X5DP84_HUMAN Loading...

Neurotrophic tyrosine kinase receptor type 3 isoform A

AlphaFold DB , UniProt , Accession X5DP84, Species HUMAN (Homo sapiens, Human), Gene NTRK3, Length 520 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	28.1	Very low	236 Å²	236	137.7 Å²	137.7	100%	1.163	81%	0.812	S	S	*	*				0	102.9	0	-76.5	-176.3	177.6	0	0	105.5
2	D	27.6	Very low	27.9	Very low	148 Å²	148	143.2 Å²	143.2	79%	0.791	82%	0.818	S	S	*	*			trans	-77.5	129.3	-148.5	-58.5	-62.9	0	0	0	113
3	V	25.8	Very low	27.6	Very low	132 Å²	132	148.7 Å²	148.7	80%	0.8	82%	0.818	S	S	*	*				75.5	123.7	100.7	-175.4	0	0	0	0	114.4
4	S	25.8	Very low	27.5	Very low	90 Å²	90	152.9 Å²	152.9	63%	0.629	82%	0.815	S	S	*	*			trans	-79.2	173.4	-174.4	50.5	0	0	0	0	116.7
5	L	26.6	Very low	27.7	Very low	162 Å²	162	152.3 Å²	152.3	85%	0.848	81%	0.81	S	S	*	*			trans	99.8	126.7	147.1	-73.9	143.8	0	0	0	119.9
6	C	29.7	Very low	27.8	Very low	120 Å²	120	156.1 Å²	156.1	81%	0.811	82%	0.818	S	S	*	*			trans	-41.2	161.4	153.6	-100.2	0	0	0	0	113.3
7	P	35.2	Very low	28.1	Very low	130 Å²	130	156.2 Å²	156.2	84%	0.844	82%	0.819	S	S	*	*				-157.4	-164.9	58.3	40.7	-16	0	0	0	117.1
8	A	29.1	Very low	28.3	Very low	90 Å²	90	157.6 Å²	157.6	74%	0.744	83%	0.826	S	S	*	*			trans	-75.9	170	-171.9	0	0	0	0	0	117.9
9	K	27.1	Very low	28.4	Very low	197 Å²	197	153.7 Å²	153.7	86%	0.857	83%	0.827	S	S	*	*			trans	93.1	133.5	152.4	-77.7	-176.4	176.3	177.6	0	120.9
10	C	23.5	Very low	28.5	Very low	119 Å²	119	151.6 Å²	151.6	80%	0.804	83%	0.825	S	S	*	*			trans	81.7	109.2	146.8	-79.8	0	0	0	0	119.9
11	S	24.3	Very low	28.8	Very low	91 Å²	91	150.8 Å²	150.8	64%	0.636	83%	0.825	S	S	*	*			trans	59	114.9	132.9	-175.8	0	0	0	0	117.2
12	F	25.1	Very low	28.7	Very low	203 Å²	203	151.3 Å²	151.3	89%	0.89	81%	0.814	S	S	*	*				-161.8	137.4	112	-111.9	-82.9	0	0	0	110.3
13	W	24.9	Very low	29.1	Very low	215 Å²	215	152.3 Å²	152.3	81%	0.814	82%	0.818	S	S	*	*			trans	-51.5	162	179.2	-90.4	31.9	0	0	0	115.6
14	R	25.5	Very low	29.4	Very low	208 Å²	208	153.3 Å²	153.3	79%	0.785	82%	0.819	S	S	*	*			trans	107	119.4	144.1	-88.3	170.4	-179	-155.4	0.8	117.7
15	I	31.1	Very low	29.6	Very low	143 Å²	143	159.1 Å²	159.1	73%	0.733	83%	0.829	S	S	*	*			trans	94.4	87.6	151.3	-53	145.3	0	0	0	114.3
16	F	28.3	Very low	30.2	Very low	213 Å²	213	158.1 Å²	158.1	93%	0.934	83%	0.829	S	S	*	*				-149.9	87.1	124.3	-102.8	-76.8	0	0	0	108.4
17	L	34.3	Very low	30.4	Very low	159 Å²	159	154.3 Å²	154.3	83%	0.832	81%	0.811	S	S	*	*			trans	-82.9	119.9	157	-91.3	162.3	0	0	0	106.5
18	L	31.9	Very low	30.8	Very low	181 Å²	181	152.4 Å²	152.4	95%	0.948	80%	0.8	S	S	*	*			trans	166.1	106	135.8	-88.2	159.4	0	0	0	109
19	G	29.8	Very low	31.9	Very low	83 Å²	83	153.6 Å²	153.6	86%	0.856	80%	0.798	S	S	*	*			trans	159.5	34.6	173.2	0	0	0	0	0	115.9
20	S	29.9	Very low	33.2	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	76%	0.764	S	S	*	*			trans	-145.9	85.3	171.6	60.1	0	0	0	0	110.1
21	V	35.2	Very low	35.3	Very low	134 Å²	134	141.6 Å²	141.6	81%	0.812	74%	0.74	S	S	*	*			trans	-128.3	114.4	159.1	179.2	0	0	0	0	105.4
22	W	33.1	Very low	38	Very low	247 Å²	247	139.1 Å²	139.1	94%	0.936	72%	0.723	S	S	*	*			trans	144.6	59.6	163.5	-87.8	92.2	0	0	0	110.1
23	L	34.9	Very low	40.8	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	69%	0.686	S	S	*	*			trans	-157.8	67.1	161.3	-115.5	146.1	0	0	0	108.6
24	D	32.1	Very low	43.4	Very low	153 Å²	153	123.9 Å²	123.9	82%	0.818	68%	0.678	S	S	*	*			trans	-119	95.5	162.8	-80.6	-38.2	0	0	0	108.1
25	Y	30.4	Very low	46.3	Very low	211 Å²	211	117.2 Å²	117.2	83%	0.827	66%	0.658	S	S	*	*			trans	-140.5	93.7	150.7	-143.7	-92.5	0	0	0	108.5	G27	Y25-G27 PolarHBondContact O-N 2.84Å
26	V	38.3	Very low	49.1	Very low	141 Å²	141	111 Å²	111	86%	0.855	63%	0.627	S	S	*	*			trans	-66.9	112.5	170.4	177.7	0	0	0	0	107.9
27	G	35	Very low	52.1	Low	41 Å²	41	105.1 Å²	105.1	42%	0.423	61%	0.608	S	S	.	*			trans	-159.6	110.5	167.5	0	0	0	0	0	107.5	Y25 V29	Y25-G27 PolarHBondContact O-N 2.84Å; G27-V29 WeakPolarHBondContact O-CG2 3.43Å; G27-V29 PolarHBondContact O-N 3.46Å
28	S	43.9	Very low	54.8	Low	89 Å²	89	99.6 Å²	99.6	62%	0.622	58%	0.583	S	S	*	*			trans	-43.6	105.4	173.6	24.5	0	0	0	0	112	L30 I71	S28-L30 PolarHBondContact O-N 3.38Å; S28-I71 WeakPolarHBondContact OG-CD1 3.27Å
29	V	50.5	Low	57.4	Low	115 Å²	115	93.8 Å²	93.8	70%	0.697	56%	0.557	S	S	*	*			trans	-86.2	104.1	-175.1	-178	0	0	0	0	108.4	G27	G27-V29 WeakPolarHBondContact O-CG2 3.43Å; G27-V29 PolarHBondContact O-N 3.46Å
30	L	55.3	Low	60.1	Low	27 Å²	27	97.3 Å²	97.3	14%	0.141	55%	0.549	C	S	.	.			trans	-55.7	143	153	-95.6	75.9	0	0	0	108.1	S28 C32 L57 E58 I71 I73 I76	S28-L30 PolarHBondContact O-N 3.38Å; L30-C32 PolarHBondContact O-N 3.11Å; L30-L57 HydrophobicContact CD2-CB 4.18Å; L30-E58 WeakPolarHBondContact CG-O 3.49Å; L30-I71 HydrophobicContact CD1-CG2 3.9Å; L30-I73 HydrophobicContact CD2-CB 4.46Å; L30-I73 HydrophobicContact CD2-CD1 3.65Å; L30-I73 HydrophobicContact CD2-CG1 3.72Å; L30-I76 HydrophobicContact CD1-CD1 3.37Å; L30-I76 HydrophobicContact CD2-CD1 4.33Å; L30-I76 HydrophobicContact CG-CD1 4.44Å
31	A	68.6	Low	63	Low	38 Å²	38	94.4 Å²	94.4	31%	0.314	53%	0.527	S	S	.	.	B	Isolated β-bridge	trans	-65.1	105.6	176.9	0	0	0	0	0	108.4	E58	A31-E58 HydrophobicContact CB-CB 4.13Å; A31-E58 PolarHBondContact N-O 2.88Å; A31-E58 PolarHBondContact O-N 3.05Å
32	C	81	Confident	65.8	Low	39 Å²	39	92.7 Å²	92.7	26%	0.264	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-59.8	138.4	168.8	-173.6	0	0	0	0	107.9	L30 C36 C38	L30-C32 PolarHBondContact O-N 3.11Å; C32-C36 VanDerWaalsContact SG-C 3.56Å; C32-C36 PolarHBondContact SG-O 3.15Å; C32-C38 VanDerWaalsContact CA-SG 3.52Å; C32-C38 HydrophobicContact CB-CB 3.66Å; C32-C38 WeakPolarHBondContact CB-SG 3.36Å; C32-C38 WeakPolarHBondContact SG-CB 3.22Å; C32-C38 PolarHBondContact SG-N 3.28Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 3.02Å
33	P	83.7	Confident	68.6	Low	19 Å²	19	81 Å²	81	12%	0.123	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-50.8	145.8	177.3	-27.5	34.4	0	0	0	111.4	N35 C36 P55 L56	P33-N35 PolarHBondContact O-N 3.03Å; P33-C36 HydrophobicContact CB-CB 4.24Å; P33-C36 WeakPolarHBondContact O-CB 3.39Å; P33-C36 PolarHBondContact O-N 3.32Å; P33-C36 VanDerWaalsContact O-N 3.07Å; P33-P55 HydrophobicContact CB-CB 3.9Å; P33-P55 HydrophobicContact CG-CB 3.74Å; P33-L56 WeakPolarHBondContact CG-O 3.38Å
34	A	79.4	Confident	71.5	Confident	78 Å²	78	75 Å²	75	65%	0.645	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	142.4	174.6	0	0	0	0	0	110	C36	A34-C36 PolarHBondContact O-N 3.25Å; A34-C36 VanDerWaalsContact O-N 3.08Å
35	N	85.3	Confident	74.4	Confident	69 Å²	69	67.7 Å²	67.7	37%	0.369	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	6.8	-178.6	-56.9	-43.5	0	0	0	116.6	P33 R47 D49	P33-N35 PolarHBondContact O-N 3.03Å; N35-R47 HydrophobicContact CB-CB 4.24Å; N35-D49 WeakPolarHBondContact CB-OD2 3.31Å; N35-D49 PolarHBondContact ND2-OD2 3.39Å
36	C	90.3	Very high	77.4	Confident	13 Å²	13	64.4 Å²	64.4	9%	0.088	38%	0.382	C	S	.	.			trans	-107.1	159.3	173.4	-56.8	0	0	0	0	112.5	C32 P33 A34 I43 N44 C45	C32-C36 VanDerWaalsContact SG-C 3.56Å; C32-C36 PolarHBondContact SG-O 3.15Å; P33-C36 HydrophobicContact CB-CB 4.24Å; P33-C36 WeakPolarHBondContact O-CB 3.39Å; P33-C36 PolarHBondContact O-N 3.32Å; P33-C36 VanDerWaalsContact O-N 3.07Å; A34-C36 PolarHBondContact O-N 3.25Å; A34-C36 VanDerWaalsContact O-N 3.08Å; C36-I43 HydrophobicContact CB-CG2 4.38Å; C36-N44 WeakPolarHBondContact CA-O 3.44Å; C36-C45 HydrophobicContact CB-CB 4.07Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.37Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.86Å
37	V	91.3	Very high	79.7	Confident	88 Å²	88	64.8 Å²	64.8	53%	0.533	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	120.4	168.3	-179.6	0	0	0	0	107.4	N44	V37-N44 PolarHBondContact N-O 2.85Å; V37-N44 PolarHBondContact O-N 2.81Å
38	C	89.9	Confident	82.2	Confident	43 Å²	43	67.6 Å²	67.6	29%	0.291	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.5	-176.7	-57.2	0	0	0	0	110.5	C32 E42	C32-C38 VanDerWaalsContact CA-SG 3.52Å; C32-C38 HydrophobicContact CB-CB 3.66Å; C32-C38 WeakPolarHBondContact CB-SG 3.36Å; C32-C38 WeakPolarHBondContact SG-CB 3.22Å; C32-C38 PolarHBondContact SG-N 3.28Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 3.02Å; C38-E42 CarbonylContact C-O 3.51Å; C38-E42 WeakPolarHBondContact CA-O 3.43Å
39	S	88.4	Confident	84.1	Confident	60 Å²	60	64.7 Å²	64.7	42%	0.42	36%	0.356	S	S	.	.			trans	-115.7	-176.7	166.1	81.5	0	0	0	0	109.2	T41 E42	S39-T41 PolarHBondContact O-N 2.94Å; S39-T41 PolarHBondContact OG-N 3Å; S39-E42 PolarHBondContact N-O 2.85Å; S39-E42 WeakPolarHBondContact OG-CB 3.39Å; S39-E42 PolarHBondContact OG-N 2.83Å
40	K	86	Confident	85.6	Confident	156 Å²	156	66 Å²	66	68%	0.678	36%	0.359	S	S	*	.	S	Bend	trans	-63.5	-20.7	176.1	-67	-175.3	178.9	-179.8	0	113.5	N79	K40-N79 PolarHBondContact O-ND2 2.67Å
41	T	90.4	Very high	86.9	Confident	51 Å²	51	66 Å²	66	31%	0.313	37%	0.365	S	S	.	.	S	Bend	trans	-130.5	-8.8	-173.2	54.8	0	0	0	0	113.5	S39 N79 I80 T81 S82	S39-T41 PolarHBondContact O-N 2.94Å; S39-T41 PolarHBondContact OG-N 3Å; T41-N79 WeakPolarHBondContact CA-O 3.35Å; T41-I80 CarbonylContact O-C 3.59Å; T41-I80 WeakPolarHBondContact O-CA 3.48Å; T41-T81 PolarHBondContact O-N 3.45Å; T41-T81 PolarHBondContact O-OG1 3.04Å; T41-S82 PolarHBondContact O-N 3.33Å; T41-S82 VanDerWaalsContact O-N 3.17Å
42	E	93	Very high	87.6	Confident	99 Å²	99	69.3 Å²	69.3	46%	0.463	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141	-172.1	-51.8	-171.3	157.8	0	0	112.2	C38 S39 S82	C38-E42 CarbonylContact C-O 3.51Å; C38-E42 WeakPolarHBondContact CA-O 3.43Å; S39-E42 PolarHBondContact N-O 2.85Å; S39-E42 WeakPolarHBondContact OG-CB 3.39Å; S39-E42 PolarHBondContact OG-N 2.83Å; E42-S82 CarbonylContact C-O 3.55Å; E42-S82 VanDerWaalsContact CA-O 3.26Å; E42-S82 WeakPolarHBondContact CA-O 3.26Å
43	I	93.6	Very high	87.8	Confident	2 Å²	2	73.7 Å²	73.7	1%	0.01	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.9	168.9	-57	175.6	0	0	0	107.5	C36 L57 I80 S82 I83 H84 Y102	C36-I43 HydrophobicContact CB-CG2 4.38Å; I43-L57 HydrophobicContact CD1-CD1 4.4Å; I43-L57 HydrophobicContact CD1-CD2 4Å; I43-L57 HydrophobicContact CD1-CG 4.02Å; I43-L57 HydrophobicContact CG1-CD2 4.5Å; I43-I80 HydrophobicContact CD1-CG1 4.3Å; I43-I80 HydrophobicContact CD1-CG2 4.24Å; I43-I80 HydrophobicContact CG1-CD1 4.15Å; I43-I80 HydrophobicContact CG1-CG1 4.43Å; I43-I80 HydrophobicContact CG1-CG2 4.16Å; I43-S82 PolarHBondContact N-O 3.39Å; I43-I83 HydrophobicContact CB-CG1 4.27Å; I43-I83 HydrophobicContact CD1-CG1 4.35Å; I43-I83 CarbonylContact O-C 3.59Å; I43-I83 WeakPolarHBondContact O-CA 3.49Å; I43-H84 PolarHBondContact O-N 2.87Å; I43-Y102 HydrophobicContact CD1-CE1 3.86Å
44	N	94.7	Very high	88	Confident	42 Å²	42	73.2 Å²	73.2	23%	0.225	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	105.4	-174.4	-169.1	13.1	0	0	0	111.6	C36 V37 R46 H84	C36-N44 WeakPolarHBondContact CA-O 3.44Å; V37-N44 PolarHBondContact N-O 2.85Å; V37-N44 PolarHBondContact O-N 2.81Å; N44-R46 PolarHBondContact ND2-NE 2.88Å; N44-R46 VanDerWaalsContact OD1-CG 3.29Å; N44-R46 WeakPolarHBondContact OD1-CG 3.18Å; N44-R46 PolarHBondContact OD1-NE 2.85Å; N44-H84 CarbonylContact C-O 3.57Å; N44-H84 PolarHBondContact OD1-CD2 2.92Å
45	C	93.8	Very high	88.2	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	79.2	-175.8	-48.9	0	0	0	0	109.7	C36 H84 I85 E86 W88	C36-C45 HydrophobicContact CB-CB 4.07Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.37Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.86Å; C45-H84 PolarHBondContact N-O 2.87Å; C45-I85 HydrophobicContact CB-CG1 4.44Å; C45-E86 PolarHBondContact O-N 3.2Å; C45-W88 HydrophobicContact CB-CZ2 3.64Å
46	R	91.9	Very high	88.1	Confident	143 Å²	143	69.7 Å²	69.7	54%	0.54	36%	0.364	S	S	.	.			trans	-96.5	-18.7	179.8	-67.9	178.3	-168.9	-175.2	-0.2	114.3	N44 E86 N87	N44-R46 PolarHBondContact ND2-NE 2.88Å; N44-R46 VanDerWaalsContact OD1-CG 3.29Å; N44-R46 WeakPolarHBondContact OD1-CG 3.18Å; N44-R46 PolarHBondContact OD1-NE 2.85Å; R46-E86 HydrophobicContact CG-CB 4.48Å; R46-N87 PolarHBondContact O-ND2 2.86Å
47	R	87.8	Confident	87.6	Confident	149 Å²	149	70 Å²	70	56%	0.562	37%	0.365	S	S	*	.	S	Bend	trans	-69.1	136.6	178.1	-66.6	-175.7	-170.4	139.2	4.1	107.8	N35 D49 W88	N35-R47 HydrophobicContact CB-CB 4.24Å; R47-D49 PolarHBondContact O-N 2.92Å; R47-W88 PolarHBondContact O-NE1 2.81Å
48	P	87.3	Confident	86.5	Confident	99 Å²	99	72.3 Å²	72.3	64%	0.643	37%	0.369	S	S	*	.			trans	-54.2	136.2	174	-21.9	31.9	0	0	0	110	N87	P48-N87 HydrophobicContact CB-CB 4.39Å; P48-N87 HydrophobicContact CG-CB 4.35Å
49	D	83.4	Confident	84.8	Confident	29 Å²	29	72.6 Å²	72.6	16%	0.155	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-134.9	137.7	177.3	-155.6	-47	0	0	0	108.6	N35 R47 G51 W88	N35-D49 WeakPolarHBondContact CB-OD2 3.31Å; N35-D49 PolarHBondContact ND2-OD2 3.39Å; R47-D49 PolarHBondContact O-N 2.92Å; D49-G51 VanDerWaalsContact C-N 3.32Å; D49-G51 WeakPolarHBondContact OD1-CA 3.1Å; D49-G51 PolarHBondContact OD1-N 2.91Å; D49-W88 HydrophobicContact CB-CD2 3.82Å; D49-W88 VanDerWaalsContact CB-CE2 3.49Å; D49-W88 HydrophobicContact CB-CE3 4.46Å; D49-W88 HydrophobicContact CB-CG 4.04Å; D49-W88 HydrophobicContact CB-CZ2 3.89Å
50	D	82.5	Confident	82.8	Confident	142 Å²	142	76.6 Å²	76.6	76%	0.759	39%	0.392	S	S	*	.			trans	-90	-3.7	175.6	-68	-36.6	0	0	0	111.7	S90	D50-S90 WeakPolarHBondContact O-CB 3.39Å; D50-S90 PolarHBondContact O-OG 3.08Å
51	G	81.6	Confident	80.5	Confident	26 Å²	26	77.1 Å²	77.1	27%	0.268	40%	0.402	S	S	.	.			trans	-65.2	146.6	175.3	0	0	0	0	0	113.2	D49 S90	D49-G51 VanDerWaalsContact C-N 3.32Å; D49-G51 WeakPolarHBondContact OD1-CA 3.1Å; D49-G51 PolarHBondContact OD1-N 2.91Å; G51-S90 WeakPolarHBondContact O-CB 3.49Å
52	N	84.3	Confident	78.1	Confident	108 Å²	108	79 Å²	79	58%	0.578	42%	0.417	S	S	*	.			trans	-106.3	-3.7	180	65.2	-15.2	0	0	0	113.4	S90	N52-S90 WeakPolarHBondContact CB-O 3.24Å
53	L	85.4	Confident	75.5	Confident	131 Å²	131	78.2 Å²	78.2	69%	0.686	44%	0.435	S	S	*	.	S	Bend	trans	-89.8	147.6	-178.2	-61.6	177	0	0	0	110.4	W88	L53-W88 VanDerWaalsContact O-CZ3 3.26Å; L53-W88 WeakPolarHBondContact O-CZ3 3.16Å
54	F	87.8	Confident	72.8	Confident	10 Å²	10	84.9 Å²	84.9	4%	0.044	47%	0.471	C	S	.	.			trans	-71.1	143.1	170.6	-168.5	-92.8	0	0	0	110.2	L56 I83 I85 L94 D98 M99 Y102 I110	F54-L56 HydrophobicContact CD1-CD2 4.47Å; F54-L56 PolarHBondContact O-N 2.8Å; F54-I83 HydrophobicContact CE1-CD1 4.33Å; F54-I83 HydrophobicContact CZ-CD1 4.23Å; F54-I83 HydrophobicContact CZ-CG2 4.12Å; F54-I85 HydrophobicContact CD2-CD1 3.89Å; F54-I85 HydrophobicContact CE2-CD1 3.46Å; F54-I85 VanDerWaalsContact CE2-CD1 3.46Å; F54-I85 HydrophobicContact CZ-CD1 3.99Å; F54-L94 HydrophobicContact CD2-CD1 3.36Å; F54-L94 HydrophobicContact CE2-CD1 3.48Å; F54-L94 VanDerWaalsContact CE2-CD1 3.48Å; F54-L94 HydrophobicContact CG-CD1 4.2Å; F54-L94 HydrophobicContact CZ-CD1 4.39Å; F54-D98 HydrophobicContact CB-CB 3.84Å; F54-D98 HydrophobicContact CD1-CB 3.95Å; F54-D98 HydrophobicContact CG-CB 3.9Å; F54-M99 HydrophobicContact CE1-SD 4.38Å; F54-M99 HydrophobicContact CE2-SD 4.23Å; F54-M99 HydrophobicContact CZ-SD 3.85Å; F54-Y102 HydrophobicContact CD1-CE2 4.44Å; F54-Y102 HydrophobicContact CE1-CD2 4.44Å; F54-Y102 AromaticContact CE1-CE2 3.79Å; F54-Y102 HydrophobicContact CE1-CE2 3.79Å; F54-I110 HydrophobicContact CE2-CD1 4.25Å
