 3.11Å; N245-A380 HydrophobicContact CB-CB 4.09Å; A378-A380 PolarHBondContact O-N 3.29Å; A380-W395 PolarHBondContact O-NE1 3.24Å
381	R	94.9	Very high	81.2	Confident	68 Å²	68	59.3 Å²	59.3	26%	0.257	38%	0.377	S	S	.	.			trans	-72	132.5	-178.4	-72.1	-162.9	177.8	-88.6	-7.6	110.8	E197 S377 A378 V379 T383 P384 W395	E197-R381 IonicContact OE1-CZ 2.81Å; E197-R381 VanDerWaalsContact OE1-CZ 3.28Å; E197-R381 IonicContact OE1-NH1 3.82Å; E197-R381 PolarHBondContact OE1-NH1 2.77Å; E197-R381 IonicContact OE1-NH2 3.75Å; E197-R381 PolarHBondContact OE1-NH2 3.11Å; E197-R381 IonicContact OE2-CZ 3.35Å; E197-R381 IonicContact OE2-NH1 3.13Å; E197-R381 PolarHBondContact OE2-NH1 2.82Å; S377-R381 WeakPolarHBondContact O-CD 3.44Å; S377-R381 PolarHBondContact O-NE 3.47Å; A378-R381 PolarHBondContact O-N 3.47Å; V379-R381 PolarHBondContact O-N 3.01Å; R381-T383 VanDerWaalsContact C-N 3.26Å; R381-T383 PolarHBondContact O-N 3.38Å; R381-P384 HydrophobicContact CB-CG 4.33Å; R381-W395 PolarHBondContact O-NE1 3.12Å
382	P	93.4	Very high	79.8	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.019	38%	0.384	C	S	.	.	S	Bend	trans	-56.3	-40.3	174	-24.1	31.9	0	0	0	112.8	D170 S195 M394 W395	D170-P382 HydrophobicContact CB-CB 4.05Å; D170-P382 HydrophobicContact CB-CG 3.97Å; D170-P382 VanDerWaalsContact CG-CG 3.4Å; D170-P382 WeakPolarHBondContact OD1-CG 3.26Å; D170-P382 VanDerWaalsContact OD2-CB 3.29Å; D170-P382 WeakPolarHBondContact OD2-CB 3.43Å; S195-P382 WeakPolarHBondContact OG-CG 3.26Å; P382-M394 HydrophobicContact CB-CG 3.95Å; P382-M394 CarbonylContact O-C 3.57Å; P382-M394 WeakPolarHBondContact O-CA 3.35Å; P382-W395 HydrophobicContact CB-CZ2 4.15Å; P382-W395 HydrophobicContact CG-CH2 4.35Å; P382-W395 HydrophobicContact CG-CZ2 3.73Å; P382-W395 PolarHBondContact O-N 3.42Å
383	T	89.4	Confident	79.2	Confident	62 Å²	62	60.5 Å²	60.5	38%	0.38	38%	0.38	S	S	.	.	S	Bend	trans	-134.6	88.4	178.9	-40	0	0	0	0	109	R147 R381	R147-T383 PolarHBondContact NH1-OG1 3.36Å; R147-T383 PolarHBondContact NH2-OG1 3.03Å; R381-T383 VanDerWaalsContact C-N 3.26Å; R381-T383 PolarHBondContact O-N 3.38Å
384	P	82.3	Confident	79.1	Confident	29 Å²	29	57.7 Å²	57.7	19%	0.188	36%	0.357	C	S	.	.			trans	-61.5	138.2	179.2	-22.5	33.7	0	0	0	112.1	A378 R381	A378-P384 HydrophobicContact CB-CB 3.78Å; A378-P384 HydrophobicContact CB-CG 4.27Å; R381-P384 HydrophobicContact CB-CG 4.33Å
385	A	73.5	Confident	79.1	Confident	59 Å²	59	53.9 Å²	53.9	49%	0.488	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	142.7	175.5	0	0	0	0	0	111.2	F376 A387	F376-A385 HydrophobicContact CB-CB 3.91Å; F376-A385 HydrophobicContact CD2-CB 3.64Å; F376-A385 HydrophobicContact CE2-CB 4.47Å; F376-A385 HydrophobicContact CG-CB 3.97Å; A385-A387 VanDerWaalsContact C-N 3.28Å; A385-A387 PolarHBondContact O-N 2.76Å
386	G	60.8	Low	79.1	Confident	88 Å²	88	52.2 Å²	52.2	91%	0.907	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	-3.7	175.3	0	0	0	0	0	116	A388	G386-A388 PolarHBondContact O-N 2.91Å