55	P	82.8	Confident	70.5	Confident	4 Å²	4	88 Å²	88	3%	0.026	50%	0.496	C	S	.	.			trans	-65.5	108.6	178.2	25.3	-33.6	0	0	0	111.1	P33 I85 W88 Y102	P33-P55 HydrophobicContact CB-CB 3.9Å; P33-P55 HydrophobicContact CG-CB 3.74Å; P55-I85 HydrophobicContact CG-CD1 3.58Å; P55-I85 HydrophobicContact CG-CG1 4.05Å; P55-W88 HydrophobicContact CB-CH2 4.22Å; P55-W88 HydrophobicContact CG-CH2 4.42Å; P55-Y102 PolarHBondContact O-OH 3.06Å
56	L	83.5	Confident	68.2	Low	69 Å²	69	95.3 Å²	95.3	36%	0.361	54%	0.535	S	S	.	.			trans	-105.1	130.3	175.2	-66.7	174.7	0	0	0	109.9	P33 F54 E58 L101 Y102	P33-L56 WeakPolarHBondContact CG-O 3.38Å; F54-L56 HydrophobicContact CD1-CD2 4.47Å; F54-L56 PolarHBondContact O-N 2.8Å; L56-E58 PolarHBondContact O-N 2.95Å; L56-L101 HydrophobicContact CD2-CD1 3.99Å; L56-Y102 HydrophobicContact CD2-CE2 4.42Å
57	L	81.2	Confident	66.1	Low	20 Å²	20	92.2 Å²	92.2	11%	0.105	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-59.1	131	171.7	-66	173.2	0	0	0	109.2	L30 I43 I73 I76 I80 Y102	L30-L57 HydrophobicContact CD2-CB 4.18Å; I43-L57 HydrophobicContact CD1-CD1 4.4Å; I43-L57 HydrophobicContact CD1-CD2 4Å; I43-L57 HydrophobicContact CD1-CG 4.02Å; I43-L57 HydrophobicContact CG1-CD2 4.5Å; L57-I73 HydrophobicContact CB-CD1 4.42Å; L57-I73 VanDerWaalsContact O-CD1 3.23Å; L57-I73 WeakPolarHBondContact O-CD1 3.39Å; L57-I76 HydrophobicContact CD1-CG2 4.02Å; L57-I80 HydrophobicContact CD1-CG1 4.13Å; L57-Y102 HydrophobicContact CD1-CE1 4.32Å
58	E	66.8	Low	63.8	Low	135 Å²	135	92.9 Å²	92.9	63%	0.631	56%	0.563	S	S	*	*	B	Isolated β-bridge	trans	-98.8	133.8	176.3	-75.6	-176	179.6	0	0	111	L30 A31 L56	L30-E58 WeakPolarHBondContact CG-O 3.49Å; A31-E58 HydrophobicContact CB-CB 4.13Å; A31-E58 PolarHBondContact N-O 2.88Å; A31-E58 PolarHBondContact O-N 3.05Å; L56-E58 PolarHBondContact O-N 2.95Å
59	G	55.7	Low	61.9	Low	49 Å²	49	92.5 Å²	92.5	51%	0.505	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-89.8	116.2	177.3	0	0	0	0	0	109.9	D61	G59-D61 PolarHBondContact O-N 2.82Å
60	Q	46.2	Very low	60.2	Low	144 Å²	144	96.8 Å²	96.8	67%	0.673	60%	0.601	S	S	*	*			trans	-81.5	101.4	173.8	-152.2	174.7	17	0	0	108.5	S62	Q60-S62 PolarHBondContact O-N 2.94Å
61	D	37.8	Very low	59	Low	168 Å²	168	93.9 Å²	93.9	90%	0.898	58%	0.584	S	S	*	*			trans	-65.1	86.2	163.8	-82.3	-24.5	0	0	0	108	G59 G63	G59-D61 PolarHBondContact O-N 2.82Å; D61-G63 VanDerWaalsContact C-N 3.3Å; D61-G63 PolarHBondContact O-N 2.85Å
62	S	38.3	Very low	58.2	Low	90 Å²	90	96.4 Å²	96.4	63%	0.629	59%	0.592	S	S	*	*			trans	-71.6	92.9	171.6	-63	0	0	0	0	107.4	Q60 N64	Q60-S62 PolarHBondContact O-N 2.94Å; S62-N64 PolarHBondContact O-N 2.77Å
63	G	39.3	Very low	57.4	Low	82 Å²	82	93.7 Å²	93.7	85%	0.845	58%	0.576	S	S	*	*			trans	-62.6	73.5	161.6	0	0	0	0	0	110	D61	D61-G63 VanDerWaalsContact C-N 3.3Å; D61-G63 PolarHBondContact O-N 2.85Å
64	N	36.9	Very low	56.7	Low	143 Å²	143	89.6 Å²	89.6	77%	0.765	56%	0.557	S	S	*	*			trans	-145.1	98.1	165.7	-141.4	29.5	0	0	0	108	S62 N66	S62-N64 PolarHBondContact O-N 2.77Å; N64-N66 PolarHBondContact O-N 2.82Å
65	S	47.1	Very low	55.9	Low	107 Å²	107	93.2 Å²	93.2	75%	0.748	58%	0.577	S	S	*	*			trans	-57.8	101.4	171.4	53	0	0	0	0	109.5
66	N	44	Very low	55.5	Low	153 Å²	153	95.4 Å²	95.4	82%	0.818	59%	0.588	S	S	*	*	S	Bend	trans	-163.2	119	142.8	-88	-25.4	0	0	0	107.1	N64 N68	N64-N66 PolarHBondContact O-N 2.82Å; N66-N68 PolarHBondContact O-N 2.82Å
67	G	49.1	Very low	55.4	Low	79 Å²	79	92.2 Å²	92.2	81%	0.814	57%	0.571	S	S	*	*			trans	-48.2	117.8	-161.7	0	0	0	0	0	114.5
68	N	39.8	Very low	55.5	Low	162 Å²	162	97.7 Å²	97.7	87%	0.866	59%	0.591	S	S	*	*			trans	-152.7	138.9	151.1	-87.6	-27.6	0	0	0	106.6	N66 S70	N66-N68 PolarHBondContact O-N 2.82Å; N68-S70 PolarHBondContact O-N 3.17Å
69	A	46.7	Very low	56.6	Low	92 Å²	92	95.2 Å²	95.2	76%	0.76	58%	0.582	S	S	*	*			trans	-39.8	127.3	-168.4	0	0	0	0	0	113.5	I71	A69-I71 PolarHBondContact O-N 3.21Å
70	S	47.8	Very low	58.4	Low	119 Å²	119	93 Å²	93	83%	0.832	56%	0.558	S	S	*	*			trans	-55.8	106.9	167.2	53.2	0	0	0	0	107.9	N68 N72	N68-S70 PolarHBondContact O-N 3.17Å; S70-N72 PolarHBondContact O-N 2.89Å
71	I	56.9	Low	60.7	Low	81 Å²	81	88 Å²	88	42%	0.415	54%	0.538	S	S	.	.			trans	-69.3	106.5	179.1	-67.2	170.9	0	0	0	106.7	S28 L30 A69 I73 I76	S28-I71 WeakPolarHBondContact OG-CD1 3.27Å; L30-I71 HydrophobicContact CD1-CG2 3.9Å; A69-I71 PolarHBondContact O-N 3.21Å; I71-I73 PolarHBondContact O-N 2.84Å; I71-I76 HydrophobicContact CG2-CD1 3.14Å; I71-I76 HydrophobicContact CG2-CG1 4.04Å
72	N	64.2	Low	63.6	Low	79 Å²	79	81 Å²	81	42%	0.422	50%	0.501	S	S	.	.			trans	-72.9	119.7	-178.2	-171.3	1	0	0	0	109.2	S70 T74 D75	S70-N72 PolarHBondContact O-N 2.89Å; N72-T74 PolarHBondContact ND2-OG1 3.45Å; N72-T74 PolarHBondContact O-N 2.84Å; N72-T74 VanDerWaalsContact O-N 3.14Å; N72-T74 PolarHBondContact OD1-N 2.83Å; N72-T74 PolarHBondContact OD1-OG1 2.85Å; N72-T74 VanDerWaalsContact OD1-OG1 3.1Å; N72-D75 HydrophobicContact CB-CB 4.49Å; N72-D75 PolarHBondContact O-N 2.87Å
73	I	68.8	Low	66.3	Low	50 Å²	50	76.7 Å²	76.7	26%	0.256	47%	0.471	S	S	.	.	H	α-helix	trans	-55.9	-34.2	-177.4	-165.3	143.2	0	0	0	112.1	L30 L57 I71 D75 I76 S77	L30-I73 HydrophobicContact CD2-CB 4.46Å; L30-I73 HydrophobicContact CD2-CD1 3.65Å; L30-I73 HydrophobicContact CD2-CG1 3.72Å; L57-I73 HydrophobicContact CB-CD1 4.42Å; L57-I73 VanDerWaalsContact O-CD1 3.23Å; L57-I73 WeakPolarHBondContact O-CD1 3.39Å; I71-I73 PolarHBondContact O-N 2.84Å; I73-D75 VanDerWaalsContact C-N 3.27Å; I73-D75 PolarHBondContact O-N 3.42Å; I73-I76 PolarHBondContact O-N 3.29Å; I73-S77 PolarHBondContact O-N 3.43Å; I73-S77 PolarHBondContact O-OG 3.43Å
74	T	70.6	Confident	69.1	Low	45 Å²	45	74.3 Å²	74.3	28%	0.276	44%	0.438	S	S	.	.	H	α-helix	trans	-63.6	-33.8	178.9	62.6	0	0	0	0	112.3	N72 I76 R78	N72-T74 PolarHBondContact ND2-OG1 3.45Å; N72-T74 PolarHBondContact O-N 2.84Å; N72-T74 VanDerWaalsContact O-N 3.14Å; N72-T74 PolarHBondContact OD1-N 2.83Å; N72-T74 PolarHBondContact OD1-OG1 2.85Å; N72-T74 VanDerWaalsContact OD1-OG1 3.1Å; T74-I76 VanDerWaalsContact C-N 3.33Å; T74-R78 WeakPolarHBondContact O-CB 3.44Å; T74-R78 VanDerWaalsContact O-CD 3.3Å; T74-R78 WeakPolarHBondContact O-CD 3.25Å; T74-R78 WeakPolarHBondContact O-CG 3.27Å; T74-R78 PolarHBondContact O-N 2.88Å; T74-R78 VanDerWaalsContact O-N 3.13Å
75	D	71	Confident	71.9	Confident	87 Å²	87	67.5 Å²	67.5	47%	0.465	40%	0.402	S	S	.	.	H	α-helix	trans	-75.1	-27.2	-178.4	-65.8	-27.8	0	0	0	111.9	N72 I73 R78	N72-D75 HydrophobicContact CB-CB 4.49Å; N72-D75 PolarHBondContact O-N 2.87Å; I73-D75 VanDerWaalsContact C-N 3.27Å; I73-D75 PolarHBondContact O-N 3.42Å; D75-R78 IonicContact OD1-CZ 2.77Å; D75-R78 IonicContact OD1-NH1 3.7Å; D75-R78 PolarHBondContact OD1-NH1 3.11Å
76	I	73.4	Confident	74.2	Confident	50 Å²	50	64.8 Å²	64.8	26%	0.256	38%	0.377	S	S	.	.	H	α-helix	trans	-80.7	-44.4	174.5	-65.8	-179.3	0	0	0	111.2	L30 L57 I71 I73 T74 R78 N79 I80	L30-I76 HydrophobicContact CD1-CD1 3.37Å; L30-I76 HydrophobicContact CD2-CD1 4.33Å; L30-I76 HydrophobicContact CG-CD1 4.44Å; L57-I76 HydrophobicContact CD1-CG2 4.02Å; I71-I76 HydrophobicContact CG2-CD1 3.14Å; I71-I76 HydrophobicContact CG2-CG1 4.04Å; I73-I76 PolarHBondContact O-N 3.29Å; T74-I76 VanDerWaalsContact C-N 3.33Å; I76-R78 PolarHBondContact O-N 2.78Å; I76-N79 WeakPolarHBondContact O-CA 3.41Å; I76-N79 WeakPolarHBondContact O-CB 3.22Å; I76-N79 PolarHBondContact O-N 2.76Å; I76-I80 PolarHBondContact O-N 2.79Å
77	S	81.2	Confident	76.5	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-57.8	-35	176.1	-50.3	0	0	0	0	111.7	I73 N79 I80 L101	I73-S77 PolarHBondContact O-N 3.43Å; I73-S77 PolarHBondContact O-OG 3.43Å; S77-N79 VanDerWaalsContact C-N 3.28Å; S77-N79 PolarHBondContact O-N 2.91Å; S77-I80 PolarHBondContact O-N 2.94Å; S77-L101 VanDerWaalsContact CB-O 3.22Å; S77-L101 WeakPolarHBondContact CB-O 3.45Å
78	R	84.4	Confident	78.6	Confident	135 Å²	135	56.2 Å²	56.2	51%	0.509	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-31.3	172.1	-78.8	168.7	179.5	169.4	-3.2	113.9	T74 D75 I76 I80 T103 G104	T74-R78 WeakPolarHBondContact O-CB 3.44Å; T74-R78 VanDerWaalsContact O-CD 3.3Å; T74-R78 WeakPolarHBondContact O-CD 3.25Å; T74-R78 WeakPolarHBondContact O-CG 3.27Å; T74-R78 PolarHBondContact O-N 2.88Å; T74-R78 VanDerWaalsContact O-N 3.13Å; D75-R78 IonicContact OD1-CZ 2.77Å; D75-R78 IonicContact OD1-NH1 3.7Å; D75-R78 PolarHBondContact OD1-NH1 3.11Å; I76-R78 PolarHBondContact O-N 2.78Å; R78-I80 VanDerWaalsContact C-N 3.34Å; R78-T103 WeakPolarHBondContact CG-OG1 3.41Å; R78-G104 WeakPolarHBondContact O-CA 3.32Å
79	N	89.3	Confident	81.1	Confident	83 Å²	83	57.8 Å²	57.8	44%	0.444	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-11.2	-177.1	-162	52.4	0	0	0	113.1	K40 T41 I76 S77 T81	K40-N79 PolarHBondContact O-ND2 2.67Å; T41-N79 WeakPolarHBondContact CA-O 3.35Å; I76-N79 WeakPolarHBondContact O-CA 3.41Å; I76-N79 WeakPolarHBondContact O-CB 3.22Å; I76-N79 PolarHBondContact O-N 2.76Å; S77-N79 VanDerWaalsContact C-N 3.28Å; S77-N79 PolarHBondContact O-N 2.91Å; N79-T81 PolarHBondContact O-N 2.77Å
80	I	92.9	Very high	83.3	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	28%	0.282	C	S	.	.			trans	-71.6	119.6	174.5	-58.4	-58.9	0	0	0	109.5	T41 I43 L57 I76 S77 R78 I83 Y102 G104 L105	T41-I80 CarbonylContact O-C 3.59Å; T41-I80 WeakPolarHBondContact O-CA 3.48Å; I43-I80 HydrophobicContact CD1-CG1 4.3Å; I43-I80 HydrophobicContact CD1-CG2 4.24Å; I43-I80 HydrophobicContact CG1-CD1 4.15Å; I43-I80 HydrophobicContact CG1-CG1 4.43Å; I43-I80 HydrophobicContact CG1-CG2 4.16Å; L57-I80 HydrophobicContact CD1-CG1 4.13Å; I76-I80 PolarHBondContact O-N 2.79Å; S77-I80 PolarHBondContact O-N 2.94Å; R78-I80 VanDerWaalsContact C-N 3.34Å; I80-I83 HydrophobicContact CG2-CD1 4.35Å; I80-I83 HydrophobicContact CG2-CG1 3.85Å; I80-Y102 HydrophobicContact CB-CD1 4.08Å; I80-Y102 HydrophobicContact CG1-CD1 4.35Å; I80-Y102 HydrophobicContact CG1-CE1 4.39Å; I80-Y102 HydrophobicContact CG2-CD1 4.31Å; I80-G104 CarbonylContact O-C 3.58Å; I80-L105 HydrophobicContact CG2-CD1 4.3Å; I80-L105 WeakPolarHBondContact O-CA 3.34Å; I80-L105 PolarHBondContact O-N 3.12Å
81	T	96.3	Very high	85.5	Confident	41 Å²	41	49.5 Å²	49.5	25%	0.252	24%	0.243	S	C	.	.			trans	-106.6	-19.8	179.5	60.6	0	0	0	0	112.6	T41 N79 Q106 K107	T41-T81 PolarHBondContact O-N 3.45Å; T41-T81 PolarHBondContact O-OG1 3.04Å; N79-T81 PolarHBondContact O-N 2.77Å; T81-Q106 WeakPolarHBondContact O-CA 3.46Å; T81-Q106 PolarHBondContact O-N 2.76Å; T81-K107 PolarHBondContact O-N 2.95Å
82	S	97.2	Very high	87.3	Confident	19 Å²	19	49.2 Å²	49.2	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.3	-179.7	-176.4	0	0	0	0	112.7	T41 E42 I43 K107	T41-S82 PolarHBondContact O-N 3.33Å; T41-S82 VanDerWaalsContact O-N 3.17Å; E42-S82 CarbonylContact C-O 3.55Å; E42-S82 VanDerWaalsContact CA-O 3.26Å; E42-S82 WeakPolarHBondContact CA-O 3.26Å; I43-S82 PolarHBondContact N-O 3.39Å; S82-K107 WeakPolarHBondContact CA-O 3.49Å
83	I	96.5	Very high	88.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.4	171.1	-64.4	170.7	0	0	0	108.5	I43 F54 I80 I85 Y102 L105 K107 L108 T109	I43-I83 HydrophobicContact CB-CG1 4.27Å; I43-I83 HydrophobicContact CD1-CG1 4.35Å; I43-I83 CarbonylContact O-C 3.59Å; I43-I83 WeakPolarHBondContact O-CA 3.49Å; F54-I83 HydrophobicContact CE1-CD1 4.33Å; F54-I83 HydrophobicContact CZ-CD1 4.23Å; F54-I83 HydrophobicContact CZ-CG2 4.12Å; I80-I83 HydrophobicContact CG2-CD1 4.35Å; I80-I83 HydrophobicContact CG2-CG1 3.85Å; I83-I85 HydrophobicContact CG2-CD1 4.15Å; I83-I85 HydrophobicContact CG2-CG1 4.04Å; I83-Y102 HydrophobicContact CD1-CD1 4.08Å; I83-Y102 HydrophobicContact CD1-CD2 3.82Å; I83-Y102 HydrophobicContact CD1-CE1 4.25Å; I83-Y102 HydrophobicContact CD1-CE2 4Å; I83-Y102 HydrophobicContact CD1-CG 3.84Å; I83-L105 HydrophobicContact CB-CD1 4.16Å; I83-L105 HydrophobicContact CD1-CD1 3.72Å; I83-L105 HydrophobicContact CD1-CD2 4.17Å; I83-L105 HydrophobicContact CG1-CD1 3.61Å; I83-K107 PolarHBondContact N-O 2.99Å; I83-L108 HydrophobicContact CB-CD1 4Å; I83-L108 HydrophobicContact CG2-CD1 4.04Å; I83-T109 PolarHBondContact O-N 2.79Å
84	H	97	Very high	90.1	Very high	33 Å²	33	45.5 Å²	45.5	15%	0.153	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.8	177.7	-177.2	97.3	0	0	0	110.3	I43 N44 C45 E86 T109	I43-H84 PolarHBondContact O-N 2.87Å; N44-H84 CarbonylContact C-O 3.57Å; N44-H84 PolarHBondContact OD1-CD2 2.92Å; C45-H84 PolarHBondContact N-O 2.87Å; H84-E86 IonicContact CE1-OE2 3.81Å; H84-E86 IonicContact NE2-OE2 2.96Å; H84-E86 PolarHBondContact NE2-OE2 3.09Å; H84-T109 CarbonylContact C-O 3.59Å; H84-T109 WeakPolarHBondContact ND1-CB 3.2Å; H84-T109 WeakPolarHBondContact ND1-CG2 3.41Å
85	I	95.4	Very high	91.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.1	178.3	-57.1	173.2	0	0	0	108	C45 F54 P55 I83 W88 L91 T109 I110 K111	C45-I85 HydrophobicContact CB-CG1 4.44Å; F54-I85 HydrophobicContact CD2-CD1 3.89Å; F54-I85 HydrophobicContact CE2-CD1 3.46Å; F54-I85 VanDerWaalsContact CE2-CD1 3.46Å; F54-I85 HydrophobicContact CZ-CD1 3.99Å; P55-I85 HydrophobicContact CG-CD1 3.58Å; P55-I85 HydrophobicContact CG-CG1 4.05Å; I83-I85 HydrophobicContact CG2-CD1 4.15Å; I83-I85 HydrophobicContact CG2-CG1 4.04Å; I85-W88 HydrophobicContact CG2-CB 3.98Å; I85-W88 HydrophobicContact CG2-CD2 3.72Å; I85-W88 HydrophobicContact CG2-CE3 4.2Å; I85-W88 HydrophobicContact CG2-CG 3.59Å; I85-L91 HydrophobicContact CD1-CD2 4.46Å; I85-L91 HydrophobicContact CG2-CD2 4.23Å; I85-T109 PolarHBondContact N-O 3.39Å; I85-I110 HydrophobicContact CB-CG1 4.38Å; I85-I110 HydrophobicContact CD1-CG1 4.31Å; I85-I110 WeakPolarHBondContact O-CA 3.26Å; I85-K111 PolarHBondContact O-N 3.36Å
86	E	95.1	Very high	92.3	Very high	49 Å²	49	42.4 Å²	42.4	23%	0.229	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	139.8	-178.1	-167	178.1	176.8	0	0	111.7	C45 R46 H84 W88 K111 N112	C45-E86 PolarHBondContact O-N 3.2Å; R46-E86 HydrophobicContact CG-CB 4.48Å; H84-E86 IonicContact CE1-OE2 3.81Å; H84-E86 IonicContact NE2-OE2 2.96Å; H84-E86 PolarHBondContact NE2-OE2 3.09Å; E86-W88 VanDerWaalsContact O-CD1 3.25Å; E86-K111 WeakPolarHBondContact CA-O 3.2Å; E86-N112 HydrophobicContact CG-CB 4.43Å
87	N	93.4	Very high	93.1	Very high	43 Å²	43	44.8 Å²	44.8	23%	0.23	22%	0.222	C	C	.	.	S	Bend	trans	69.2	24.5	179.5	-51.1	-53.6	0	0	0	115.6	R46 P48 R89 K111 N112 S113	R46-N87 PolarHBondContact O-ND2 2.86Å; P48-N87 HydrophobicContact CB-CB 4.39Å; P48-N87 HydrophobicContact CG-CB 4.35Å; N87-R89 PolarHBondContact O-N 3.48Å; N87-K111 PolarHBondContact N-O 3.04Å; N87-N112 VanDerWaalsContact CA-O 3.27Å; N87-N112 WeakPolarHBondContact CA-O 3.39Å; N87-N112 PolarHBondContact N-O 3.45Å; N87-N112 PolarHBondContact OD1-ND2 2.79Å; N87-S113 PolarHBondContact N-OG 3.3Å
88	W	93.5	Very high	93.5	Very high	10 Å²	10	45.7 Å²	45.7	4%	0.038	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-94.5	88.8	179.2	-74.6	32.9	0	0	0	109.9	C45 R47 D49 L53 P55 I85 E86 S90 L91 S113 G114	C45-W88 HydrophobicContact CB-CZ2 3.64Å; R47-W88 PolarHBondContact O-NE1 2.81Å; D49-W88 HydrophobicContact CB-CD2 3.82Å; D49-W88 VanDerWaalsContact CB-CE2 3.49Å; D49-W88 HydrophobicContact CB-CE3 4.46Å; D49-W88 HydrophobicContact CB-CG 4.04Å; D49-W88 HydrophobicContact CB-CZ2 3.89Å; L53-W88 VanDerWaalsContact O-CZ3 3.26Å; L53-W88 WeakPolarHBondContact O-CZ3 3.16Å; P55-W88 HydrophobicContact CB-CH2 4.22Å; P55-W88 HydrophobicContact CG-CH2 4.42Å; I85-W88 HydrophobicContact CG2-CB 3.98Å; I85-W88 HydrophobicContact CG2-CD2 3.72Å; I85-W88 HydrophobicContact CG2-CE3 4.2Å; I85-W88 HydrophobicContact CG2-CG 3.59Å; E86-W88 VanDerWaalsContact O-CD1 3.25Å; W88-S90 PolarHBondContact O-N 2.81Å; W88-L91 HydrophobicContact CB-CB 4.05Å; W88-L91 PolarHBondContact O-N 3.03Å; W88-S113 PolarHBondContact N-OG 2.86Å; W88-S113 VanDerWaalsContact N-OG 3.17Å; W88-S113 WeakPolarHBondContact O-CA 3.38Å; W88-S113 VanDerWaalsContact O-CB 3.31Å; W88-S113 WeakPolarHBondContact O-CB 3.47Å; W88-G114 PolarHBondContact O-N 3.2Å
89	R	91.7	Very high	93.9	Very high	194 Å²	194	39.2 Å²	39.2	73%	0.732	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-23.6	-167.8	-66.7	-174.6	178.2	179.3	1.6	114.2	N87 H92 G114	N87-R89 PolarHBondContact O-N 3.48Å; R89-H92 PolarHBondContact O-CE1 2.7Å; R89-G114 VanDerWaalsContact O-CA 3.3Å; R89-G114 WeakPolarHBondContact O-CA 3.29Å
90	S	93.6	Very high	94	Very high	37 Å²	37	40 Å²	40	26%	0.259	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-6.9	179.6	-53.9	0	0	0	0	113.3	D50 G51 N52 W88 H92	D50-S90 WeakPolarHBondContact O-CB 3.39Å; D50-S90 PolarHBondContact O-OG 3.08Å; G51-S90 WeakPolarHBondContact O-CB 3.49Å; N52-S90 WeakPolarHBondContact CB-O 3.24Å; W88-S90 PolarHBondContact O-N 2.81Å; S90-H92 PolarHBondContact O-CD2 3.13Å; S90-H92 PolarHBondContact O-N 3.27Å
91	L	93.9	Very high	93.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.221	C	C	.	.			trans	-75.2	90.2	175.8	-176.5	67.5	0	0	0	109.7	I85 W88 I110 G114 L115	I85-L91 HydrophobicContact CD1-CD2 4.46Å; I85-L91 HydrophobicContact CG2-CD2 4.23Å; W88-L91 HydrophobicContact CB-CB 4.05Å; W88-L91 PolarHBondContact O-N 3.03Å; L91-I110 HydrophobicContact CD2-CG2 4.18Å; L91-G114 CarbonylContact O-C 3.59Å; L91-L115 VanDerWaalsContact O-CA 3.23Å; L91-L115 WeakPolarHBondContact O-CA 3.47Å; L91-L115 PolarHBondContact O-N 3.17Å
92	H	94.8	Very high	93.6	Very high	75 Å²	75	41.3 Å²	41.3	35%	0.347	21%	0.209	S	C	.	.			trans	-91.4	-28.4	-174.3	-64.2	-40.7	0	0	0	114.7	R89 S90 G114 R116 S117	R89-H92 PolarHBondContact O-CE1 2.7Å; S90-H92 PolarHBondContact O-CD2 3.13Å; S90-H92 PolarHBondContact O-N 3.27Å; H92-G114 WeakPolarHBondContact CA-O 3.37Å; H92-G114 PolarHBondContact ND1-O 3.1Å; H92-R116 PolarHBondContact O-N 2.82Å; H92-S117 PolarHBondContact O-N 2.86Å
93	T	95.2	Very high	93.4	Very high	50 Å²	50	42.9 Å²	42.9	31%	0.307	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	138.2	-174.2	-56.7	0	0	0	0	109.8	S117 Q119	T93-S117 WeakPolarHBondContact CA-O 3.34Å; T93-S117 PolarHBondContact OG1-OG 2.91Å; T93-Q119 HydrophobicContact CG2-CG 4.3Å
94	L	96.1	Very high	93.3	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	118.3	168.1	-178.9	64.5	0	0	0	108.8	F54 M99 L108 I110 L115 S117 I118 Q119 F123	F54-L94 HydrophobicContact CD2-CD1 3.36Å; F54-L94 HydrophobicContact CE2-CD1 3.48Å; F54-L94 VanDerWaalsContact CE2-CD1 3.48Å; F54-L94 HydrophobicContact CG-CD1 4.2Å; F54-L94 HydrophobicContact CZ-CD1 4.39Å; L94-M99 HydrophobicContact CD1-CG 4.09Å; L94-M99 HydrophobicContact CD1-SD 3.92Å; L94-M99 HydrophobicContact CD2-CG 4.23Å; L94-M99 HydrophobicContact CD2-SD 4.18Å; L94-M99 HydrophobicContact CG-CG 4.2Å; L94-M99 HydrophobicContact CG-SD 4.43Å; L94-L108 HydrophobicContact CD2-CD2 4.32Å; L94-I110 HydrophobicContact CD1-CD1 4.4Å; L94-I110 HydrophobicContact CD2-CD1 4.08Å; L94-L115 HydrophobicContact CB-CD1 4.08Å; L94-S117 PolarHBondContact N-O 2.85Å; L94-S117 VanDerWaalsContact N-O 3.14Å; L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.27Å; L94-I118 HydrophobicContact CD2-CG2 4.19Å; L94-I118 HydrophobicContact CG-CG2 4.49Å; L94-Q119 PolarHBondContact O-N 3.23Å; L94-F123 HydrophobicContact CD2-CE1 3.78Å; L94-F123 HydrophobicContact CD2-CZ 3.94Å
95	N	94.3	Very high	93.3	Very high	52 Å²	52	42 Å²	42	28%	0.278	22%	0.217	S	C	.	.			trans	-91.3	157.6	-178.8	-49.3	-59.5	0	0	0	111.4	D98 Q119	N95-D98 VanDerWaalsContact CB-OD2 3.25Å; N95-D98 WeakPolarHBondContact CB-OD2 3.48Å; N95-D98 PolarHBondContact N-OD2 2.92Å; N95-D98 PolarHBondContact ND2-OD2 3.38Å; N95-D98 PolarHBondContact O-N 3.47Å; N95-Q119 VanDerWaalsContact CA-OE1 3.32Å; N95-Q119 HydrophobicContact CB-CG 4.5Å; N95-Q119 VanDerWaalsContact OD1-CD 3.29Å; N95-Q119 PolarHBondContact OD1-NE2 3.03Å
96	A	92.4	Very high	93.4	Very high	15 Å²	15	46.8 Å²	46.8	12%	0.124	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-44.2	176.4	0	0	0	0	0	111.9	D98 M99 E100 A122	A96-D98 PolarHBondContact O-N 2.91Å; A96-D98 VanDerWaalsContact O-N 3.15Å; A96-M99 PolarHBondContact O-N 2.82Å; A96-E100 WeakPolarHBondContact O-CG 3.49Å; A96-E100 PolarHBondContact O-N 2.87Å; A96-E100 VanDerWaalsContact O-N 3.14Å; A96-A122 HydrophobicContact CB-CB 4.38Å
97	V	90.6	Very high	93.5	Very high	99 Å²	99	49.2 Å²	49.2	60%	0.6	25%	0.249	S	C	*	.	H	α-helix	trans	-54.5	-37	179.6	-176.5	0	0	0	0	112	M99 E100	V97-M99 PolarHBondContact O-N 2.86Å; V97-E100 PolarHBondContact O-N 2.57Å
98	D	89.4	Confident	93.8	Very high	21 Å²	21	47.2 Å²	47.2	11%	0.112	24%	0.238	C	C	.	.	H	α-helix	trans	-64.3	-31	-179.9	-57.9	-32.7	0	0	0	112.1	F54 N95 A96 Y102	F54-D98 HydrophobicContact CB-CB 3.84Å; F54-D98 HydrophobicContact CD1-CB 3.95Å; F54-D98 HydrophobicContact CG-CB 3.9Å; N95-D98 VanDerWaalsContact CB-OD2 3.25Å; N95-D98 WeakPolarHBondContact CB-OD2 3.48Å; N95-D98 PolarHBondContact N-OD2 2.92Å; N95-D98 PolarHBondContact ND2-OD2 3.38Å; N95-D98 PolarHBondContact O-N 3.47Å; A96-D98 PolarHBondContact O-N 2.91Å; A96-D98 VanDerWaalsContact O-N 3.15Å; D98-Y102 WeakPolarHBondContact O-CD2 3.42Å; D98-Y102 WeakPolarHBondContact O-CE2 3.36Å
99	M	93.3	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-93.6	-22.7	-174.8	-65.4	-58.3	-58.6	0	0	113.4	F54 L94 A96 V97 L101 Y102 L105 L108 A122 F123 N126	F54-M99 HydrophobicContact CE1-SD 4.38Å; F54-M99 HydrophobicContact CE2-SD 4.23Å; F54-M99 HydrophobicContact CZ-SD 3.85Å; L94-M99 HydrophobicContact CD1-CG 4.09Å; L94-M99 HydrophobicContact CD1-SD 3.92Å; L94-M99 HydrophobicContact CD2-CG 4.23Å; L94-M99 HydrophobicContact CD2-SD 4.18Å; L94-M99 HydrophobicContact CG-CG 4.2Å; L94-M99 HydrophobicContact CG-SD 4.43Å; A96-M99 PolarHBondContact O-N 2.82Å; V97-M99 PolarHBondContact O-N 2.86Å; M99-L101 PolarHBondContact O-N 3.13Å; M99-Y102 PolarHBondContact O-N 3.13Å; M99-Y102 VanDerWaalsContact O-N 3.14Å; M99-L105 HydrophobicContact CE-CD2 3.48Å; M99-L105 VanDerWaalsContact CE-CD2 3.48Å; M99-L108 HydrophobicContact CE-CD2 3.91Å; M99-L108 HydrophobicContact SD-CD2 4.41Å; M99-A122 WeakPolarHBondContact CB-O 3.46Å; M99-F123 HydrophobicContact CE-CD1 4.05Å; M99-F123 HydrophobicContact CE-CE1 4.04Å; M99-F123 HydrophobicContact CG-CD1 4.43Å; M99-F123 HydrophobicContact CG-CE1 4.38Å; M99-N126 PolarHBondContact O-ND2 2.87Å
100	E	91.4	Very high	94.2	Very high	98 Å²	98	37.8 Å²	37.8	46%	0.458	20%	0.204	S	C	.	.	H	α-helix	trans	-59.6	-30.2	-174.9	-74.4	-176.5	177.8	0	0	113.9	A96 V97 Y102 T103 K125	A96-E100 WeakPolarHBondContact O-CG 3.49Å; A96-E100 PolarHBondContact O-N 2.87Å; A96-E100 VanDerWaalsContact O-N 3.14Å; V97-E100 PolarHBondContact O-N 2.57Å; E100-Y102 VanDerWaalsContact C-N 3.32Å; E100-Y102 PolarHBondContact O-N 2.84Å; E100-T103 WeakPolarHBondContact O-CG2 3.39Å; E100-K125 HydrophobicContact CB-CB 4.49Å; E100-K125 HydrophobicContact CB-CG 4.32Å; E100-K125 HydrophobicContact CG-CB 4.35Å; E100-K125 HydrophobicContact CG-CG 3.85Å
101	L	88.4	Confident	94.4	Very high	71 Å²	71	39.5 Å²	39.5	37%	0.372	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-26.6	-179.2	-68.5	167.3	0	0	0	113.2	L56 S77 M99 T103	L56-L101 HydrophobicContact CD2-CD1 3.99Å; S77-L101 VanDerWaalsContact CB-O 3.22Å; S77-L101 WeakPolarHBondContact CB-O 3.45Å; M99-L101 PolarHBondContact O-N 3.13Å; L101-T103 PolarHBondContact O-N 3.27Å
102	Y	92.5	Very high	94.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.226	C	C	.	.			trans	-98.2	56.7	-169.6	-57.4	-69.9	0	0	0	112	I43 F54 P55 L56 L57 I80 I83 D98 M99 E100 G104 L105 N126	I43-Y102 HydrophobicContact CD1-CE1 3.86Å; F54-Y102 HydrophobicContact CD1-CE2 4.44Å; F54-Y102 HydrophobicContact CE1-CD2 4.44Å; F54-Y102 AromaticContact CE1-CE2 3.79Å; F54-Y102 HydrophobicContact CE1-CE2 3.79Å; P55-Y102 PolarHBondContact O-OH 3.06Å; L56-Y102 HydrophobicContact CD2-CE2 4.42Å; L57-Y102 HydrophobicContact CD1-CE1 4.32Å; I80-Y102 HydrophobicContact CB-CD1 4.08Å; I80-Y102 HydrophobicContact CG1-CD1 4.35Å; I80-Y102 HydrophobicContact CG1-CE1 4.39Å; I80-Y102 HydrophobicContact CG2-CD1 4.31Å; I83-Y102 HydrophobicContact CD1-CD1 4.08Å; I83-Y102 HydrophobicContact CD1-CD2 3.82Å; I83-Y102 HydrophobicContact CD1-CE1 4.25Å; I83-Y102 HydrophobicContact CD1-CE2 4Å; I83-Y102 HydrophobicContact CD1-CG 3.84Å; D98-Y102 WeakPolarHBondContact O-CD2 3.42Å; D98-Y102 WeakPolarHBondContact O-CE2 3.36Å; M99-Y102 PolarHBondContact O-N 3.13Å; M99-Y102 VanDerWaalsContact O-N 3.14Å; E100-Y102 VanDerWaalsContact C-N 3.32Å; E100-Y102 PolarHBondContact O-N 2.84Å; Y102-G104 PolarHBondContact O-N 3.32Å; Y102-G104 VanDerWaalsContact O-N 3.15Å; Y102-L105 WeakPolarHBondContact O-CB 3.4Å; Y102-L105 PolarHBondContact O-N 2.84Å; Y102-N126 PolarHBondContact O-ND2 2.99Å
103	T	93	Very high	94.5	Very high	52 Å²	52	39.9 Å²	39.9	32%	0.319	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.6	-171.1	67.5	0	0	0	0	114.3	R78 E100 L101 K125	R78-T103 WeakPolarHBondContact CG-OG1 3.41Å; E100-T103 WeakPolarHBondContact O-CG2 3.39Å; L101-T103 PolarHBondContact O-N 3.27Å; T103-K125 WeakPolarHBondContact CA-O 3.4Å
104	G	93.6	Very high	94.5	Very high	14 Å²	14	37.8 Å²	37.8	14%	0.144	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	2.1	176.3	0	0	0	0	0	114.9	R78 I80 Y102 Q106	R78-G104 WeakPolarHBondContact O-CA 3.32Å; I80-G104 CarbonylContact O-C 3.58Å; Y102-G104 PolarHBondContact O-N 3.32Å; Y102-G104 VanDerWaalsContact O-N 3.15Å; G104-Q106 PolarHBondContact O-N 3.21Å
105	L	96.9	Very high	94.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.			trans	-62.8	131.7	-173.7	-166.4	71.7	0	0	0	112	I80 I83 M99 Y102 L108 H128 L129	I80-L105 HydrophobicContact CG2-CD1 4.3Å; I80-L105 WeakPolarHBondContact O-CA 3.34Å; I80-L105 PolarHBondContact O-N 3.12Å; I83-L105 HydrophobicContact CB-CD1 4.16Å; I83-L105 HydrophobicContact CD1-CD1 3.72Å; I83-L105 HydrophobicContact CD1-CD2 4.17Å; I83-L105 HydrophobicContact CG1-CD1 3.61Å; M99-L105 HydrophobicContact CE-CD2 3.48Å; M99-L105 VanDerWaalsContact CE-CD2 3.48Å; Y102-L105 WeakPolarHBondContact O-CB 3.4Å; Y102-L105 PolarHBondContact O-N 2.84Å; L105-L108 HydrophobicContact CD2-CB 4.23Å; L105-H128 CarbonylContact O-C 3.54Å; L105-H128 VanDerWaalsContact O-C 3.23Å; L105-L129 HydrophobicContact CD2-CD1 4.18Å; L105-L129 HydrophobicContact CG-CD1 4.19Å; L105-L129 WeakPolarHBondContact O-CA 3.49Å; L105-L129 PolarHBondContact O-N 3.44Å; L105-L129 VanDerWaalsContact O-N 3.08Å
106	Q	97.8	Very high	94.7	Very high	101 Å²	101	42.4 Å²	42.4	47%	0.472	21%	0.213	S	C	.	.			trans	-116	-28.7	179.9	-61.1	-179.1	10.6	0	0	112.7	T81 G104 H128 R130 Y131	T81-Q106 WeakPolarHBondContact O-CA 3.46Å; T81-Q106 PolarHBondContact O-N 2.76Å; G104-Q106 PolarHBondContact O-N 3.21Å; Q106-H128 WeakPolarHBondContact CA-O 3.4Å; Q106-H128 HydrophobicContact CG-CB 4.23Å; Q106-R130 PolarHBondContact O-N 3.49Å; Q106-Y131 PolarHBondContact O-N 3.5Å
107	K	98.4	Very high	94.9	Very high	100 Å²	100	44.2 Å²	44.2	44%	0.435	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.6	-178	-176.6	173.5	-177.7	-179.3	0	111.4	T81 S82 I83 Y131	T81-K107 PolarHBondContact O-N 2.95Å; S82-K107 WeakPolarHBondContact CA-O 3.49Å; I83-K107 PolarHBondContact N-O 2.99Å; K107-Y131 WeakPolarHBondContact CA-O 3.3Å
108	L	98.3	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.6	174.1	179.5	63.4	0	0	0	109.6	I83 L94 M99 L105 I110 F123 L129 Y131 I132 N133	I83-L108 HydrophobicContact CB-CD1 4Å; I83-L108 HydrophobicContact CG2-CD1 4.04Å; L94-L108 HydrophobicContact CD2-CD2 4.32Å; M99-L108 HydrophobicContact CE-CD2 3.91Å; M99-L108 HydrophobicContact SD-CD2 4.41Å; L105-L108 HydrophobicContact CD2-CB 4.23Å; L108-I110 HydrophobicContact CD1-CD1 4.33Å; L108-I110 HydrophobicContact CD1-CG1 4.12Å; L108-I110 HydrophobicContact CD2-CD1 4.44Å; L108-I110 HydrophobicContact CG-CG1 4.32Å; L108-F123 HydrophobicContact CD2-CE1 3.64Å; L108-F123 HydrophobicContact CD2-CZ 4.06Å; L108-L129 HydrophobicContact CB-CD1 3.94Å; L108-Y131 PolarHBondContact N-O 3.04Å; L108-I132 CarbonylContact O-C 3.41Å; L108-I132 WeakPolarHBondContact O-CA 3.28Å; L108-N133 PolarHBondContact O-N 3.36Å
109	T	98.3	Very high	95.5	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.8	170.7	-55.6	0	0	0	0	108.7	I83 H84 I85 K111 N133	I83-T109 PolarHBondContact O-N 2.79Å; H84-T109 CarbonylContact C-O 3.59Å; H84-T109 WeakPolarHBondContact ND1-CB 3.2Å; H84-T109 WeakPolarHBondContact ND1-CG2 3.41Å; I85-T109 PolarHBondContact N-O 3.39Å; T109-K111 HydrophobicContact CG2-CB 3.99Å; T109-N133 CarbonylContact C-O 3.56Å; T109-N133 WeakPolarHBondContact CA-O 3.38Å; T109-N133 HydrophobicContact CG2-CB 3.98Å
110	I	97.1	Very high	95.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	95	166.1	-54.3	178.2	0	0	0	105.3	F54 I85 L91 L94 L108 L115 N133 L134 N137	F54-I110 HydrophobicContact CE2-CD1 4.25Å; I85-I110 HydrophobicContact CB-CG1 4.38Å; I85-I110 HydrophobicContact CD1-CG1 4.31Å; I85-I110 WeakPolarHBondContact O-CA 3.26Å; L91-I110 HydrophobicContact CD2-CG2 4.18Å; L94-I110 HydrophobicContact CD1-CD1 4.4Å; L94-I110 HydrophobicContact CD2-CD1 4.08Å; L108-I110 HydrophobicContact CD1-CD1 4.33Å; L108-I110 HydrophobicContact CD1-CG1 4.12Å; L108-I110 HydrophobicContact CD2-CD1 4.44Å; L108-I110 HydrophobicContact CG-CG1 4.32Å; I110-L115 HydrophobicContact CD1-CD2 4.45Å; I110-L115 HydrophobicContact CG2-CD2 4.34Å; I110-N133 CarbonylContact C-O 3.57Å; I110-N133 PolarHBondContact N-O 3.32Å; I110-L134 HydrophobicContact CB-CD2 4.1Å; I110-L134 HydrophobicContact CD1-CD2 4.5Å; I110-L134 WeakPolarHBondContact O-CA 3.12Å; I110-N137 PolarHBondContact O-ND2 2.98Å