387	A	57.3	Low	79	Confident	48 Å²	48	51 Å²	51	40%	0.397	33%	0.333	S	S	.	.			trans	-74	126.8	167.9	0	0	0	0	0	108.8	A385 Q389	A385-A387 VanDerWaalsContact C-N 3.28Å; A385-A387 PolarHBondContact O-N 2.76Å; A387-Q389 HydrophobicContact CB-CG 3.73Å; A387-Q389 PolarHBondContact O-N 3.16Å
388	A	48.5	Very low	78.7	Confident	113 Å²	113	51.9 Å²	51.9	93%	0.934	35%	0.345	S	S	*	.			trans	-67.2	69.9	167.8	0	0	0	0	0	108.9	G386	G386-A388 PolarHBondContact O-N 2.91Å
389	Q	56.8	Low	78.5	Confident	67 Å²	67	50 Å²	50	31%	0.313	33%	0.329	S	S	.	.			trans	-94	139	178.5	-73.2	-163.4	7.2	0	0	109.1	A387 D391 T393	A387-Q389 HydrophobicContact CB-CG 3.73Å; A387-Q389 PolarHBondContact O-N 3.16Å; Q389-D391 PolarHBondContact O-N 3.29Å; Q389-T393 WeakPolarHBondContact CB-OG1 3.28Å; Q389-T393 PolarHBondContact OE1-OG1 3.06Å
390	P	57	Low	78.2	Confident	96 Å²	96	54 Å²	54	62%	0.623	34%	0.344	S	S	*	.			trans	-56.2	140.6	168	23.2	-29.2	0	0	0	108.7	R392 T393	P390-R392 PolarHBondContact O-N 2.89Å; P390-T393 HydrophobicContact CG-CG2 3.85Å; P390-T393 PolarHBondContact O-OG1 2.99Å
391	D	61.9	Low	77.9	Confident	115 Å²	115	54.1 Å²	54.1	62%	0.615	34%	0.344	S	S	*	.	S	Bend	trans	-45.7	129.7	-179.7	-171.7	24.5	0	0	0	110.5	Q389	Q389-D391 PolarHBondContact O-N 3.29Å
392	R	65.5	Low	77.5	Confident	51 Å²	51	53.4 Å²	53.4	19%	0.192	34%	0.343	C	S	.	.	S	Bend	trans	71.4	48.6	173.1	-48.1	165.1	-154	-177.6	7.4	115.5	D124 P390 K402 N404	D124-R392 WeakPolarHBondContact OD2-CB 3.48Å; P390-R392 PolarHBondContact O-N 2.89Å; R392-K402 HydrophobicContact CB-CD 4.22Å; R392-N404 PolarHBondContact NH1-OD1 3.21Å
393	T	81.3	Confident	76.6	Confident	14 Å²	14	53.8 Å²	53.8	9%	0.086	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.6	163.9	50.8	0	0	0	0	112.2	R147 Q389 P390 R397	R147-T393 PolarHBondContact NH1-O 3.01Å; Q389-T393 WeakPolarHBondContact CB-OG1 3.28Å; Q389-T393 PolarHBondContact OE1-OG1 3.06Å; P390-T393 HydrophobicContact CG-CG2 3.85Å; P390-T393 PolarHBondContact O-OG1 2.99Å; T393-R397 WeakPolarHBondContact CA-O 3.3Å
394	M	88.2	Confident	75.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	120.3	178.4	-176.8	173.8	139.2	0	0	109.4	R145 L146 R147 D168 D170 P382 G396 R397	R145-M394 HydrophobicContact CG-CE 4.36Å; L146-M394 WeakPolarHBondContact O-CE 3.3Å; R147-M394 HydrophobicContact CB-SD 3.5Å; R147-M394 VanDerWaalsContact CB-SD 3.5Å; R147-M394 HydrophobicContact CG-SD 3.93Å; D168-M394 HydrophobicContact CB-CE 3.98Å; D170-M394 HydrophobicContact CB-CE 3.57Å; D170-M394 HydrophobicContact CB-CG 4.42Å; D170-M394 HydrophobicContact CB-SD 3.51Å; D170-M394 VanDerWaalsContact CB-SD 3.51Å; P382-M394 HydrophobicContact CB-CG 3.95Å; P382-M394 CarbonylContact O-C 3.57Å; P382-M394 WeakPolarHBondContact O-CA 3.35Å; M394-G396 PolarHBondContact O-N 3.24Å; M394-R397 PolarHBondContact N-O 3.12Å; M394-R397 PolarHBondContact O-N 2.77Å