111	K	96.4	Very high	95.7	Very high	73 Å²	73	53 Å²	53	32%	0.317	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	152	-172.9	178.5	173.3	-177.9	178.2	0	111.5	I85 E86 N87 T109 S113 S135	I85-K111 PolarHBondContact O-N 3.36Å; E86-K111 WeakPolarHBondContact CA-O 3.2Å; N87-K111 PolarHBondContact N-O 3.04Å; T109-K111 HydrophobicContact CG2-CB 3.99Å; K111-S113 PolarHBondContact O-N 3.22Å; K111-S113 VanDerWaalsContact O-N 3.13Å; K111-S113 PolarHBondContact O-OG 3.26Å; K111-S135 WeakPolarHBondContact CA-O 3.31Å; K111-S135 WeakPolarHBondContact CD-OG 3.48Å; K111-S135 WeakPolarHBondContact CE-OG 3.48Å; K111-S135 WeakPolarHBondContact CG-OG 3.22Å
112	N	95.9	Very high	96.1	Very high	79 Å²	79	49.7 Å²	49.7	42%	0.422	24%	0.243	S	C	.	.	S	Bend	trans	51.7	41.5	173.6	-163.5	30.5	0	0	0	112.5	E86 N87 S135 S136	E86-N112 HydrophobicContact CG-CB 4.43Å; N87-N112 VanDerWaalsContact CA-O 3.27Å; N87-N112 WeakPolarHBondContact CA-O 3.39Å; N87-N112 PolarHBondContact N-O 3.45Å; N87-N112 PolarHBondContact OD1-ND2 2.79Å; N112-S135 PolarHBondContact N-O 2.5Å; N112-S135 VanDerWaalsContact N-O 3.15Å; N112-S136 WeakPolarHBondContact CA-O 3.22Å; N112-S136 PolarHBondContact N-O 2.84Å
113	S	95.8	Very high	96.3	Very high	6 Å²	6	49.7 Å²	49.7	4%	0.042	24%	0.243	C	C	.	.	S	Bend	trans	-126.9	177.8	-169.8	-66.1	0	0	0	0	110.7	N87 W88 K111 L115 S136 N137	N87-S113 PolarHBondContact N-OG 3.3Å; W88-S113 PolarHBondContact N-OG 2.86Å; W88-S113 VanDerWaalsContact N-OG 3.17Å; W88-S113 WeakPolarHBondContact O-CA 3.38Å; W88-S113 VanDerWaalsContact O-CB 3.31Å; W88-S113 WeakPolarHBondContact O-CB 3.47Å; K111-S113 PolarHBondContact O-N 3.22Å; K111-S113 VanDerWaalsContact O-N 3.13Å; K111-S113 PolarHBondContact O-OG 3.26Å; S113-L115 VanDerWaalsContact C-N 3.26Å; S113-L115 PolarHBondContact O-N 2.76Å; S113-S136 PolarHBondContact N-O 2.88Å; S113-N137 WeakPolarHBondContact CA-OD1 3.5Å; S113-N137 VanDerWaalsContact CB-OD1 3.26Å; S113-N137 WeakPolarHBondContact CB-OD1 3.49Å; S113-N137 PolarHBondContact N-OD1 3.49Å; S113-N137 PolarHBondContact O-OD1 3.09Å; S113-N137 VanDerWaalsContact O-OD1 3.07Å
114	G	95.2	Very high	96.4	Very high	6 Å²	6	49.7 Å²	49.7	6%	0.062	25%	0.248	C	C	.	.			trans	-82.7	11.6	-175.1	0	0	0	0	0	115.8	W88 R89 L91 H92 R116	W88-G114 PolarHBondContact O-N 3.2Å; R89-G114 VanDerWaalsContact O-CA 3.3Å; R89-G114 WeakPolarHBondContact O-CA 3.29Å; L91-G114 CarbonylContact O-C 3.59Å; H92-G114 WeakPolarHBondContact CA-O 3.37Å; H92-G114 PolarHBondContact ND1-O 3.1Å; G114-R116 PolarHBondContact O-N 2.76Å
115	L	96.9	Very high	96.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.266	C	S	.	.			trans	-68.9	124.1	-163.7	-168.1	71.6	0	0	0	111.2	L91 L94 I110 S113 I118 L134 N137 R138 L139	L91-L115 VanDerWaalsContact O-CA 3.23Å; L91-L115 WeakPolarHBondContact O-CA 3.47Å; L91-L115 PolarHBondContact O-N 3.17Å; L94-L115 HydrophobicContact CB-CD1 4.08Å; I110-L115 HydrophobicContact CD1-CD2 4.45Å; I110-L115 HydrophobicContact CG2-CD2 4.34Å; S113-L115 VanDerWaalsContact C-N 3.26Å; S113-L115 PolarHBondContact O-N 2.76Å; L115-I118 HydrophobicContact CD2-CD1 4.15Å; L115-I118 HydrophobicContact CD2-CG1 4.06Å; L115-L134 HydrophobicContact CD2-CD2 3.98Å; L115-N137 HydrophobicContact CB-CB 4.06Å; L115-N137 WeakPolarHBondContact CB-OD1 3.18Å; L115-N137 PolarHBondContact N-OD1 3Å; L115-R138 CarbonylContact O-C 3.6Å; L115-R138 VanDerWaalsContact O-CA 3.27Å; L115-R138 WeakPolarHBondContact O-CA 3.39Å; L115-R138 PolarHBondContact O-N 2.9Å; L115-L139 HydrophobicContact CD2-CD2 4.43Å; L115-L139 HydrophobicContact CG-CD2 4.27Å; L115-L139 PolarHBondContact O-N 2.82Å
116	R	96.8	Very high	96.4	Very high	149 Å²	149	54.7 Å²	54.7	56%	0.562	27%	0.266	S	S	*	.			trans	-112.4	-32.7	-177.9	-65.8	174.1	-174.4	-104.7	4.3	112.7	H92 G114 R138 L139	H92-R116 PolarHBondContact O-N 2.82Å; G114-R116 PolarHBondContact O-N 2.76Å; R116-R138 HydrophobicContact CG-CB 3.92Å; R116-L139 WeakPolarHBondContact O-CD2 3.39Å
117	S	96.5	Very high	96.4	Very high	54 Å²	54	53.6 Å²	53.6	38%	0.378	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155	-177.3	67.3	0	0	0	0	112.1	H92 T93 L94	H92-S117 PolarHBondContact O-N 2.86Å; T93-S117 WeakPolarHBondContact CA-O 3.34Å; T93-S117 PolarHBondContact OG1-OG 2.91Å; L94-S117 PolarHBondContact N-O 2.85Å; L94-S117 VanDerWaalsContact N-O 3.14Å
118	I	97.5	Very high	96.3	Very high	20 Å²	20	53.6 Å²	53.6	10%	0.103	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	129.3	173.2	-58.3	178.3	0	0	0	106.1	L94 L115 A122 F123 L134 L142 L146	L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.27Å; L94-I118 HydrophobicContact CD2-CG2 4.19Å; L94-I118 HydrophobicContact CG-CG2 4.49Å; L115-I118 HydrophobicContact CD2-CD1 4.15Å; L115-I118 HydrophobicContact CD2-CG1 4.06Å; I118-A122 HydrophobicContact CG2-CB 3.72Å; I118-F123 HydrophobicContact CD1-CZ 4.32Å; I118-F123 HydrophobicContact CG2-CE2 4.41Å; I118-F123 HydrophobicContact CG2-CZ 4.23Å; I118-L134 HydrophobicContact CD1-CD1 3.65Å; I118-L134 HydrophobicContact CD1-CD2 4.37Å; I118-L142 HydrophobicContact CD1-CD1 4.05Å; I118-L146 HydrophobicContact CB-CD1 4.01Å; I118-L146 HydrophobicContact CG2-CD1 4.07Å; I118-L146 HydrophobicContact CG2-CD2 3.97Å
119	Q	96.2	Very high	96.3	Very high	77 Å²	77	53.6 Å²	53.6	36%	0.36	27%	0.269	S	S	.	.			trans	-63.6	145.3	-179.7	-75.1	-173.4	-14.4	0	0	111.4	T93 L94 N95 R121 A122 L146	T93-Q119 HydrophobicContact CG2-CG 4.3Å; L94-Q119 PolarHBondContact O-N 3.23Å; N95-Q119 VanDerWaalsContact CA-OE1 3.32Å; N95-Q119 HydrophobicContact CB-CG 4.5Å; N95-Q119 VanDerWaalsContact OD1-CD 3.29Å; N95-Q119 PolarHBondContact OD1-NE2 3.03Å; Q119-R121 PolarHBondContact O-N 3.33Å; Q119-A122 VanDerWaalsContact O-CB 3.23Å; Q119-A122 WeakPolarHBondContact O-CB 3.33Å; Q119-A122 PolarHBondContact O-N 2.85Å; Q119-L146 VanDerWaalsContact O-CD2 3.23Å; Q119-L146 WeakPolarHBondContact O-CD2 3.25Å
120	P	94.8	Very high	96.2	Very high	106 Å²	106	58.5 Å²	58.5	69%	0.688	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	142.4	173.5	-25.8	34.6	0	0	0	111.6	A122	P120-A122 PolarHBondContact O-N 3.48Å
121	R	93.6	Very high	96.3	Very high	200 Å²	200	62.7 Å²	62.7	76%	0.755	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	16.4	180	-50.3	177	-171.7	158.3	1.4	114.9	Q119 F123 A124	Q119-R121 PolarHBondContact O-N 3.33Å; R121-F123 PolarHBondContact O-N 3.13Å; R121-A124 HydrophobicContact CB-CB 4.08Å; R121-A124 VanDerWaalsContact O-CB 3.22Å; R121-A124 WeakPolarHBondContact O-CB 3.32Å; R121-A124 PolarHBondContact O-N 2.74Å
122	A	96.3	Very high	96.4	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.008	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.5	-179.8	0	0	0	0	0	114	A96 M99 I118 Q119 P120	A96-A122 HydrophobicContact CB-CB 4.38Å; M99-A122 WeakPolarHBondContact CB-O 3.46Å; I118-A122 HydrophobicContact CG2-CB 3.72Å; Q119-A122 VanDerWaalsContact O-CB 3.23Å; Q119-A122 WeakPolarHBondContact O-CB 3.33Å; Q119-A122 PolarHBondContact O-N 2.85Å; P120-A122 PolarHBondContact O-N 3.48Å
123	F	96.9	Very high	96.5	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	8.8	179.4	-51.1	-48.6	0	0	0	114.4	L94 M99 L108 I118 R121 K125 N126 L129 I132 L146 F147 L150	L94-F123 HydrophobicContact CD2-CE1 3.78Å; L94-F123 HydrophobicContact CD2-CZ 3.94Å; M99-F123 HydrophobicContact CE-CD1 4.05Å; M99-F123 HydrophobicContact CE-CE1 4.04Å; M99-F123 HydrophobicContact CG-CD1 4.43Å; M99-F123 HydrophobicContact CG-CE1 4.38Å; L108-F123 HydrophobicContact CD2-CE1 3.64Å; L108-F123 HydrophobicContact CD2-CZ 4.06Å; I118-F123 HydrophobicContact CD1-CZ 4.32Å; I118-F123 HydrophobicContact CG2-CE2 4.41Å; I118-F123 HydrophobicContact CG2-CZ 4.23Å; R121-F123 PolarHBondContact O-N 3.13Å; F123-K125 PolarHBondContact O-N 3.4Å; F123-K125 VanDerWaalsContact O-N 3.17Å; F123-N126 WeakPolarHBondContact CA-OD1 3.34Å; F123-N126 PolarHBondContact O-N 2.62Å; F123-L129 HydrophobicContact CB-CD2 4.39Å; F123-L129 HydrophobicContact CD1-CD2 3.88Å; F123-L129 HydrophobicContact CE1-CD2 4.34Å; F123-L129 HydrophobicContact CG-CD2 4.07Å; F123-I132 HydrophobicContact CD2-CD1 4.38Å; F123-I132 HydrophobicContact CE2-CD1 4.21Å; F123-L146 HydrophobicContact CD2-CB 4.28Å; F123-L146 HydrophobicContact CE2-CB 4.45Å; F123-F147 HydrophobicContact CD2-CD1 4.25Å; F123-F147 HydrophobicContact CD2-CE1 4.13Å; F123-F147 HydrophobicContact CE2-CD1 4.41Å; F123-F147 AromaticContact CE2-CE1 3.84Å; F123-F147 HydrophobicContact CE2-CE1 3.84Å; F123-L150 HydrophobicContact CB-CD1 3.95Å; F123-L150 HydrophobicContact CD2-CD1 4.38Å; F123-L150 HydrophobicContact CG-CD1 4.41Å
124	A	94.6	Very high	96.7	Very high	51 Å²	51	56.4 Å²	56.4	42%	0.421	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-24.9	-173.7	0	0	0	0	0	113.9	R121	R121-A124 HydrophobicContact CB-CB 4.08Å; R121-A124 VanDerWaalsContact O-CB 3.22Å; R121-A124 WeakPolarHBondContact O-CB 3.32Å; R121-A124 PolarHBondContact O-N 2.74Å
125	K	95	Very high	96.8	Very high	120 Å²	120	56.4 Å²	56.4	52%	0.522	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	8.8	177.1	-61.9	-57.5	-175.1	-178.8	0	113.5	E100 T103 F123 P127	E100-K125 HydrophobicContact CB-CB 4.49Å; E100-K125 HydrophobicContact CB-CG 4.32Å; E100-K125 HydrophobicContact CG-CB 4.35Å; E100-K125 HydrophobicContact CG-CG 3.85Å; T103-K125 WeakPolarHBondContact CA-O 3.4Å; F123-K125 PolarHBondContact O-N 3.4Å; F123-K125 VanDerWaalsContact O-N 3.17Å; K125-P127 WeakPolarHBondContact O-CD 3.41Å
126	N	96.6	Very high	96.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.277	C	S	.	.			trans	-117.2	61.5	-179.1	-44.9	98.5	0	0	0	111.3	M99 Y102 F123 H128 L129 L150	M99-N126 PolarHBondContact O-ND2 2.87Å; Y102-N126 PolarHBondContact O-ND2 2.99Å; F123-N126 WeakPolarHBondContact CA-OD1 3.34Å; F123-N126 PolarHBondContact O-N 2.62Å; N126-H128 PolarHBondContact O-N 2.83Å; N126-L129 HydrophobicContact CB-CB 4.18Å; N126-L129 HydrophobicContact CB-CD2 4.49Å; N126-L129 VanDerWaalsContact O-CB 3.29Å; N126-L129 WeakPolarHBondContact O-CB 3.49Å; N126-L129 PolarHBondContact O-N 2.81Å; N126-L129 VanDerWaalsContact O-N 3.1Å; N126-L150 VanDerWaalsContact O-CD2 3.24Å; N126-L150 WeakPolarHBondContact O-CD2 3.12Å
127	P	96.2	Very high	96.9	Very high	77 Å²	77	50.2 Å²	50.2	50%	0.5	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.3	-171.2	29	-37.5	0	0	0	114.1	K125	K125-P127 WeakPolarHBondContact O-CD 3.41Å
128	H	96.8	Very high	96.9	Very high	101 Å²	101	54.1 Å²	54.1	47%	0.468	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-1.2	-179.5	-57.8	-53.5	0	0	0	113.8	L105 Q106 N126 R130	L105-H128 CarbonylContact O-C 3.54Å; L105-H128 VanDerWaalsContact O-C 3.23Å; Q106-H128 WeakPolarHBondContact CA-O 3.4Å; Q106-H128 HydrophobicContact CG-CB 4.23Å; N126-H128 PolarHBondContact O-N 2.83Å; H128-R130 WeakPolarHBondContact O-CG 3.26Å; H128-R130 PolarHBondContact O-N 3.02Å
129	L	97.9	Very high	97	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.252	C	S	.	.			trans	-68.4	118.2	-178.1	-173.1	60	0	0	0	110.2	L105 L108 F123 N126 I132 L150	L105-L129 HydrophobicContact CD2-CD1 4.18Å; L105-L129 HydrophobicContact CG-CD1 4.19Å; L105-L129 WeakPolarHBondContact O-CA 3.49Å; L105-L129 PolarHBondContact O-N 3.44Å; L105-L129 VanDerWaalsContact O-N 3.08Å; L108-L129 HydrophobicContact CB-CD1 3.94Å; F123-L129 HydrophobicContact CB-CD2 4.39Å; F123-L129 HydrophobicContact CD1-CD2 3.88Å; F123-L129 HydrophobicContact CE1-CD2 4.34Å; F123-L129 HydrophobicContact CG-CD2 4.07Å; N126-L129 HydrophobicContact CB-CB 4.18Å; N126-L129 HydrophobicContact CB-CD2 4.49Å; N126-L129 VanDerWaalsContact O-CB 3.29Å; N126-L129 WeakPolarHBondContact O-CB 3.49Å; N126-L129 PolarHBondContact O-N 2.81Å; N126-L129 VanDerWaalsContact O-N 3.1Å; L129-I132 HydrophobicContact CD1-CG1 4.2Å; L129-I132 HydrophobicContact CD2-CD1 3.65Å; L129-I132 HydrophobicContact CD2-CG1 3.88Å; L129-I132 HydrophobicContact CG-CD1 4.01Å; L129-I132 HydrophobicContact CG-CG1 3.87Å; L129-L150 HydrophobicContact CB-CD1 4.32Å; L129-L150 HydrophobicContact CB-CD2 4.24Å; L129-L150 HydrophobicContact CD2-CD1 4.19Å; L129-L150 HydrophobicContact CG-CD1 4.43Å
130	R	98.1	Very high	97	Very high	108 Å²	108	52.4 Å²	52.4	41%	0.408	25%	0.253	S	S	.	.			trans	-123.9	-21.3	-175.1	-71.2	177.4	179	-177.4	0.9	113.7	Q106 H128 R153 E154	Q106-R130 PolarHBondContact O-N 3.49Å; H128-R130 WeakPolarHBondContact O-CG 3.26Å; H128-R130 PolarHBondContact O-N 3.02Å; R130-R153 HydrophobicContact CB-CG 4.26Å; R130-R153 PolarHBondContact O-N 2.86Å; R130-E154 PolarHBondContact O-N 2.83Å
131	Y	98.6	Very high	97.2	Very high	88 Å²	88	50.2 Å²	50.2	35%	0.345	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	115.8	-176.5	-62.3	-88.3	0	0	0	109.1	Q106 K107 L108 R153 E154	Q106-Y131 PolarHBondContact O-N 3.5Å; K107-Y131 WeakPolarHBondContact CA-O 3.3Å; L108-Y131 PolarHBondContact N-O 3.04Å; Y131-R153 HydrophobicContact CE1-CB 3.98Å; Y131-R153 VanDerWaalsContact OH-CD 3.27Å; Y131-R153 WeakPolarHBondContact OH-CD 3.24Å; Y131-E154 HydrophobicContact CD1-CB 3.77Å; Y131-E154 HydrophobicContact CE1-CB 4.23Å
132	I	98.6	Very high	97.3	Very high	4 Å²	4	41 Å²	41	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128	178.9	-62.1	179	0	0	0	108.7	L108 F123 L129 L134 F147 L150 L152 E154 L155 Q156	L108-I132 CarbonylContact O-C 3.41Å; L108-I132 WeakPolarHBondContact O-CA 3.28Å; F123-I132 HydrophobicContact CD2-CD1 4.38Å; F123-I132 HydrophobicContact CE2-CD1 4.21Å; L129-I132 HydrophobicContact CD1-CG1 4.2Å; L129-I132 HydrophobicContact CD2-CD1 3.65Å; L129-I132 HydrophobicContact CD2-CG1 3.88Å; L129-I132 HydrophobicContact CG-CD1 4.01Å; L129-I132 HydrophobicContact CG-CG1 3.87Å; I132-L134 HydrophobicContact CG2-CD1 3.96Å; I132-L134 HydrophobicContact CG2-CD2 4.26Å; I132-L134 HydrophobicContact CG2-CG 3.73Å; I132-F147 HydrophobicContact CD1-CD1 4.03Å; I132-F147 HydrophobicContact CD1-CE1 3.82Å; I132-L150 HydrophobicContact CD1-CD1 4.19Å; I132-L152 HydrophobicContact CD1-CD1 4.43Å; I132-L152 HydrophobicContact CD1-CD2 3.72Å; I132-L152 HydrophobicContact CG1-CD2 4Å; I132-E154 PolarHBondContact N-O 2.83Å; I132-L155 HydrophobicContact CB-CD1 3.76Å; I132-L155 HydrophobicContact CG2-CD1 3.66Å; I132-L155 CarbonylContact O-C 3.59Å; I132-L155 VanDerWaalsContact O-CA 3.32Å; I132-L155 WeakPolarHBondContact O-CA 3.41Å; I132-Q156 PolarHBondContact O-N 2.88Å
133	N	98.6	Very high	97.4	Very high	23 Å²	23	43.4 Å²	43.4	12%	0.123	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	111.2	173.8	-176.8	-10.2	0	0	0	110.1	L108 T109 I110 S135 Q156	L108-N133 PolarHBondContact O-N 3.36Å; T109-N133 CarbonylContact C-O 3.56Å; T109-N133 WeakPolarHBondContact CA-O 3.38Å; T109-N133 HydrophobicContact CG2-CB 3.98Å; I110-N133 CarbonylContact C-O 3.57Å; I110-N133 PolarHBondContact N-O 3.32Å; N133-S135 WeakPolarHBondContact OD1-CB 3.27Å; N133-S135 PolarHBondContact OD1-N 3.42Å; N133-S135 PolarHBondContact OD1-OG 2.79Å; N133-Q156 HydrophobicContact CB-CB 4.17Å; N133-Q156 PolarHBondContact ND2-OE1 2.79Å; N133-Q156 PolarHBondContact OD1-OE1 3.49Å
134	L	98.3	Very high	97.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.			trans	-118	23.5	178.2	-57.2	172.4	0	0	0	111.2	I110 L115 I118 I132 N137 L139 Q156 L157 N160	I110-L134 HydrophobicContact CB-CD2 4.1Å; I110-L134 HydrophobicContact CD1-CD2 4.5Å; I110-L134 WeakPolarHBondContact O-CA 3.12Å; L115-L134 HydrophobicContact CD2-CD2 3.98Å; I118-L134 HydrophobicContact CD1-CD1 3.65Å; I118-L134 HydrophobicContact CD1-CD2 4.37Å; I132-L134 HydrophobicContact CG2-CD1 3.96Å; I132-L134 HydrophobicContact CG2-CD2 4.26Å; I132-L134 HydrophobicContact CG2-CG 3.73Å; L134-N137 PolarHBondContact O-ND2 3.38Å; L134-L139 HydrophobicContact CB-CD1 4.11Å; L134-L139 HydrophobicContact CD1-CD1 4.25Å; L134-Q156 CarbonylContact C-O 3.49Å; L134-Q156 PolarHBondContact N-O 3.01Å; L134-L157 HydrophobicContact CB-CD2 4.16Å; L134-L157 HydrophobicContact CD1-CD2 4.31Å; L134-N160 PolarHBondContact O-ND2 3.31Å
135	S	98.1	Very high	97.5	Very high	5 Å²	5	44.9 Å²	44.9	4%	0.035	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	153.8	-177.6	60.1	0	0	0	0	113.1	K111 N112 N133 N137 Q156 E158	K111-S135 WeakPolarHBondContact CA-O 3.31Å; K111-S135 WeakPolarHBondContact CD-OG 3.48Å; K111-S135 WeakPolarHBondContact CE-OG 3.48Å; K111-S135 WeakPolarHBondContact CG-OG 3.22Å; N112-S135 PolarHBondContact N-O 2.5Å; N112-S135 VanDerWaalsContact N-O 3.15Å; N133-S135 WeakPolarHBondContact OD1-CB 3.27Å; N133-S135 PolarHBondContact OD1-N 3.42Å; N133-S135 PolarHBondContact OD1-OG 2.79Å; S135-N137 VanDerWaalsContact C-N 3.31Å; S135-N137 PolarHBondContact O-N 2.88Å; S135-N137 PolarHBondContact O-ND2 3.01Å; S135-Q156 PolarHBondContact N-O 2.86Å; S135-E158 CarbonylContact C-O 3.5Å; S135-E158 WeakPolarHBondContact CA-O 3.48Å; S135-E158 WeakPolarHBondContact CB-O 3.24Å
136	S	97.6	Very high	97.6	Very high	18 Å²	18	39.6 Å²	39.6	13%	0.126	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	39.1	176.8	-45	0	0	0	0	113.3	N112 S113 E158 Q159	N112-S136 WeakPolarHBondContact CA-O 3.22Å; N112-S136 PolarHBondContact N-O 2.84Å; S113-S136 PolarHBondContact N-O 2.88Å; S136-E158 PolarHBondContact N-O 2.01Å; S136-Q159 WeakPolarHBondContact CA-O 3.28Å; S136-Q159 PolarHBondContact OG-OE1 3.05Å
137	N	98.1	Very high	97.6	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	20%	0.196	C	C	.	.	S	Bend	trans	-107.9	-163.4	175	-76.1	-72.8	0	0	0	111.4	I110 S113 L115 L134 S135 L139 N160 F161	I110-N137 PolarHBondContact O-ND2 2.98Å; S113-N137 WeakPolarHBondContact CA-OD1 3.5Å; S113-N137 VanDerWaalsContact CB-OD1 3.26Å; S113-N137 WeakPolarHBondContact CB-OD1 3.49Å; S113-N137 PolarHBondContact N-OD1 3.49Å; S113-N137 PolarHBondContact O-OD1 3.09Å; S113-N137 VanDerWaalsContact O-OD1 3.07Å; L115-N137 HydrophobicContact CB-CB 4.06Å; L115-N137 WeakPolarHBondContact CB-OD1 3.18Å; L115-N137 PolarHBondContact N-OD1 3Å; L134-N137 PolarHBondContact O-ND2 3.38Å; S135-N137 VanDerWaalsContact C-N 3.31Å; S135-N137 PolarHBondContact O-N 2.88Å; S135-N137 PolarHBondContact O-ND2 3.01Å; N137-L139 HydrophobicContact CB-CG 4.4Å; N137-N160 WeakPolarHBondContact CA-OD1 2.88Å; N137-N160 VanDerWaalsContact CB-OD1 3.23Å; N137-N160 WeakPolarHBondContact CB-OD1 3.11Å; N137-N160 PolarHBondContact N-OD1 3.48Å; N137-N160 PolarHBondContact O-OD1 2.97Å; N137-F161 WeakPolarHBondContact O-CD2 3.41Å; N137-F161 WeakPolarHBondContact O-CE2 3.49Å
138	R	97.2	Very high	97.4	Very high	136 Å²	136	40.9 Å²	40.9	51%	0.513	19%	0.194	S	C	.	.			trans	-115.2	27.3	-178.9	-58.3	-61	-173.4	166.8	1.7	111.8	L115 R116 T140	L115-R138 CarbonylContact O-C 3.6Å; L115-R138 VanDerWaalsContact O-CA 3.27Å; L115-R138 WeakPolarHBondContact O-CA 3.39Å; L115-R138 PolarHBondContact O-N 2.9Å; R116-R138 HydrophobicContact CG-CB 3.92Å; R138-T140 PolarHBondContact O-N 3.17Å
139	L	98.1	Very high	97.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.			trans	-68.4	128.9	178.1	-60.4	173.3	0	0	0	109.6	L115 R116 L134 N137 N160 F161 F162	L115-L139 HydrophobicContact CD2-CD2 4.43Å; L115-L139 HydrophobicContact CG-CD2 4.27Å; L115-L139 PolarHBondContact O-N 2.82Å; R116-L139 WeakPolarHBondContact O-CD2 3.39Å; L134-L139 HydrophobicContact CB-CD1 4.11Å; L134-L139 HydrophobicContact CD1-CD1 4.25Å; N137-L139 HydrophobicContact CB-CG 4.4Å; L139-N160 HydrophobicContact CB-CB 4.26Å; L139-N160 WeakPolarHBondContact CB-OD1 3.3Å; L139-N160 PolarHBondContact N-OD1 3.44Å; L139-N160 VanDerWaalsContact N-OD1 3.17Å; L139-F161 CarbonylContact O-C 3.48Å; L139-F161 VanDerWaalsContact O-C 3.25Å; L139-F161 PolarHBondContact O-N 2.92Å; L139-F162 HydrophobicContact CB-CE1 3.89Å; L139-F162 HydrophobicContact CB-CZ 4.32Å
140	T	97.3	Very high	97.2	Very high	62 Å²	62	40.8 Å²	40.8	38%	0.38	20%	0.2	S	C	.	.	S	Bend	trans	-104.5	-19.7	174.7	57.5	0	0	0	0	112.8	R138 F161 F162 N163	R138-T140 PolarHBondContact O-N 3.17Å; T140-F161 WeakPolarHBondContact CA-O 3.31Å; T140-F162 CarbonylContact O-C 3.58Å; T140-F162 WeakPolarHBondContact O-CA 3.47Å; T140-N163 PolarHBondContact O-N 3.37Å
141	T	97.8	Very high	97.1	Very high	60 Å²	60	40.2 Å²	40.2	37%	0.368	21%	0.213	S	C	.	.			trans	-153.4	164.8	173	-172.3	0	0	0	0	108.4	D167	T141-D167 WeakPolarHBondContact OG1-CB 3.46Å
142	L	97.6	Very high	97	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	20%	0.202	C	C	.	.			trans	-160.1	130.1	176	-177	71.3	0	0	0	107.3	I118 L146 F147 L157 F162 W170 M171	I118-L142 HydrophobicContact CD1-CD1 4.05Å; L142-L146 HydrophobicContact CD1-CD1 3.46Å; L142-L146 VanDerWaalsContact CD1-CD1 3.46Å; L142-L146 HydrophobicContact CG-CD1 4.3Å; L142-F147 HydrophobicContact CD1-CZ 4.41Å; L142-F147 HydrophobicContact CD2-CE2 3.98Å; L142-F147 HydrophobicContact CD2-CZ 3.86Å; L142-F147 HydrophobicContact CG-CE2 4.21Å; L142-F147 HydrophobicContact CG-CZ 4.22Å; L142-L157 HydrophobicContact CD2-CD1 4.16Å; L142-L157 HydrophobicContact CD2-CD2 3.72Å; L142-F162 HydrophobicContact CB-CE1 4.19Å; L142-W170 HydrophobicContact CB-CZ2 4.39Å; L142-W170 HydrophobicContact CD2-CH2 4.38Å; L142-W170 HydrophobicContact CD2-CZ2 4.16Å; L142-W170 HydrophobicContact CG-CZ2 4.22Å; L142-W170 PolarHBondContact O-NE1 2.67Å; L142-M171 HydrophobicContact CB-CE 3.53Å; L142-M171 HydrophobicContact CD2-CE 4.13Å; L142-M171 HydrophobicContact CG-CE 4.35Å
143	S	97.3	Very high	97	Very high	51 Å²	51	43.5 Å²	43.5	36%	0.357	23%	0.226	S	C	.	.			trans	-94.9	142.5	-177.5	112.4	0	0	0	0	111.3	Q145 L146	S143-Q145 PolarHBondContact O-N 2.83Å; S143-Q145 PolarHBondContact OG-N 2.97Å; S143-Q145 PolarHBondContact OG-OE1 3.22Å; S143-L146 PolarHBondContact O-N 3.17Å
144	W	97.1	Very high	96.9	Very high	20 Å²	20	44.4 Å²	44.4	8%	0.076	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-67.8	-24.2	-179.9	67.7	-94.9	0	0	0	112.4	L146 F147 Q148 W170 E287 N288 V289 M292	W144-L146 PolarHBondContact O-N 3.2Å; W144-L146 VanDerWaalsContact O-N 3.08Å; W144-F147 PolarHBondContact O-N 3.03Å; W144-Q148 HydrophobicContact CE3-CB 4.29Å; W144-Q148 HydrophobicContact CZ3-CB 3.81Å; W144-Q148 PolarHBondContact O-N 3.05Å; W144-W170 HydrophobicContact CB-CB 4.2Å; W144-W170 HydrophobicContact CB-CD2 3.66Å; W144-W170 HydrophobicContact CB-CE3 4.02Å; W144-W170 HydrophobicContact CB-CG 3.74Å; W144-W170 HydrophobicContact CG-CB 4.42Å; W144-W170 HydrophobicContact CG-CG 4.31Å; W144-E287 HydrophobicContact CH2-CG 4.31Å; W144-E287 HydrophobicContact CZ2-CB 4.47Å; W144-E287 HydrophobicContact CZ2-CG 4.49Å; W144-N288 PolarHBondContact NE1-O 2.81Å; W144-V289 VanDerWaalsContact CD1-O 3.29Å; W144-M292 HydrophobicContact CH2-CB 3.62Å; W144-M292 HydrophobicContact CH2-CE 3.62Å; W144-M292 HydrophobicContact CZ2-CB 4.12Å; W144-M292 HydrophobicContact CZ3-CB 4.22Å; W144-M292 HydrophobicContact CZ3-CE 3.99Å
145	Q	96.1	Very high	97	Very high	61 Å²	61	44.4 Å²	44.4	29%	0.285	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-59.5	-21.8	178.3	-65.4	97.2	-20.9	0	0	113.1	S143 F147 Q148	S143-Q145 PolarHBondContact O-N 2.83Å; S143-Q145 PolarHBondContact OG-N 2.97Å; S143-Q145 PolarHBondContact OG-OE1 3.22Å; Q145-F147 PolarHBondContact O-N 3.22Å; Q145-Q148 WeakPolarHBondContact O-CG 2.92Å; Q145-Q148 PolarHBondContact O-N 3.31Å
146	L	97	Very high	97	Very high	9 Å²	9	47 Å²	47	5%	0.047	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-59.6	-27.3	171.4	-69.5	172.1	0	0	0	112.8	I118 Q119 F123 L142 S143 W144	I118-L146 HydrophobicContact CB-CD1 4.01Å; I118-L146 HydrophobicContact CG2-CD1 4.07Å; I118-L146 HydrophobicContact CG2-CD2 3.97Å; Q119-L146 VanDerWaalsContact O-CD2 3.23Å; Q119-L146 WeakPolarHBondContact O-CD2 3.25Å; F123-L146 HydrophobicContact CD2-CB 4.28Å; F123-L146 HydrophobicContact CE2-CB 4.45Å; L142-L146 HydrophobicContact CD1-CD1 3.46Å; L142-L146 VanDerWaalsContact CD1-CD1 3.46Å; L142-L146 HydrophobicContact CG-CD1 4.3Å; S143-L146 PolarHBondContact O-N 3.17Å; W144-L146 PolarHBondContact O-N 3.2Å; W144-L146 VanDerWaalsContact O-N 3.08Å
147	F	96.8	Very high	97	Very high	5 Å²	5	46.2 Å²	46.2	2%	0.022	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-109.8	-0.1	-173	-44.9	-58.9	0	0	0	113.2	F123 I132 L142 W144 Q145 T149 L150 L152 L155 W170 W174	F123-F147 HydrophobicContact CD2-CD1 4.25Å; F123-F147 HydrophobicContact CD2-CE1 4.13Å; F123-F147 HydrophobicContact CE2-CD1 4.41Å; F123-F147 AromaticContact CE2-CE1 3.84Å; F123-F147 HydrophobicContact CE2-CE1 3.84Å; I132-F147 HydrophobicContact CD1-CD1 4.03Å; I132-F147 HydrophobicContact CD1-CE1 3.82Å; L142-F147 HydrophobicContact CD1-CZ 4.41Å; L142-F147 HydrophobicContact CD2-CE2 3.98Å; L142-F147 HydrophobicContact CD2-CZ 3.86Å; L142-F147 HydrophobicContact CG-CE2 4.21Å; L142-F147 HydrophobicContact CG-CZ 4.22Å; W144-F147 PolarHBondContact O-N 3.03Å; Q145-F147 PolarHBondContact O-N 3.22Å; F147-T149 PolarHBondContact O-N 3.01Å; F147-T149 VanDerWaalsContact O-N 3.11Å; F147-L150 HydrophobicContact CD1-CD1 4.3Å; F147-L150 WeakPolarHBondContact O-CB 3.33Å; F147-L150 PolarHBondContact O-N 3.16Å; F147-L152 HydrophobicContact CB-CD1 3.87Å; F147-L152 HydrophobicContact CD1-CD1 3.7Å; F147-L152 HydrophobicContact CD2-CD1 4.49Å; F147-L152 HydrophobicContact CE1-CD1 4.39Å; F147-L152 HydrophobicContact CG-CD1 3.75Å; F147-L155 HydrophobicContact CD2-CD2 4.4Å; F147-L155 HydrophobicContact CE1-CD1 4.4Å; F147-L155 HydrophobicContact CE2-CD2 3.95Å; F147-L155 HydrophobicContact CZ-CD1 4.21Å; F147-L155 HydrophobicContact CZ-CD2 4.11Å; F147-W170 HydrophobicContact CD2-CH2 4.08Å; F147-W170 AromaticContact CE2-CH2 3.68Å; F147-W170 HydrophobicContact CE2-CH2 3.68Å; F147-W170 HydrophobicContact CE2-CZ2 4.12Å; F147-W174 HydrophobicContact CB-CH2 4.29Å; F147-W174 HydrophobicContact CD2-CH2 4.46Å
148	Q	93.5	Very high	97	Very high	99 Å²	99	49.4 Å²	49.4	46%	0.463	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.4	-171.6	74.1	-171.6	17.7	0	0	114.2	W144 Q145	W144-Q148 HydrophobicContact CE3-CB 4.29Å; W144-Q148 HydrophobicContact CZ3-CB 3.81Å; W144-Q148 PolarHBondContact O-N 3.05Å; Q145-Q148 WeakPolarHBondContact O-CG 2.92Å; Q145-Q148 PolarHBondContact O-N 3.31Å
149	T	92.5	Very high	96.9	Very high	81 Å²	81	49.5 Å²	49.5	50%	0.497	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	0.5	178.5	62.3	0	0	0	0	113	F147	F147-T149 PolarHBondContact O-N 3.01Å; F147-T149 VanDerWaalsContact O-N 3.11Å
150	L	96.5	Very high	96.9	Very high	19 Å²	19	50.4 Å²	50.4	10%	0.099	26%	0.261	C	S	.	.			trans	-109.7	145.5	-171.9	-55.2	-177.2	0	0	0	111.2	F123 N126 L129 I132 F147 L152	F123-L150 HydrophobicContact CB-CD1 3.95Å; F123-L150 HydrophobicContact CD2-CD1 4.38Å; F123-L150 HydrophobicContact CG-CD1 4.41Å; N126-L150 VanDerWaalsContact O-CD2 3.24Å; N126-L150 WeakPolarHBondContact O-CD2 3.12Å; L129-L150 HydrophobicContact CB-CD1 4.32Å; L129-L150 HydrophobicContact CB-CD2 4.24Å; L129-L150 HydrophobicContact CD2-CD1 4.19Å; L129-L150 HydrophobicContact CG-CD1 4.43Å; I132-L150 HydrophobicContact CD1-CD1 4.19Å; F147-L150 HydrophobicContact CD1-CD1 4.3Å; F147-L150 WeakPolarHBondContact O-CB 3.33Å; F147-L150 PolarHBondContact O-N 3.16Å; L150-L152 HydrophobicContact CB-CD2 4.19Å; L150-L152 HydrophobicContact CB-CG 4.15Å; L150-L152 HydrophobicContact CD1-CD2 4.06Å
151	S	95.6	Very high	96.9	Very high	95 Å²	95	51.8 Å²	51.8	66%	0.664	26%	0.262	S	S	*	.			trans	-102.9	75.2	169.4	-50.7	0	0	0	0	109.6
152	L	97.6	Very high	96.9	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.131	25%	0.246	C	C	.	.			trans	-65.4	133.8	-175.2	-67.1	179.8	0	0	0	111.9	I132 F147 L150 L155 W174 A180	I132-L152 HydrophobicContact CD1-CD1 4.43Å; I132-L152 HydrophobicContact CD1-CD2 3.72Å; I132-L152 HydrophobicContact CG1-CD2 4Å; F147-L152 HydrophobicContact CB-CD1 3.87Å; F147-L152 HydrophobicContact CD1-CD1 3.7Å; F147-L152 HydrophobicContact CD2-CD1 4.49Å; F147-L152 HydrophobicContact CE1-CD1 4.39Å; F147-L152 HydrophobicContact CG-CD1 3.75Å; L150-L152 HydrophobicContact CB-CD2 4.19Å; L150-L152 HydrophobicContact CB-CG 4.15Å; L150-L152 HydrophobicContact CD1-CD2 4.06Å; L152-L155 HydrophobicContact CD1-CB 4.34Å; L152-L155 HydrophobicContact CD1-CD2 4.38Å; L152-W174 HydrophobicContact CD1-CZ3 4.37Å; L152-A180 HydrophobicContact CB-CB 4.13Å
153	R	97.7	Very high	96.9	Very high	136 Å²	136	52.7 Å²	52.7	51%	0.513	27%	0.265	S	S	.	.	S	Bend	trans	-94.1	-30.4	170.3	-68.2	-174.8	175.7	-149.7	-3.4	111.8	R130 Y131	R130-R153 HydrophobicContact CB-CG 4.26Å; R130-R153 PolarHBondContact O-N 2.86Å; Y131-R153 HydrophobicContact CE1-CB 3.98Å; Y131-R153 VanDerWaalsContact OH-CD 3.27Å; Y131-R153 WeakPolarHBondContact OH-CD 3.24Å
154	E	98.4	Very high	96.9	Very high	43 Å²	43	51.4 Å²	51.4	20%	0.201	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	130.1	-177.6	-166.1	166.7	138.7	0	0	111	R130 Y131 I132 Q156 A180 K181	R130-E154 PolarHBondContact O-N 2.83Å; Y131-E154 HydrophobicContact CD1-CB 3.77Å; Y131-E154 HydrophobicContact CE1-CB 4.23Å; I132-E154 PolarHBondContact N-O 2.83Å; E154-Q156 HydrophobicContact CG-CG 4.28Å; E154-Q156 PolarHBondContact OE1-NE2 3.43Å; E154-A180 WeakPolarHBondContact CA-O 3.31Å; E154-K181 HydrophobicContact CG-CB 4.47Å; E154-K181 HydrophobicContact CG-CD 4.08Å; E154-K181 IonicContact OE2-NZ 3.7Å; E154-K181 PolarHBondContact OE2-NZ 2.81Å
155	L	98.6	Very high	96.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	108.1	174.3	178.1	60.8	0	0	0	109.4	I132 F147 L152 L157 W170 W174 A180 Q185	I132-L155 HydrophobicContact CB-CD1 3.76Å; I132-L155 HydrophobicContact CG2-CD1 3.66Å; I132-L155 CarbonylContact O-C 3.59Å; I132-L155 VanDerWaalsContact O-CA 3.32Å; I132-L155 WeakPolarHBondContact O-CA 3.41Å; F147-L155 HydrophobicContact CD2-CD2 4.4Å; F147-L155 HydrophobicContact CE1-CD1 4.4Å; F147-L155 HydrophobicContact CE2-CD2 3.95Å; F147-L155 HydrophobicContact CZ-CD1 4.21Å; F147-L155 HydrophobicContact CZ-CD2 4.11Å; L152-L155 HydrophobicContact CD1-CB 4.34Å; L152-L155 HydrophobicContact CD1-CD2 4.38Å; L155-L157 HydrophobicContact CD1-CD2 3.97Å; L155-L157 HydrophobicContact CD1-CG 4.37Å; L155-L157 HydrophobicContact CD2-CD1 3.98Å; L155-L157 HydrophobicContact CD2-CD2 4.46Å; L155-L157 HydrophobicContact CD2-CG 4.29Å; L155-L157 HydrophobicContact CG-CD1 4.17Å; L155-L157 HydrophobicContact CG-CD2 4.07Å; L155-L157 HydrophobicContact CG-CG 3.93Å; L155-W170 HydrophobicContact CD2-CH2 4.01Å; L155-W170 HydrophobicContact CD2-CZ3 4.35Å; L155-W174 HydrophobicContact CD2-CZ3 4.33Å; L155-A180 HydrophobicContact CB-CB 3.95Å; L155-A180 PolarHBondContact N-O 3.28Å; L155-Q185 PolarHBondContact O-NE2 2.9Å