395	W	91.1	Very high	74	Confident	25 Å²	25	56.7 Å²	56.7	10%	0.095	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	48.4	-170.7	-62.3	-67.9	0	0	0	112.3	D168 L169 R193 A380 R381 P382 R397	D168-W395 HydrophobicContact CB-CE3 4.19Å; D168-W395 HydrophobicContact CB-CZ3 3.91Å; L169-W395 WeakPolarHBondContact O-CH2 3.19Å; R193-W395 HydrophobicContact CB-CD2 3.7Å; R193-W395 HydrophobicContact CB-CE3 3.41Å; R193-W395 VanDerWaalsContact CB-CE3 3.41Å; R193-W395 HydrophobicContact CB-CG 4.49Å; R193-W395 HydrophobicContact CB-CH2 3.65Å; R193-W395 HydrophobicContact CB-CZ2 3.91Å; R193-W395 HydrophobicContact CB-CZ3 3.31Å; R193-W395 HydrophobicContact CG-CD2 4.29Å; R193-W395 HydrophobicContact CG-CE3 4.28Å; R193-W395 PolarHBondContact NH1-O 3.03Å; R193-W395 VanDerWaalsContact NH1-O 3.15Å; R193-W395 VanDerWaalsContact O-CH2 3.29Å; R193-W395 WeakPolarHBondContact O-CH2 3.3Å; R193-W395 WeakPolarHBondContact O-CZ3 3.49Å; A380-W395 PolarHBondContact O-NE1 3.24Å; R381-W395 PolarHBondContact O-NE1 3.12Å; P382-W395 HydrophobicContact CB-CZ2 4.15Å; P382-W395 HydrophobicContact CG-CH2 4.35Å; P382-W395 HydrophobicContact CG-CZ2 3.73Å; P382-W395 PolarHBondContact O-N 3.42Å; W395-R397 PolarHBondContact O-N 2.82Å
396	G	87.9	Confident	72.8	Confident	52 Å²	52	63.3 Å²	63.3	54%	0.536	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	12.9	179.2	0	0	0	0	0	115	M394	M394-G396 PolarHBondContact O-N 3.24Å
397	R	88.7	Confident	71.7	Confident	113 Å²	113	63.1 Å²	63.1	43%	0.426	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.6	-179.9	-55	-175.5	-174.7	-173.8	-5.3	111.4	R193 T393 M394 W395	R193-R397 VanDerWaalsContact NH2-CZ 3.27Å; R193-R397 VanDerWaalsContact NH2-NH1 3.17Å; T393-R397 WeakPolarHBondContact CA-O 3.3Å; M394-R397 PolarHBondContact N-O 3.12Å; M394-R397 PolarHBondContact O-N 2.77Å; W395-R397 PolarHBondContact O-N 2.82Å
398	G	86.9	Confident	70.6	Confident	36 Å²	36	66 Å²	66	37%	0.371	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	157.4	175.9	0	0	0	0	0	113.1	R145	R145-G398 PolarHBondContact NH1-O 2.89Å; R145-G398 VanDerWaalsContact NH1-O 3.09Å
399	C	89.8	Confident	69.9	Low	8 Å²	8	70.7 Å²	70.7	5%	0.054	36%	0.362	C	S	.	.			trans	-97.9	137.5	165.4	-63.5	0	0	0	0	109.7	D124 K402	D124-C399 HydrophobicContact CB-CB 3.78Å; C399-K402 HydrophobicContact CB-CG 4.47Å; C399-K402 WeakPolarHBondContact O-CE 3.44Å
400	R	90.1	Very high	68.6	Low	88 Å²	88	76 Å²	76	33%	0.332	42%	0.417	S	S	.	.	S	Bend	trans	-72.4	-54.8	178.7	178.6	-170.1	166.6	-128.5	-14.2	110.7	C92 G93 L119 S122	C92-R400 PolarHBondContact O-NH2 3.08Å; G93-R400 PolarHBondContact O-NE 3.24Å; G93-R400 PolarHBondContact O-NH2 3.3Å; L119-R400 VanDerWaalsContact CD2-NH1 3.34Å; L119-R400 PolarHBondContact O-NH1 3.34Å; S122-R400 PolarHBondContact O-N 2.97Å; S122-R400 PolarHBondContact OG-N 3.43Å
401	L	91.2	Very high	69.2	Low	1 Å²	1	75 Å²	75	1%	0.005	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.2	-176.9	-63.3	-178.5	0	0	0	108.6	L97 L100 L119 W120 S122 V123 D124	L97-L401 HydrophobicContact CB-CB 4.15Å; L97-L401 HydrophobicContact CB-CD2 4.43Å; L97-L401 HydrophobicContact CD1-CB 4.35Å; L97-L401 HydrophobicContact CD1-CD1 4.32Å; L97-L401 HydrophobicContact CD2-CB 4.44Å; L100-L401 HydrophobicContact CD2-CD1 3.98Å; L100-L401 HydrophobicContact CD2-CD2 3.95Å; L119-L401 WeakPolarHBondContact O-CD1 