156	Q	98.5	Very high	97	Very high	60 Å²	60	49.8 Å²	49.8	28%	0.28	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.6	178.7	-58.9	-171.1	-5	0	0	111.5	I132 N133 L134 S135 E154	I132-Q156 PolarHBondContact O-N 2.88Å; N133-Q156 HydrophobicContact CB-CB 4.17Å; N133-Q156 PolarHBondContact ND2-OE1 2.79Å; N133-Q156 PolarHBondContact OD1-OE1 3.49Å; L134-Q156 CarbonylContact C-O 3.49Å; L134-Q156 PolarHBondContact N-O 3.01Å; S135-Q156 PolarHBondContact N-O 2.86Å; E154-Q156 HydrophobicContact CG-CG 4.28Å; E154-Q156 PolarHBondContact OE1-NE2 3.43Å
157	L	98.3	Very high	97	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.27	C	S	.	.			trans	-125.9	2.8	-175.7	-60.8	179.1	0	0	0	113.7	L134 L142 L155 N160 F162 W170 M171 L182 L187	L134-L157 HydrophobicContact CB-CD2 4.16Å; L134-L157 HydrophobicContact CD1-CD2 4.31Å; L142-L157 HydrophobicContact CD2-CD1 4.16Å; L142-L157 HydrophobicContact CD2-CD2 3.72Å; L155-L157 HydrophobicContact CD1-CD2 3.97Å; L155-L157 HydrophobicContact CD1-CG 4.37Å; L155-L157 HydrophobicContact CD2-CD1 3.98Å; L155-L157 HydrophobicContact CD2-CD2 4.46Å; L155-L157 HydrophobicContact CD2-CG 4.29Å; L155-L157 HydrophobicContact CG-CD1 4.17Å; L155-L157 HydrophobicContact CG-CD2 4.07Å; L155-L157 HydrophobicContact CG-CG 3.93Å; L157-N160 PolarHBondContact O-ND2 2.87Å; L157-F162 HydrophobicContact CB-CE2 4.09Å; L157-F162 HydrophobicContact CB-CZ 4.23Å; L157-F162 HydrophobicContact CD1-CZ 4.4Å; L157-W170 HydrophobicContact CD1-CH2 4.48Å; L157-M171 HydrophobicContact CD1-CE 4.21Å; L157-M171 HydrophobicContact CD1-CG 4.48Å; L157-M171 HydrophobicContact CD1-SD 4.03Å; L157-L182 HydrophobicContact CD1-CD2 3.96Å; L157-L182 HydrophobicContact CG-CD2 4.35Å; L157-L187 HydrophobicContact CB-CD2 4.05Å
158	E	96.8	Very high	97	Very high	68 Å²	68	52.7 Å²	52.7	32%	0.318	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	152	-177.7	-61.7	-166.5	142.2	0	0	113.2	S135 S136 N160 Q185 N186 L187	S135-E158 CarbonylContact C-O 3.5Å; S135-E158 WeakPolarHBondContact CA-O 3.48Å; S135-E158 WeakPolarHBondContact CB-O 3.24Å; S136-E158 PolarHBondContact N-O 2.01Å; E158-N160 VanDerWaalsContact C-N 3.29Å; E158-N160 PolarHBondContact O-N 2.76Å; E158-Q185 HydrophobicContact CG-CB 3.82Å; E158-Q185 HydrophobicContact CG-CG 3.83Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.22Å; E158-N186 PolarHBondContact OE1-N 2.85Å; E158-N186 VanDerWaalsContact OE1-N 3.07Å; E158-L187 HydrophobicContact CG-CD2 4.32Å
159	Q	96.5	Very high	97.2	Very high	138 Å²	138	49.9 Å²	49.9	65%	0.645	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	33.3	175.8	-52.6	178	7.2	0	0	114.5	S136	S136-Q159 WeakPolarHBondContact CA-O 3.28Å; S136-Q159 PolarHBondContact OG-OE1 3.05Å
160	N	97.9	Very high	97.5	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.102	23%	0.231	C	C	.	.			trans	-97.7	177.2	163.9	-79.7	-76.1	0	0	0	111.1	L134 N137 L139 L157 E158 F162	L134-N160 PolarHBondContact O-ND2 3.31Å; N137-N160 WeakPolarHBondContact CA-OD1 2.88Å; N137-N160 VanDerWaalsContact CB-OD1 3.23Å; N137-N160 WeakPolarHBondContact CB-OD1 3.11Å; N137-N160 PolarHBondContact N-OD1 3.48Å; N137-N160 PolarHBondContact O-OD1 2.97Å; L139-N160 HydrophobicContact CB-CB 4.26Å; L139-N160 WeakPolarHBondContact CB-OD1 3.3Å; L139-N160 PolarHBondContact N-OD1 3.44Å; L139-N160 VanDerWaalsContact N-OD1 3.17Å; L157-N160 PolarHBondContact O-ND2 2.87Å; E158-N160 VanDerWaalsContact C-N 3.29Å; E158-N160 PolarHBondContact O-N 2.76Å; N160-F162 HydrophobicContact CB-CD2 3.97Å; N160-F162 HydrophobicContact CB-CE1 4.41Å; N160-F162 HydrophobicContact CB-CE2 3.54Å; N160-F162 HydrophobicContact CB-CZ 3.78Å
161	F	96.6	Very high	97.5	Very high	90 Å²	90	45.2 Å²	45.2	40%	0.395	23%	0.226	S	C	.	.			trans	-116	50.1	-173	-63.1	-92.6	0	0	0	111	N137 L139 T140 I190	N137-F161 WeakPolarHBondContact O-CD2 3.41Å; N137-F161 WeakPolarHBondContact O-CE2 3.49Å; L139-F161 CarbonylContact O-C 3.48Å; L139-F161 VanDerWaalsContact O-C 3.25Å; L139-F161 PolarHBondContact O-N 2.92Å; T140-F161 WeakPolarHBondContact CA-O 3.31Å; F161-I190 HydrophobicContact CB-CD1 4.13Å; F161-I190 HydrophobicContact CD1-CD1 4.1Å
162	F	98.1	Very high	97.6	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	136.7	-174.7	-64.6	-64.5	0	0	0	112.3	L139 T140 L142 L157 N160 I168 M171 C189 I190	L139-F162 HydrophobicContact CB-CE1 3.89Å; L139-F162 HydrophobicContact CB-CZ 4.32Å; T140-F162 CarbonylContact O-C 3.58Å; T140-F162 WeakPolarHBondContact O-CA 3.47Å; L142-F162 HydrophobicContact CB-CE1 4.19Å; L157-F162 HydrophobicContact CB-CE2 4.09Å; L157-F162 HydrophobicContact CB-CZ 4.23Å; L157-F162 HydrophobicContact CD1-CZ 4.4Å; N160-F162 HydrophobicContact CB-CD2 3.97Å; N160-F162 HydrophobicContact CB-CE1 4.41Å; N160-F162 HydrophobicContact CB-CE2 3.54Å; N160-F162 HydrophobicContact CB-CZ 3.78Å; F162-I168 HydrophobicContact CB-CD1 3.97Å; F162-I168 HydrophobicContact CD1-CG2 4.22Å; F162-M171 HydrophobicContact CD1-CE 4.14Å; F162-M171 HydrophobicContact CE1-CE 3.7Å; F162-M171 HydrophobicContact CE1-SD 4.35Å; F162-M171 HydrophobicContact CE2-SD 4.29Å; F162-M171 HydrophobicContact CZ-CE 3.94Å; F162-M171 HydrophobicContact CZ-SD 4.22Å; F162-C189 HydrophobicContact CB-CB 4.43Å; F162-C189 CarbonylContact O-C 3.59Å; F162-C189 WeakPolarHBondContact O-CA 3.28Å; F162-I190 PolarHBondContact O-N 3.05Å
163	N	97.8	Very high	97.6	Very high	81 Å²	81	40.9 Å²	40.9	43%	0.433	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	130.2	173.7	-68.7	-19.5	0	0	0	110	T140 S165 I168	T140-N163 PolarHBondContact O-N 3.37Å; N163-S165 PolarHBondContact O-N 2.03Å; N163-S165 PolarHBondContact O-OG 3.03Å; N163-I168 VanDerWaalsContact O-CD1 3.25Å; N163-I168 WeakPolarHBondContact O-CD1 3.32Å
164	C	97.7	Very high	97.6	Very high	23 Å²	23	37.2 Å²	37.2	16%	0.155	18%	0.182	C	C	.	.	S	Bend	trans	-62.5	106.9	176.5	-59	0	0	0	0	109.2	C189 I190 N191 M202	C164-C189 VanDerWaalsContact CA-SG 3.51Å; C164-C189 HydrophobicContact CB-CB 3.91Å; C164-C189 WeakPolarHBondContact CB-SG 3.38Å; C164-C189 WeakPolarHBondContact SG-CB 3.49Å; C164-C189 CovalentContact SG-SG 2.03Å; C164-C189 PolarHBondContact SG-SG 3.43Å; C164-I190 PolarHBondContact N-O 2.92Å; C164-I190 VanDerWaalsContact SG-C 3.52Å; C164-I190 PolarHBondContact SG-N 2.8Å; C164-N191 WeakPolarHBondContact CB-OD1 3.28Å; C164-N191 PolarHBondContact SG-OD1 3.45Å; C164-M202 HydrophobicContact CB-SD 4.31Å
165	S	96.8	Very high	97.5	Very high	27 Å²	27	36.4 Å²	36.4	19%	0.189	18%	0.178	C	C	.	.	S	Bend	trans	-161	169.1	-171.1	61.7	0	0	0	0	110.4	N163 D167 I168	N163-S165 PolarHBondContact O-N 2.03Å; N163-S165 PolarHBondContact O-OG 3.03Å; S165-D167 PolarHBondContact O-N 2.86Å; S165-I168 WeakPolarHBondContact O-CG1 3.43Å; S165-I168 PolarHBondContact O-N 3.34Å
166	C	97.4	Very high	97.4	Very high	21 Å²	21	42 Å²	42	14%	0.142	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-65.7	-28	178.1	-164.9	0	0	0	0	113	I168 R169 I204 C207 V289 V290	C166-I168 PolarHBondContact O-N 3.44Å; C166-I168 VanDerWaalsContact O-N 3.09Å; C166-R169 WeakPolarHBondContact O-CB 3.49Å; C166-R169 PolarHBondContact O-N 3.18Å; C166-I204 HydrophobicContact CB-CG2 4.43Å; C166-C207 WeakPolarHBondContact CA-SG 3.48Å; C166-C207 HydrophobicContact CB-CB 3.87Å; C166-C207 WeakPolarHBondContact CB-SG 3.42Å; C166-C207 VanDerWaalsContact SG-CA 3.58Å; C166-C207 WeakPolarHBondContact SG-CB 3.02Å; C166-C207 CovalentContact SG-SG 2.03Å; C166-C207 PolarHBondContact SG-SG 2.74Å; C166-V289 HydrophobicContact CB-CG2 4.19Å; C166-V290 WeakPolarHBondContact SG-CG2 3.46Å
167	D	97.1	Very high	97.2	Very high	74 Å²	74	44.9 Å²	44.9	40%	0.396	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-63	-20	-177.7	-59.4	-34.4	0	0	0	114	T141 S165 W170	T141-D167 WeakPolarHBondContact OG1-CB 3.46Å; S165-D167 PolarHBondContact O-N 2.86Å; D167-W170 PolarHBondContact O-NE1 2.91Å
168	I	97.6	Very high	97.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-110.5	6.1	177.6	65.2	164.7	0	0	0	112.8	F162 N163 S165 C166 W170 M171 C189 L199 M202	F162-I168 HydrophobicContact CB-CD1 3.97Å; F162-I168 HydrophobicContact CD1-CG2 4.22Å; N163-I168 VanDerWaalsContact O-CD1 3.25Å; N163-I168 WeakPolarHBondContact O-CD1 3.32Å; S165-I168 WeakPolarHBondContact O-CG1 3.43Å; S165-I168 PolarHBondContact O-N 3.34Å; C166-I168 PolarHBondContact O-N 3.44Å; C166-I168 VanDerWaalsContact O-N 3.09Å; I168-W170 PolarHBondContact O-N 2.8Å; I168-M171 HydrophobicContact CB-CE 4.19Å; I168-M171 HydrophobicContact CB-CG 4.44Å; I168-M171 HydrophobicContact CB-SD 3.98Å; I168-M171 HydrophobicContact CG2-CE 3.82Å; I168-M171 HydrophobicContact CG2-SD 4.17Å; I168-M171 VanDerWaalsContact O-CB 3.31Å; I168-M171 WeakPolarHBondContact O-CB 3.15Å; I168-M171 PolarHBondContact O-N 2.82Å; I168-C189 HydrophobicContact CD1-CB 3.68Å; I168-L199 HydrophobicContact CD1-CD1 3.85Å; I168-L199 HydrophobicContact CG1-CD1 4.49Å; I168-M202 HydrophobicContact CD1-SD 4.02Å; I168-M202 HydrophobicContact CG1-CE 4.12Å; I168-M202 HydrophobicContact CG1-SD 4Å
169	R	97.7	Very high	97.1	Very high	40 Å²	40	47.8 Å²	47.8	15%	0.151	24%	0.24	C	C	.	.	H	α-helix	trans	-58.1	-35.7	178.7	-177.9	75.5	176	92.6	9.6	112	C166 M171 Q172 L173 M202 C207 V290	C166-R169 WeakPolarHBondContact O-CB 3.49Å; C166-R169 PolarHBondContact O-N 3.18Å; R169-M171 PolarHBondContact O-N 3.37Å; R169-Q172 VanDerWaalsContact NH1-CD 3.27Å; R169-Q172 WeakPolarHBondContact O-CB 3.5Å; R169-Q172 PolarHBondContact O-N 3.17Å; R169-Q172 VanDerWaalsContact O-N 3.11Å; R169-L173 PolarHBondContact O-N 2.85Å; R169-L173 VanDerWaalsContact O-N 3.09Å; R169-M202 HydrophobicContact CB-CE 4.24Å; R169-C207 VanDerWaalsContact CB-SG 3.55Å; R169-C207 PolarHBondContact NE-O 3.06Å; R169-V290 HydrophobicContact CB-CG1 4.09Å; R169-V290 HydrophobicContact CB-CG2 4.12Å; R169-V290 HydrophobicContact CG-CB 4.48Å; R169-V290 HydrophobicContact CG-CG1 3.62Å; R169-V290 HydrophobicContact CG-CG2 4.13Å
170	W	97.8	Very high	97.1	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-57.2	-35.3	174.9	71.7	-95.7	0	0	0	112.6	L142 W144 F147 L155 L157 D167 I168 Q172 L173 W174 V290	L142-W170 HydrophobicContact CB-CZ2 4.39Å; L142-W170 HydrophobicContact CD2-CH2 4.38Å; L142-W170 HydrophobicContact CD2-CZ2 4.16Å; L142-W170 HydrophobicContact CG-CZ2 4.22Å; L142-W170 PolarHBondContact O-NE1 2.67Å; W144-W170 HydrophobicContact CB-CB 4.2Å; W144-W170 HydrophobicContact CB-CD2 3.66Å; W144-W170 HydrophobicContact CB-CE3 4.02Å; W144-W170 HydrophobicContact CB-CG 3.74Å; W144-W170 HydrophobicContact CG-CB 4.42Å; W144-W170 HydrophobicContact CG-CG 4.31Å; F147-W170 HydrophobicContact CD2-CH2 4.08Å; F147-W170 AromaticContact CE2-CH2 3.68Å; F147-W170 HydrophobicContact CE2-CH2 3.68Å; F147-W170 HydrophobicContact CE2-CZ2 4.12Å; L155-W170 HydrophobicContact CD2-CH2 4.01Å; L155-W170 HydrophobicContact CD2-CZ3 4.35Å; L157-W170 HydrophobicContact CD1-CH2 4.48Å; D167-W170 PolarHBondContact O-NE1 2.91Å; I168-W170 PolarHBondContact O-N 2.8Å; W170-Q172 VanDerWaalsContact C-N 3.33Å; W170-Q172 PolarHBondContact O-N 3.42Å; W170-L173 PolarHBondContact O-N 3.4Å; W170-W174 AromaticContact CE3-CD2 3.84Å; W170-W174 HydrophobicContact CE3-CD2 3.84Å; W170-W174 AromaticContact CE3-CE2 3.94Å; W170-W174 HydrophobicContact CE3-CE3 4.22Å; W170-W174 HydrophobicContact CE3-CG 4.1Å; W170-W174 HydrophobicContact CE3-CZ2 4.38Å; W170-W174 AromaticContact CZ3-CD2 3.83Å; W170-W174 HydrophobicContact CZ3-CD2 3.83Å; W170-W174 AromaticContact CZ3-CE3 3.71Å; W170-W174 HydrophobicContact CZ3-CE3 3.71Å; W170-W174 HydrophobicContact CZ3-CG 4.42Å; W170-W174 HydrophobicContact CZ3-CH2 4.25Å; W170-W174 HydrophobicContact CZ3-CZ2 4.38Å; W170-W174 AromaticContact CZ3-CZ3 3.92Å; W170-W174 HydrophobicContact CZ3-CZ3 3.92Å; W170-W174 VanDerWaalsContact O-CD1 3.3Å; W170-W174 PolarHBondContact O-N 2.79Å; W170-V290 WeakPolarHBondContact CB-O 3.16Å
171	M	97.8	Very high	97.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.6	-38.9	178.5	-60.1	179.2	-171.1	0	0	111.1	L142 L157 F162 I168 R169 W174 Q175 L199	L142-M171 HydrophobicContact CB-CE 3.53Å; L142-M171 HydrophobicContact CD2-CE 4.13Å; L142-M171 HydrophobicContact CG-CE 4.35Å; L157-M171 HydrophobicContact CD1-CE 4.21Å; L157-M171 HydrophobicContact CD1-CG 4.48Å; L157-M171 HydrophobicContact CD1-SD 4.03Å; F162-M171 HydrophobicContact CD1-CE 4.14Å; F162-M171 HydrophobicContact CE1-CE 3.7Å; F162-M171 HydrophobicContact CE1-SD 4.35Å; F162-M171 HydrophobicContact CE2-SD 4.29Å; F162-M171 HydrophobicContact CZ-CE 3.94Å; F162-M171 HydrophobicContact CZ-SD 4.22Å; I168-M171 HydrophobicContact CB-CE 4.19Å; I168-M171 HydrophobicContact CB-CG 4.44Å; I168-M171 HydrophobicContact CB-SD 3.98Å; I168-M171 HydrophobicContact CG2-CE 3.82Å; I168-M171 HydrophobicContact CG2-SD 4.17Å; I168-M171 VanDerWaalsContact O-CB 3.31Å; I168-M171 WeakPolarHBondContact O-CB 3.15Å; I168-M171 PolarHBondContact O-N 2.82Å; R169-M171 PolarHBondContact O-N 3.37Å; M171-W174 PolarHBondContact O-N 3.28Å; M171-Q175 WeakPolarHBondContact O-CB 3.47Å; M171-Q175 PolarHBondContact O-N 2.99Å; M171-L199 HydrophobicContact CB-CD2 3.73Å
172	Q	97.4	Very high	97.1	Very high	10 Å²	10	41.2 Å²	41.2	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-45.2	174.9	-177	-175.3	7.7	0	0	110.4	R169 W170 W174 Q175 E176 L199 M202	R169-Q172 VanDerWaalsContact NH1-CD 3.27Å; R169-Q172 WeakPolarHBondContact O-CB 3.5Å; R169-Q172 PolarHBondContact O-N 3.17Å; R169-Q172 VanDerWaalsContact O-N 3.11Å; W170-Q172 VanDerWaalsContact C-N 3.33Å; W170-Q172 PolarHBondContact O-N 3.42Å; Q172-W174 PolarHBondContact O-N 3.43Å; Q172-Q175 WeakPolarHBondContact O-CB 3.34Å; Q172-Q175 PolarHBondContact O-N 3.1Å; Q172-E176 WeakPolarHBondContact O-CG 3.35Å; Q172-E176 PolarHBondContact O-N 3.31Å; Q172-L199 HydrophobicContact CB-CG 4.12Å; Q172-M202 HydrophobicContact CB-CE 4.4Å; Q172-M202 PolarHBondContact NE2-O 3.18Å; Q172-M202 PolarHBondContact OE1-O 2.94Å
173	L	96.8	Very high	97	Very high	20 Å²	20	45.4 Å²	45.4	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-61	-44.2	176.6	-66.1	174.7	0	0	0	111.8	R169 W170 Q175 E176 Q177 L209 V290	R169-L173 PolarHBondContact O-N 2.85Å; R169-L173 VanDerWaalsContact O-N 3.09Å; W170-L173 PolarHBondContact O-N 3.4Å; L173-Q175 VanDerWaalsContact C-N 3.3Å; L173-Q175 PolarHBondContact O-N 3.15Å; L173-E176 PolarHBondContact O-N 3.47Å; L173-Q177 WeakPolarHBondContact O-CB 3.17Å; L173-Q177 VanDerWaalsContact O-CG 3.28Å; L173-Q177 WeakPolarHBondContact O-CG 3.38Å; L173-Q177 PolarHBondContact O-N 3.26Å; L173-L209 HydrophobicContact CD1-CD1 4.05Å; L173-L209 HydrophobicContact CD1-CD2 4.17Å; L173-L209 HydrophobicContact CD1-CG 3.91Å; L173-V290 HydrophobicContact CD1-CG1 3.56Å
174	W	97.4	Very high	97	Very high	59 Å²	59	45.8 Å²	45.8	22%	0.223	24%	0.241	C	C	.	.	H	α-helix	trans	-65	-35.3	175.9	-77	25.1	0	0	0	112.2	F147 L152 L155 W170 M171 Q172 E176 Q177 G178 E179 A180 L182	F147-W174 HydrophobicContact CB-CH2 4.29Å; F147-W174 HydrophobicContact CD2-CH2 4.46Å; L152-W174 HydrophobicContact CD1-CZ3 4.37Å; L155-W174 HydrophobicContact CD2-CZ3 4.33Å; W170-W174 AromaticContact CE3-CD2 3.84Å; W170-W174 HydrophobicContact CE3-CD2 3.84Å; W170-W174 AromaticContact CE3-CE2 3.94Å; W170-W174 HydrophobicContact CE3-CE3 4.22Å; W170-W174 HydrophobicContact CE3-CG 4.1Å; W170-W174 HydrophobicContact CE3-CZ2 4.38Å; W170-W174 AromaticContact CZ3-CD2 3.83Å; W170-W174 HydrophobicContact CZ3-CD2 3.83Å; W170-W174 AromaticContact CZ3-CE3 3.71Å; W170-W174 HydrophobicContact CZ3-CE3 3.71Å; W170-W174 HydrophobicContact CZ3-CG 4.42Å; W170-W174 HydrophobicContact CZ3-CH2 4.25Å; W170-W174 HydrophobicContact CZ3-CZ2 4.38Å; W170-W174 AromaticContact CZ3-CZ3 3.92Å; W170-W174 HydrophobicContact CZ3-CZ3 3.92Å; W170-W174 VanDerWaalsContact O-CD1 3.3Å; W170-W174 PolarHBondContact O-N 2.79Å; M171-W174 PolarHBondContact O-N 3.28Å; Q172-W174 PolarHBondContact O-N 3.43Å; W174-E176 VanDerWaalsContact C-N 3.34Å; W174-Q177 PolarHBondContact O-N 3.5Å; W174-G178 PolarHBondContact O-N 3.08Å; W174-E179 HydrophobicContact CB-CB 3.81Å; W174-E179 HydrophobicContact CD2-CB 3.9Å; W174-E179 HydrophobicContact CE3-CB 4.11Å; W174-E179 HydrophobicContact CG-CB 3.77Å; W174-E179 HydrophobicContact CG-CG 4.36Å; W174-E179 PolarHBondContact O-N 3.1Å; W174-A180 HydrophobicContact CE3-CB 4.18Å; W174-A180 HydrophobicContact CZ3-CB 4.12Å; W174-L182 HydrophobicContact CB-CD1 3.48Å; W174-L182 VanDerWaalsContact CB-CD1 3.48Å; W174-L182 HydrophobicContact CD2-CD1 4.18Å; W174-L182 HydrophobicContact CE3-CD1 3.59Å; W174-L182 HydrophobicContact CG-CD1 4.22Å
175	Q	96.8	Very high	96.9	Very high	26 Å²	26	45.2 Å²	45.2	12%	0.121	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-39.4	173.9	-166	177.2	23.6	0	0	111.5	M171 Q172 L173 L182 N183 Q185	M171-Q175 WeakPolarHBondContact O-CB 3.47Å; M171-Q175 PolarHBondContact O-N 2.99Å; Q172-Q175 WeakPolarHBondContact O-CB 3.34Å; Q172-Q175 PolarHBondContact O-N 3.1Å; L173-Q175 VanDerWaalsContact C-N 3.3Å; L173-Q175 PolarHBondContact O-N 3.15Å; Q175-L182 HydrophobicContact CB-CB 4.41Å; Q175-N183 VanDerWaalsContact O-CB 3.27Å; Q175-N183 WeakPolarHBondContact O-CB 3.33Å; Q175-Q185 PolarHBondContact NE2-O 3.46Å; Q175-Q185 VanDerWaalsContact NE2-O 3.12Å
176	E	95.9	Very high	96.9	Very high	118 Å²	118	49.5 Å²	49.5	55%	0.551	26%	0.257	S	S	*	.	H	α-helix	trans	-70.1	-38.7	176.5	-71	167.4	-170.6	0	0	112.3	Q172 L173 W174	Q172-E176 WeakPolarHBondContact O-CG 3.35Å; Q172-E176 PolarHBondContact O-N 3.31Å; L173-E176 PolarHBondContact O-N 3.47Å; W174-E176 VanDerWaalsContact C-N 3.34Å
177	Q	95.9	Very high	96.9	Very high	120 Å²	120	48.8 Å²	48.8	56%	0.561	25%	0.252	S	S	*	.	H	α-helix	trans	-81.1	-16.1	-179.1	-68.9	168.7	-14.3	0	0	113.6	L173 W174 E179	L173-Q177 WeakPolarHBondContact O-CB 3.17Å; L173-Q177 VanDerWaalsContact O-CG 3.28Å; L173-Q177 WeakPolarHBondContact O-CG 3.38Å; L173-Q177 PolarHBondContact O-N 3.26Å; W174-Q177 PolarHBondContact O-N 3.5Å; Q177-E179 HydrophobicContact CB-CG 3.93Å
178	G	95.7	Very high	96.9	Very high	32 Å²	32	49.8 Å²	49.8	33%	0.33	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	19.1	-175.2	0	0	0	0	0	114.3	W174	W174-G178 PolarHBondContact O-N 3.08Å
179	E	96.8	Very high	96.9	Very high	97 Å²	97	49.8 Å²	49.8	45%	0.453	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-71	139.4	-179.3	-68.9	-62.8	159.2	0	0	111.8	W174 Q177 K181 L182	W174-E179 HydrophobicContact CB-CB 3.81Å; W174-E179 HydrophobicContact CD2-CB 3.9Å; W174-E179 HydrophobicContact CE3-CB 4.11Å; W174-E179 HydrophobicContact CG-CB 3.77Å; W174-E179 HydrophobicContact CG-CG 4.36Å; W174-E179 PolarHBondContact O-N 3.1Å; Q177-E179 HydrophobicContact CB-CG 3.93Å; E179-K181 PolarHBondContact O-N 2.74Å; E179-L182 PolarHBondContact O-N 2.94Å
180	A	97.3	Very high	96.9	Very high	8 Å²	8	50.2 Å²	50.2	7%	0.066	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	46.3	29.2	178.6	0	0	0	0	0	115.4	L152 E154 L155 W174 L182	L152-A180 HydrophobicContact CB-CB 4.13Å; E154-A180 WeakPolarHBondContact CA-O 3.31Å; L155-A180 HydrophobicContact CB-CB 3.95Å; L155-A180 PolarHBondContact N-O 3.28Å; W174-A180 HydrophobicContact CE3-CB 4.18Å; W174-A180 HydrophobicContact CZ3-CB 4.12Å; A180-L182 VanDerWaalsContact C-N 3.26Å; A180-L182 PolarHBondContact O-N 3Å
181	K	97.3	Very high	96.9	Very high	101 Å²	101	52.6 Å²	52.6	44%	0.439	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	59.4	24.8	-176.6	-55.8	-175.3	-174.5	169.8	0	115.4	E154 E179 N183 S184 Q185	E154-K181 HydrophobicContact CG-CB 4.47Å; E154-K181 HydrophobicContact CG-CD 4.08Å; E154-K181 IonicContact OE2-NZ 3.7Å; E154-K181 PolarHBondContact OE2-NZ 2.81Å; E179-K181 PolarHBondContact O-N 2.74Å; K181-N183 VanDerWaalsContact C-N 3.26Å; K181-N183 PolarHBondContact O-N 3.07Å; K181-S184 PolarHBondContact O-N 2.89Å; K181-S184 PolarHBondContact O-OG 2.86Å; K181-Q185 PolarHBondContact O-NE2 3.45Å
182	L	96.7	Very high	96.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-65.7	-30.3	175.2	-75.6	160.1	0	0	0	112.5	L157 W174 Q175 E179 A180 S184 Q185 L187	L157-L182 HydrophobicContact CD1-CD2 3.96Å; L157-L182 HydrophobicContact CG-CD2 4.35Å; W174-L182 HydrophobicContact CB-CD1 3.48Å; W174-L182 VanDerWaalsContact CB-CD1 3.48Å; W174-L182 HydrophobicContact CD2-CD1 4.18Å; W174-L182 HydrophobicContact CE3-CD1 3.59Å; W174-L182 HydrophobicContact CG-CD1 4.22Å; Q175-L182 HydrophobicContact CB-CB 4.41Å; E179-L182 PolarHBondContact O-N 2.94Å; A180-L182 VanDerWaalsContact C-N 3.26Å; A180-L182 PolarHBondContact O-N 3Å; L182-S184 PolarHBondContact O-N 3.45Å; L182-Q185 WeakPolarHBondContact O-CB 3.18Å; L182-Q185 PolarHBondContact O-N 2.92Å; L182-L187 HydrophobicContact CD2-CD1 3.66Å
183	N	96.3	Very high	96.4	Very high	95 Å²	95	63.9 Å²	63.9	51%	0.508	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-58	-26.9	175	65.4	-31.4	0	0	0	114.4	Q175 K181 Q185	Q175-N183 VanDerWaalsContact O-CB 3.27Å; Q175-N183 WeakPolarHBondContact O-CB 3.33Å; K181-N183 VanDerWaalsContact C-N 3.26Å; K181-N183 PolarHBondContact O-N 3.07Å; N183-Q185 VanDerWaalsContact C-N 3.32Å
184	S	96.6	Very high	96.3	Very high	88 Å²	88	65.6 Å²	65.6	62%	0.615	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-82.3	-7.8	177.7	67.8	0	0	0	0	114.3	K181 L182	K181-S184 PolarHBondContact O-N 2.89Å; K181-S184 PolarHBondContact O-OG 2.86Å; L182-S184 PolarHBondContact O-N 3.45Å
185	Q	97	Very high	96.1	Very high	11 Å²	11	65 Å²	65	5%	0.051	37%	0.373	C	S	.	.	S	Bend	trans	-101.8	147.1	-174.8	-69.6	171.9	69.5	0	0	112	L155 E158 Q175 K181 L182 N183 L187	L155-Q185 PolarHBondContact O-NE2 2.9Å; E158-Q185 HydrophobicContact CG-CB 3.82Å; E158-Q185 HydrophobicContact CG-CG 3.83Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.22Å; Q175-Q185 PolarHBondContact NE2-O 3.46Å; Q175-Q185 VanDerWaalsContact NE2-O 3.12Å; K181-Q185 PolarHBondContact O-NE2 3.45Å; L182-Q185 WeakPolarHBondContact O-CB 3.18Å; L182-Q185 PolarHBondContact O-N 2.92Å; N183-Q185 VanDerWaalsContact C-N 3.32Å; Q185-L187 HydrophobicContact CB-CD2 4.09Å; Q185-L187 HydrophobicContact CB-CG 4.07Å; Q185-L187 PolarHBondContact O-N 3.5Å
186	N	95.7	Very high	96.1	Very high	117 Å²	117	70 Å²	70	63%	0.626	40%	0.396	S	S	*	.			trans	-92.8	85	173.5	-70.8	-46.3	0	0	0	110.1	E158 Y188	E158-N186 PolarHBondContact OE1-N 2.85Å; E158-N186 VanDerWaalsContact OE1-N 3.07Å; N186-Y188 HydrophobicContact CB-CE2 4Å; N186-Y188 VanDerWaalsContact O-CD2 3.29Å; N186-Y188 WeakPolarHBondContact O-CD2 3.36Å; N186-Y188 VanDerWaalsContact O-CE2 3.29Å; N186-Y188 WeakPolarHBondContact O-CE2 3.47Å
187	L	97.4	Very high	96.2	Very high	7 Å²	7	66.4 Å²	66.4	4%	0.037	38%	0.381	C	S	.	.			trans	-89.7	143.9	179.8	-57.3	179.6	0	0	0	111.9	L157 E158 L182 Q185 L199	L157-L187 HydrophobicContact CB-CD2 4.05Å; E158-L187 HydrophobicContact CG-CD2 4.32Å; L182-L187 HydrophobicContact CD2-CD1 3.66Å; Q185-L187 HydrophobicContact CB-CD2 4.09Å; Q185-L187 HydrophobicContact CB-CG 4.07Å; Q185-L187 PolarHBondContact O-N 3.5Å; L187-L199 HydrophobicContact CB-CB 3.9Å; L187-L199 HydrophobicContact CB-CD2 3.82Å; L187-L199 HydrophobicContact CD1-CD2 3.8Å; L187-L199 HydrophobicContact CG-CD2 4.49Å; L187-L199 PolarHBondContact O-N 2.03Å
188	Y	97.6	Very high	96.2	Very high	95 Å²	95	62.1 Å²	62.1	37%	0.373	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	153.7	179.3	-59.2	-97.7	0	0	0	110.1	N186 Q196 L197 P198	N186-Y188 HydrophobicContact CB-CE2 4Å; N186-Y188 VanDerWaalsContact O-CD2 3.29Å; N186-Y188 WeakPolarHBondContact O-CD2 3.36Å; N186-Y188 VanDerWaalsContact O-CE2 3.29Å; N186-Y188 WeakPolarHBondContact O-CE2 3.47Å; Y188-Q196 HydrophobicContact CD1-CG 3.78Å; Y188-Q196 HydrophobicContact CG-CG 3.93Å; Y188-L197 CarbonylContact C-O 3.52Å; Y188-L197 VanDerWaalsContact CA-O 3.24Å; Y188-L197 WeakPolarHBondContact CA-O 3.31Å; Y188-P198 HydrophobicContact CD1-CB 4.26Å; Y188-P198 HydrophobicContact CD1-CG 4.16Å; Y188-P198 HydrophobicContact CE1-CB 4.26Å; Y188-P198 HydrophobicContact CE1-CG 3.97Å
189	C	98	Very high	96.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	162.1	168.7	68.1	0	0	0	0	110.4	F162 C164 I168 Q196 L197	F162-C189 HydrophobicContact CB-CB 4.43Å; F162-C189 CarbonylContact O-C 3.59Å; F162-C189 WeakPolarHBondContact O-CA 3.28Å; C164-C189 VanDerWaalsContact CA-SG 3.51Å; C164-C189 HydrophobicContact CB-CB 3.91Å; C164-C189 WeakPolarHBondContact CB-SG 3.38Å; C164-C189 WeakPolarHBondContact SG-CB 3.49Å; C164-C189 CovalentContact SG-SG 2.03Å; C164-C189 PolarHBondContact SG-SG 3.43Å; I168-C189 HydrophobicContact CD1-CB 3.68Å; C189-Q196 CarbonylContact O-C 3.35Å; C189-Q196 WeakPolarHBondContact O-CA 3.34Å; C189-L197 PolarHBondContact N-O 3.36Å; C189-L197 PolarHBondContact O-N 3.35Å
190	I	97.7	Very high	96.2	Very high	49 Å²	49	61.6 Å²	61.6	25%	0.251	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.9	-178.4	-55.7	171.4	0	0	0	107.8	F161 F162 C164 S195	F161-I190 HydrophobicContact CB-CD1 4.13Å; F161-I190 HydrophobicContact CD1-CD1 4.1Å; F162-I190 PolarHBondContact O-N 3.05Å; C164-I190 PolarHBondContact N-O 2.92Å; C164-I190 VanDerWaalsContact SG-C 3.52Å; C164-I190 PolarHBondContact SG-N 2.8Å; I190-S195 WeakPolarHBondContact CA-O 3.37Å
191	N	96.1	Very high	96.1	Very high	52 Å²	52	69.1 Å²	69.1	28%	0.278	38%	0.377	S	S	.	.			trans	-73.7	167.9	174.9	-74.2	-42.2	0	0	0	111	C164 D193 G194 S195	C164-N191 WeakPolarHBondContact CB-OD1 3.28Å; C164-N191 PolarHBondContact SG-OD1 3.45Å; N191-D193 WeakPolarHBondContact CB-OD1 3.14Å; N191-D193 PolarHBondContact O-N 3.14Å; N191-D193 VanDerWaalsContact O-N 3.13Å; N191-G194 PolarHBondContact O-N 3.37Å; N191-S195 PolarHBondContact N-O 3.25Å; N191-S195 PolarHBondContact ND2-OG 3.09Å
192	A	92.6	Very high	96.1	Very high	120 Å²	120	64.7 Å²	64.7	99%	0.992	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.4	177.6	0	0	0	0	0	113.8	G194	A192-G194 VanDerWaalsContact C-N 3.28Å
193	D	93.6	Very high	96	Very high	127 Å²	127	71.8 Å²	71.8	68%	0.679	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.1	175	67.9	-8.3	0	0	0	113.5	N191 S195	N191-D193 WeakPolarHBondContact CB-OD1 3.14Å; N191-D193 PolarHBondContact O-N 3.14Å; N191-D193 VanDerWaalsContact O-N 3.13Å; D193-S195 VanDerWaalsContact C-N 3.29Å; D193-S195 VanDerWaalsContact CG-OG 3.32Å; D193-S195 VanDerWaalsContact OD1-CB 3.26Å; D193-S195 WeakPolarHBondContact OD1-CB 3.27Å; D193-S195 PolarHBondContact OD1-N 3.2Å; D193-S195 PolarHBondContact OD1-OG 3.06Å; D193-S195 PolarHBondContact OD2-OG 3.46Å
194	G	93	Very high	96	Very high	55 Å²	55	69.8 Å²	69.8	57%	0.567	39%	0.385	S	S	*	.	S	Bend	trans	82.4	-0.1	-177.4	0	0	0	0	0	114.5	N191 A192	N191-G194 PolarHBondContact O-N 3.37Å; A192-G194 VanDerWaalsContact C-N 3.28Å
195	S	94.9	Very high	95.9	Very high	47 Å²	47	70.3 Å²	70.3	33%	0.329	39%	0.388	S	S	.	.			trans	-71.3	140.1	176.4	66.8	0	0	0	0	111.3	I190 N191 D193	I190-S195 WeakPolarHBondContact CA-O 3.37Å; N191-S195 PolarHBondContact N-O 3.25Å; N191-S195 PolarHBondContact ND2-OG 3.09Å; D193-S195 VanDerWaalsContact C-N 3.29Å; D193-S195 VanDerWaalsContact CG-OG 3.32Å; D193-S195 VanDerWaalsContact OD1-CB 3.26Å; D193-S195 WeakPolarHBondContact OD1-CB 3.27Å; D193-S195 PolarHBondContact OD1-N 3.2Å; D193-S195 PolarHBondContact OD1-OG 3.06Å; D193-S195 PolarHBondContact OD2-OG 3.46Å
196	Q	96	Very high	95.7	Very high	132 Å²	132	76.8 Å²	76.8	62%	0.617	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	124.1	177.3	-171.8	175.9	-7.8	0	0	109.9	Y188 C189	Y188-Q196 HydrophobicContact CD1-CG 3.78Å; Y188-Q196 HydrophobicContact CG-CG 3.93Å; C189-Q196 CarbonylContact O-C 3.35Å; C189-Q196 WeakPolarHBondContact O-CA 3.34Å
197	L	97.2	Very high	95.7	Very high	42 Å²	42	71.3 Å²	71.3	22%	0.22	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131	179.9	-172.8	70.6	0	0	0	109.6	Y188 C189 L199 R201 M202	Y188-L197 CarbonylContact C-O 3.52Å; Y188-L197 VanDerWaalsContact CA-O 3.24Å; Y188-L197 WeakPolarHBondContact CA-O 3.31Å; C189-L197 PolarHBondContact N-O 3.36Å; C189-L197 PolarHBondContact O-N 3.35Å; L197-L199 PolarHBondContact O-N 3.09Å; L197-R201 HydrophobicContact CD1-CB 4.05Å; L197-R201 HydrophobicContact CG-CB 4.24Å; L197-M202 HydrophobicContact CD2-CB 4.46Å
198	P	97.1	Very high	95.5	Very high	29 Å²	29	75 Å²	75	19%	0.188	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	133.4	169.1	-20.8	31.6	0	0	0	110.5	Y188 F200 R201	Y188-P198 HydrophobicContact CD1-CB 4.26Å; Y188-P198 HydrophobicContact CD1-CG 4.16Å; Y188-P198 HydrophobicContact CE1-CB 4.26Å; Y188-P198 HydrophobicContact CE1-CG 3.97Å; P198-F200 VanDerWaalsContact C-N 3.28Å; P198-F200 HydrophobicContact CB-CD1 3.75Å; P198-F200 HydrophobicContact CB-CE1 3.32Å; P198-F200 HydrophobicContact CB-CZ 3.93Å; P198-F200 HydrophobicContact CG-CE1 4.27Å; P198-F200 PolarHBondContact O-N 2.58Å; P198-R201 HydrophobicContact CB-CG 4.5Å; P198-R201 WeakPolarHBondContact O-CB 3.48Å; P198-R201 PolarHBondContact O-N 3.36Å
199	L	96.7	Very high	95.4	Very high	4 Å²	4	74 Å²	74	2%	0.021	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-57	-39.7	-170.2	-175.8	68	0	0	0	113	I168 M171 Q172 L187 L197 R201 M202	I168-L199 HydrophobicContact CD1-CD1 3.85Å; I168-L199 HydrophobicContact CG1-CD1 4.49Å; M171-L199 HydrophobicContact CB-CD2 3.73Å; Q172-L199 HydrophobicContact CB-CG 4.12Å; L187-L199 HydrophobicContact CB-CB 3.9Å; L187-L199 HydrophobicContact CB-CD2 3.82Å; L187-L199 HydrophobicContact CD1-CD2 3.8Å; L187-L199 HydrophobicContact CG-CD2 4.49Å; L187-L199 PolarHBondContact O-N 2.03Å; L197-L199 PolarHBondContact O-N 3.09Å; L199-R201 PolarHBondContact O-N 3Å; L199-R201 VanDerWaalsContact O-N 3.09Å; L199-M202 HydrophobicContact CD1-CE 4.27Å; L199-M202 HydrophobicContact CD1-SD 4.33Å; L199-M202 WeakPolarHBondContact O-CB 3.36Å; L199-M202 PolarHBondContact O-N 3.32Å