3.33Å; W120-L401 HydrophobicContact CB-CD1 4.39Å; W120-L401 HydrophobicContact CD2-CD1 3.52Å; W120-L401 HydrophobicContact CE3-CD1 3.56Å; W120-L401 HydrophobicContact CG-CD1 3.92Å; W120-L401 HydrophobicContact CH2-CD1 4.47Å; W120-L401 HydrophobicContact CZ2-CD1 4.45Å; W120-L401 HydrophobicContact CZ3-CD1 4.05Å; S122-L401 PolarHBondContact O-N 3.43Å; V123-L401 CarbonylContact C-O 3.53Å; V123-L401 WeakPolarHBondContact CA-O 3.44Å; V123-L401 HydrophobicContact CG2-CB 4.22Å; V123-L401 HydrophobicContact CG2-CD1 4.31Å; D124-L401 PolarHBondContact N-O 3.39Å
402	K	86.4	Confident	69.5	Low	54 Å²	54	72.8 Å²	72.8	24%	0.235	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	149.3	-177.1	-49.3	-174.1	-172.2	-178.1	0	110.1	L97 D124 R392 C399	L97-K402 WeakPolarHBondContact CB-O 3.32Å; D124-K402 HydrophobicContact CB-CB 4.44Å; D124-K402 HydrophobicContact CB-CG 4.15Å; R392-K402 HydrophobicContact CB-CD 4.22Å; C399-K402 HydrophobicContact CB-CG 4.47Å; C399-K402 WeakPolarHBondContact O-CE 3.44Å
403	L	74.2	Confident	69.8	Low	11 Å²	11	74.1 Å²	74.1	6%	0.058	41%	0.407	C	S	.	.			trans	-84.7	121.8	168	-70.1	155.1	0	0	0	109.4	P34 L97 L125 L128 I405	P34-L403 HydrophobicContact CB-CD2 4.03Å; L97-L403 HydrophobicContact CD2-CD2 4.12Å; L97-L403 HydrophobicContact CD2-CG 3.89Å; L125-L403 HydrophobicContact CD2-CD1 4.14Å; L128-L403 HydrophobicContact CD1-CD1 3.5Å; L128-L403 HydrophobicContact CD2-CD1 3.29Å; L128-L403 HydrophobicContact CD2-CG 4.47Å; L128-L403 HydrophobicContact CG-CD1 3.23Å; L403-I405 HydrophobicContact CB-CD1 4.44Å; L403-I405 HydrophobicContact CB-CG1 4.05Å; L403-I405 PolarHBondContact O-N 3.4Å
404	N	63.5	Low	69.1	Low	74 Å²	74	77.6 Å²	77.6	40%	0.396	43%	0.426	S	S	.	.			trans	-83.3	94.9	168.1	-79.3	-15.9	0	0	0	107.8	R392 Y406	R392-N404 PolarHBondContact NH1-OD1 3.21Å; N404-Y406 VanDerWaalsContact C-N 3.31Å
405	I	54.6	Low	67.9	Low	77 Å²	77	82.4 Å²	82.4	40%	0.395	45%	0.453	S	S	.	.			trans	-84.2	-12.9	177.2	-53.5	177.9	0	0	0	110.8	E126 G127 L403	E126-I405 WeakPolarHBondContact O-CD1 3.34Å; G127-I405 VanDerWaalsContact C-CD1 3.43Å; G127-I405 WeakPolarHBondContact O-CD1 3.26Å; L403-I405 HydrophobicContact CB-CD1 4.44Å; L403-I405 HydrophobicContact CB-CG1 4.05Å; L403-I405 PolarHBondContact O-N 3.4Å
406	Y	46.3	Very low	66.3	Low	198 Å²	198	86.3 Å²	86.3	78%	0.776	48%	0.477	S	S	*	.	S	Bend	trans	-105.8	15	-173	-67	-71.9	0	0	0	116.3	N404	N404-Y406 VanDerWaalsContact C-N 3.31Å
407	S	38.7	Very low	64.8	Low	85 Å²	85	88.7 Å²	88.7	59%	0.594	47%	0.473	S	S	*	.			trans	-94.7	24.2	179.3	57.2	0	0	0	0	114.9
408	N	33.8	Very low	63	Low	108 Å²	108	86.8 Å²	86.8	58%	0.578	48%	0.476	S	S	*	.	S	Bend	trans	-126.3	35.3	178	-83.1	12.6	0	0	0	113.5
409	F	33.8	Very low	61	Low	211 Å²	211	91.1 Å²	91.1	93%	0.925	49%	0.485	S	S	*	.			trans	-141.8	80.7	160.4	-74.7	-76.5	0	0	0	108.7
410	A	29.5	Very low	58.4	Low	178 Å²	178	98.6 Å²	98.6	100%	1.471	52%	0.524	S	S	*	.			trans	-149.6	0	160.8	0	0	0	0	0	108.5

Retrieved 410 of 410 residues in 286 ms (Link to these results)

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