200	F	95	Very high	95.3	Very high	114 Å²	114	74.2 Å²	74.2	50%	0.5	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-63.5	-12.8	177.4	71.3	-93.1	0	0	0	114.6	P198	P198-F200 VanDerWaalsContact C-N 3.28Å; P198-F200 HydrophobicContact CB-CD1 3.75Å; P198-F200 HydrophobicContact CB-CE1 3.32Å; P198-F200 HydrophobicContact CB-CZ 3.93Å; P198-F200 HydrophobicContact CG-CE1 4.27Å; P198-F200 PolarHBondContact O-N 2.58Å
201	R	96.3	Very high	95.2	Very high	167 Å²	167	78.5 Å²	78.5	63%	0.63	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-98.6	0.2	174.6	-62.2	-169.9	175	-176.6	-2.5	113.1	L197 P198 L199 N203	L197-R201 HydrophobicContact CD1-CB 4.05Å; L197-R201 HydrophobicContact CG-CB 4.24Å; P198-R201 HydrophobicContact CB-CG 4.5Å; P198-R201 WeakPolarHBondContact O-CB 3.48Å; P198-R201 PolarHBondContact O-N 3.36Å; L199-R201 PolarHBondContact O-N 3Å; L199-R201 VanDerWaalsContact O-N 3.09Å; R201-N203 PolarHBondContact O-N 3.42Å
202	M	96.1	Very high	95.2	Very high	8 Å²	8	78 Å²	78	4%	0.039	43%	0.427	C	S	.	.			trans	-63.4	131.5	178.6	-172.2	175.3	69.8	0	0	109.8	C164 I168 R169 Q172 L197 L199 I204	C164-M202 HydrophobicContact CB-SD 4.31Å; I168-M202 HydrophobicContact CD1-SD 4.02Å; I168-M202 HydrophobicContact CG1-CE 4.12Å; I168-M202 HydrophobicContact CG1-SD 4Å; R169-M202 HydrophobicContact CB-CE 4.24Å; Q172-M202 HydrophobicContact CB-CE 4.4Å; Q172-M202 PolarHBondContact NE2-O 3.18Å; Q172-M202 PolarHBondContact OE1-O 2.94Å; L197-M202 HydrophobicContact CD2-CB 4.46Å; L199-M202 HydrophobicContact CD1-CE 4.27Å; L199-M202 HydrophobicContact CD1-SD 4.33Å; L199-M202 WeakPolarHBondContact O-CB 3.36Å; L199-M202 PolarHBondContact O-N 3.32Å; M202-I204 HydrophobicContact CG-CD1 4.26Å; M202-I204 HydrophobicContact CG-CG1 3.89Å; M202-I204 HydrophobicContact SD-CG1 4.18Å
203	N	95.2	Very high	95.3	Very high	148 Å²	148	75.1 Å²	75.1	79%	0.791	40%	0.4	S	S	*	.			trans	-135.8	101.6	178.5	-176.3	9.8	0	0	0	108.7	R201	R201-N203 PolarHBondContact O-N 3.42Å
204	I	95.5	Very high	95.4	Very high	54 Å²	54	71 Å²	71	28%	0.277	38%	0.379	S	S	.	.			trans	-113.4	121.3	178.9	-55	-62.4	0	0	0	107.1	C166 M202 C207	C166-I204 HydrophobicContact CB-CG2 4.43Å; M202-I204 HydrophobicContact CG-CD1 4.26Å; M202-I204 HydrophobicContact CG-CG1 3.89Å; M202-I204 HydrophobicContact SD-CG1 4.18Å; I204-C207 HydrophobicContact CB-CB 3.98Å; I204-C207 HydrophobicContact CG2-CB 3.72Å
205	S	94.4	Very high	95.4	Very high	99 Å²	99	71.4 Å²	71.4	69%	0.692	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	149.8	174.5	57.7	0	0	0	0	111	C207	S205-C207 VanDerWaalsContact C-N 3.32Å; S205-C207 PolarHBondContact O-N 3.45Å
206	Q	93.2	Very high	95.3	Very high	147 Å²	147	73 Å²	73	69%	0.687	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	40.6	175.3	-61.5	-176	-6.9	0	0	112.6	S236	Q206-S236 CarbonylContact C-O 3.39Å; Q206-S236 WeakPolarHBondContact CB-OG 3.35Å; Q206-S236 CarbonylContact O-C 3Å; Q206-S236 VanDerWaalsContact O-CB 3.3Å; Q206-S236 WeakPolarHBondContact O-CB 3.45Å; Q206-S236 VanDerWaalsContact O-O 3.12Å; Q206-S236 PolarHBondContact O-OG 3.08Å
207	C	95.8	Very high	95.1	Very high	1 Å²	1	72.2 Å²	72.2	1%	0.007	38%	0.379	C	S	.	.			trans	-143	76.9	-173.9	-177.4	0	0	0	0	111	C166 R169 I204 S205 S236 V290	C166-C207 WeakPolarHBondContact CA-SG 3.48Å; C166-C207 HydrophobicContact CB-CB 3.87Å; C166-C207 WeakPolarHBondContact CB-SG 3.42Å; C166-C207 VanDerWaalsContact SG-CA 3.58Å; C166-C207 WeakPolarHBondContact SG-CB 3.02Å; C166-C207 CovalentContact SG-SG 2.03Å; C166-C207 PolarHBondContact SG-SG 2.74Å; R169-C207 VanDerWaalsContact CB-SG 3.55Å; R169-C207 PolarHBondContact NE-O 3.06Å; I204-C207 HydrophobicContact CB-CB 3.98Å; I204-C207 HydrophobicContact CG2-CB 3.72Å; S205-C207 VanDerWaalsContact C-N 3.32Å; S205-C207 PolarHBondContact O-N 3.45Å; C207-S236 CarbonylContact C-O 3.56Å; C207-S236 VanDerWaalsContact CA-O 3.28Å; C207-S236 WeakPolarHBondContact CA-O 3.23Å; C207-S236 PolarHBondContact N-O 3.24Å; C207-V290 VanDerWaalsContact SG-CG2 3.57Å
208	D	93.7	Very high	94.9	Very high	86 Å²	86	75.6 Å²	75.6	46%	0.46	40%	0.397	S	S	.	.			trans	-130.1	163.1	-171.1	-60	-63.7	0	0	0	110.9	S236 N288	D208-S236 PolarHBondContact N-O 2.87Å; D208-N288 PolarHBondContact O-ND2 2.86Å
209	L	95.6	Very high	94.9	Very high	74 Å²	74	74.9 Å²	74.9	39%	0.387	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-62.3	149.6	173.9	-76.6	167.8	0	0	0	110.6	L173 V290	L173-L209 HydrophobicContact CD1-CD1 4.05Å; L173-L209 HydrophobicContact CD1-CD2 4.17Å; L173-L209 HydrophobicContact CD1-CG 3.91Å; L209-V290 HydrophobicContact CD2-CG1 4.02Å; L209-V290 HydrophobicContact CG-CG1 4.1Å
210	P	96.3	Very high	94.9	Very high	3 Å²	3	79 Å²	79	2%	0.019	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-69.9	137.4	178.4	29.4	-33.1	0	0	0	111.2	P239 A286 S293	P210-P239 HydrophobicContact CB-CB 3.73Å; P210-P239 HydrophobicContact CB-CG 3.88Å; P210-A286 HydrophobicContact CB-CB 4.07Å; P210-A286 HydrophobicContact CG-CB 4.47Å; P210-A286 WeakPolarHBondContact CG-O 3.08Å; P210-S293 VanDerWaalsContact O-CB 3.24Å; P210-S293 WeakPolarHBondContact O-CB 3.01Å; P210-S293 PolarHBondContact O-OG 2.95Å
211	E	95.3	Very high	95	Very high	140 Å²	140	74.1 Å²	74.1	65%	0.654	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	134.4	169.4	-67.3	-174.8	177.8	0	0	109.5	G233 S234	E211-G233 CarbonylContact O-C 3.38Å; E211-G233 WeakPolarHBondContact O-CA 3.24Å; E211-S234 PolarHBondContact N-O 3.37Å; E211-S234 PolarHBondContact O-N 3.41Å
212	I	95.7	Very high	95.1	Very high	40 Å²	40	72.1 Å²	72.1	21%	0.205	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.7	-176.2	-169.5	166.4	0	0	0	110.8	N232 C284 A286 A295	I212-N232 WeakPolarHBondContact CA-O 3.3Å; I212-C284 HydrophobicContact CD1-CB 4.06Å; I212-C284 WeakPolarHBondContact CD1-O 3.25Å; I212-A286 HydrophobicContact CB-CB 4.24Å; I212-A286 HydrophobicContact CD1-CB 3.98Å; I212-A286 HydrophobicContact CG1-CB 4.32Å; I212-A295 HydrophobicContact CD1-CB 3.96Å; I212-A295 HydrophobicContact CG1-CB 3.97Å; I212-A295 HydrophobicContact CG2-CB 4.07Å
213	S	94.6	Very high	95.1	Very high	60 Å²	60	74.1 Å²	74.1	42%	0.42	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	144.9	174.6	60	0	0	0	0	111	C231 N232	S213-C231 CarbonylContact O-C 3.58Å; S213-C231 WeakPolarHBondContact O-CA 3.31Å; S213-N232 PolarHBondContact N-O 3.49Å; S213-N232 PolarHBondContact O-N 3.18Å; S213-N232 PolarHBondContact OG-O 3.45Å
214	V	95.9	Very high	95.2	Very high	40 Å²	40	68.6 Å²	68.6	24%	0.242	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.4	178.5	-72	0	0	0	0	109.7	H216 T230 C231 W243 C284 A295 V297	V214-H216 VanDerWaalsContact CG2-O 3.26Å; V214-H216 WeakPolarHBondContact CG2-O 3.15Å; V214-H216 PolarHBondContact O-N 3.5Å; V214-T230 WeakPolarHBondContact CA-O 3.46Å; V214-C231 HydrophobicContact CG1-CB 4.19Å; V214-W243 HydrophobicContact CG1-CH2 3.96Å; V214-W243 HydrophobicContact CG1-CZ2 4.5Å; V214-C284 HydrophobicContact CG1-CB 4.34Å; V214-A295 HydrophobicContact CG1-CB 3.74Å; V214-A295 HydrophobicContact CG2-CB 4.31Å; V214-V297 HydrophobicContact CB-CG2 4.05Å; V214-V297 HydrophobicContact CG1-CG2 4.18Å; V214-V297 HydrophobicContact CG2-CG2 3.87Å
215	S	93.9	Very high	95.3	Very high	64 Å²	64	70.1 Å²	70.1	45%	0.448	39%	0.386	S	S	.	.	S	Bend	trans	-63.7	-24	-180	52	0	0	0	0	114	I229 T230	S215-I229 WeakPolarHBondContact OG-CG1 3.33Å; S215-T230 PolarHBondContact N-O 3.16Å; S215-T230 PolarHBondContact OG-N 2.93Å; S215-T230 PolarHBondContact OG-O 3.39Å; S215-T230 VanDerWaalsContact OG-O 3.13Å
216	H	92.3	Very high	95.4	Very high	82 Å²	82	70.4 Å²	70.4	38%	0.38	38%	0.379	S	S	.	.			trans	-138.6	142.3	-178.3	-59.1	80.3	0	0	0	110	V214 I229 V297	V214-H216 VanDerWaalsContact CG2-O 3.26Å; V214-H216 WeakPolarHBondContact CG2-O 3.15Å; V214-H216 PolarHBondContact O-N 3.5Å; H216-I229 HydrophobicContact CB-CD1 4.02Å; H216-V297 HydrophobicContact CB-CG1 4.48Å; H216-V297 WeakPolarHBondContact O-CG2 3.48Å
217	V	90.4	Very high	95.5	Very high	115 Å²	115	64 Å²	64	70%	0.697	35%	0.351	S	S	*	.	S	Bend	trans	-83.9	-37.7	171.2	-175.3	0	0	0	0	110.6	V297 A298	V217-V297 WeakPolarHBondContact O-CA 3.13Å; V217-V297 WeakPolarHBondContact O-CG1 3.27Å; V217-A298 PolarHBondContact O-N 2.93Å
218	N	94.8	Very high	95.5	Very high	112 Å²	112	67.4 Å²	67.4	60%	0.599	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.1	142	176.8	-43.7	-28.5	0	0	0	108
219	L	96.1	Very high	95.6	Very high	15 Å²	15	63.3 Å²	63.3	8%	0.079	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.6	177.9	-179	61.9	0	0	0	109.5	V221 A227 I229 L270 L282 V297 A298 L299 T300	L219-V221 HydrophobicContact CD1-CG2 4.14Å; L219-V221 HydrophobicContact CD2-CG2 4.23Å; L219-V221 HydrophobicContact CG-CG2 3.78Å; L219-A227 HydrophobicContact CD1-CB 4.37Å; L219-A227 HydrophobicContact CD2-CB 4.1Å; L219-I229 HydrophobicContact CD2-CB 4.5Å; L219-L270 HydrophobicContact CD2-CD1 4.45Å; L219-L282 HydrophobicContact CD2-CD1 4.16Å; L219-V297 HydrophobicContact CB-CG1 4.01Å; L219-A298 PolarHBondContact N-O 3.41Å; L219-L299 HydrophobicContact CB-CD1 4.33Å; L219-L299 HydrophobicContact CD2-CD1 4.02Å; L219-L299 HydrophobicContact CG-CD1 4.05Å; L219-L299 CarbonylContact O-C 3.57Å; L219-L299 WeakPolarHBondContact O-CA 3.41Å; L219-T300 PolarHBondContact O-N 2.94Å
220	T	96.7	Very high	95.6	Very high	91 Å²	91	61.5 Å²	61.5	56%	0.558	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	124.2	175.9	53.5	0	0	0	0	109.8	T300	T220-T300 CarbonylContact C-O 3.59Å; T220-T300 WeakPolarHBondContact CA-O 3.44Å
221	V	97.3	Very high	95.5	Very high	11 Å²	11	61.4 Å²	61.4	7%	0.067	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.1	-176.8	-166.4	0	0	0	0	109.1	L219 D225 A227 V273 L299 T300 V301 Y302	L219-V221 HydrophobicContact CD1-CG2 4.14Å; L219-V221 HydrophobicContact CD2-CG2 4.23Å; L219-V221 HydrophobicContact CG-CG2 3.78Å; V221-D225 HydrophobicContact CG1-CB 4Å; V221-A227 HydrophobicContact CG1-CB 4.16Å; V221-A227 HydrophobicContact CG2-CB 3.58Å; V221-V273 HydrophobicContact CG1-CB 4.26Å; V221-V273 HydrophobicContact CG1-CG2 4.08Å; V221-L299 HydrophobicContact CG2-CD1 3.89Å; V221-T300 PolarHBondContact N-O 2.99Å; V221-V301 CarbonylContact O-C 3.56Å; V221-V301 VanDerWaalsContact O-CA 3.27Å; V221-V301 WeakPolarHBondContact O-CA 3.3Å; V221-Y302 PolarHBondContact O-N 2.97Å
222	R	97.6	Very high	95.5	Very high	125 Å²	125	56.8 Å²	56.8	47%	0.472	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	143.3	170.3	-170.1	-177.1	-176.8	-179.2	2.3	109.4	G224 D225 Y302 L384	R222-G224 PolarHBondContact O-N 3.31Å; R222-D225 WeakPolarHBondContact CB-OD2 3.33Å; R222-D225 WeakPolarHBondContact O-CB 3.48Å; R222-D225 PolarHBondContact O-N 3.03Å; R222-Y302 CarbonylContact C-O 3.57Å; R222-Y302 WeakPolarHBondContact CA-O 3.23Å; R222-L384 HydrophobicContact CG-CD1 4.36Å
223	E	97.2	Very high	95.5	Very high	50 Å²	50	54.9 Å²	54.9	23%	0.234	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	132.3	172.9	-179.8	-174.8	-143.2	0	0	111	D225 V273 S275 V301 Y302 Y303 R306	E223-D225 VanDerWaalsContact C-N 3.32Å; E223-V273 CarbonylContact C-O 3.57Å; E223-V273 WeakPolarHBondContact CA-O 3.49Å; E223-S275 PolarHBondContact OE1-OG 3.49Å; E223-V301 HydrophobicContact CB-CG1 4.12Å; E223-Y302 PolarHBondContact N-O 3.36Å; E223-Y303 WeakPolarHBondContact OE2-CB 3.5Å; E223-R306 IonicContact OE1-CZ 3.54Å; E223-R306 IonicContact OE1-NH1 3.65Å; E223-R306 IonicContact OE1-NH2 2.67Å; E223-R306 PolarHBondContact OE1-NH2 2.9Å; E223-R306 IonicContact OE2-CZ 3.81Å; E223-R306 IonicContact OE2-NH2 2.76Å; E223-R306 PolarHBondContact OE2-NH2 3.14Å
224	G	96.2	Very high	95.4	Very high	32 Å²	32	53.6 Å²	53.6	33%	0.33	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	-15.7	-177	0	0	0	0	0	115.2	R222 N272 V273	R222-G224 PolarHBondContact O-N 3.31Å; G224-N272 WeakPolarHBondContact CA-OD1 3.37Å; G224-V273 PolarHBondContact N-O 3.09Å
225	D	97.6	Very high	95.2	Very high	86 Å²	86	53 Å²	53	46%	0.46	31%	0.305	S	S	.	.			trans	-81.6	165.7	177.6	-70.8	-13.8	0	0	0	111.6	V221 R222 E223 V273	V221-D225 HydrophobicContact CG1-CB 4Å; R222-D225 WeakPolarHBondContact CB-OD2 3.33Å; R222-D225 WeakPolarHBondContact O-CB 3.48Å; R222-D225 PolarHBondContact O-N 3.03Å; E223-D225 VanDerWaalsContact C-N 3.32Å; D225-V273 WeakPolarHBondContact O-CG2 3.45Å; D225-V273 PolarHBondContact O-N 3.37Å
226	N	97.3	Very high	95.2	Very high	104 Å²	104	51.9 Å²	51.9	56%	0.556	30%	0.297	S	S	*	.			trans	-102	150.7	174.1	-60.6	-12.4	0	0	0	110.2	L270 V271 N272	N226-L270 CarbonylContact C-O 3.58Å; N226-L270 VanDerWaalsContact CA-O 3.22Å; N226-L270 WeakPolarHBondContact CA-O 3.25Å; N226-L270 WeakPolarHBondContact CB-O 3.49Å; N226-V271 WeakPolarHBondContact OD1-CA 3.39Å; N226-N272 PolarHBondContact OD1-N 3.35Å
227	A	95.9	Very high	95.3	Very high	12 Å²	12	50.2 Å²	50.2	10%	0.099	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.6	175.6	0	0	0	0	0	111.3	L219 V221 T269 L270	L219-A227 HydrophobicContact CD1-CB 4.37Å; L219-A227 HydrophobicContact CD2-CB 4.1Å; V221-A227 HydrophobicContact CG1-CB 4.16Å; V221-A227 HydrophobicContact CG2-CB 3.58Å; A227-T269 CarbonylContact O-C 3.54Å; A227-T269 WeakPolarHBondContact O-CA 3.39Å; A227-L270 PolarHBondContact N-O 3.48Å; A227-L270 PolarHBondContact O-N 3.44Å
228	V	95.6	Very high	95.4	Very high	73 Å²	73	48.7 Å²	48.7	44%	0.442	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132.2	176.4	-177.6	0	0	0	0	108.8	N267 L268 T269	V228-N267 HydrophobicContact CG1-CB 4.3Å; V228-L268 WeakPolarHBondContact CA-O 3.36Å; V228-T269 HydrophobicContact CG2-CG2 3.93Å
229	I	95.4	Very high	95.5	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	133.1	174.1	-168.8	167.9	0	0	0	110.7	S215 H216 L219 W243 N267 L268 L282 V297	S215-I229 WeakPolarHBondContact OG-CG1 3.33Å; H216-I229 HydrophobicContact CB-CD1 4.02Å; L219-I229 HydrophobicContact CD2-CB 4.5Å; I229-W243 HydrophobicContact CB-CZ2 4.47Å; I229-W243 HydrophobicContact CD1-CH2 3.96Å; I229-W243 HydrophobicContact CG1-CH2 4.05Å; I229-W243 HydrophobicContact CG1-CZ2 4.13Å; I229-W243 HydrophobicContact CG2-CH2 3.93Å; I229-W243 HydrophobicContact CG2-CZ2 3.79Å; I229-N267 CarbonylContact O-C 3.58Å; I229-N267 WeakPolarHBondContact O-CA 3.17Å; I229-L268 HydrophobicContact CG2-CB 3.8Å; I229-L268 HydrophobicContact CG2-CD2 4.04Å; I229-L268 HydrophobicContact CG2-CG 4.24Å; I229-L268 PolarHBondContact N-O 2.91Å; I229-L268 PolarHBondContact O-N 3.43Å; I229-L282 HydrophobicContact CG2-CD1 4.43Å; I229-V297 HydrophobicContact CD1-CB 3.85Å; I229-V297 HydrophobicContact CD1-CG1 3.55Å; I229-V297 HydrophobicContact CD1-CG2 3.61Å
230	T	95.3	Very high	95.4	Very high	36 Å²	36	47.8 Å²	47.8	22%	0.221	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.9	178.7	-55.8	0	0	0	0	110.8	V214 S215 N232 A265 N267	V214-T230 WeakPolarHBondContact CA-O 3.46Å; S215-T230 PolarHBondContact N-O 3.16Å; S215-T230 PolarHBondContact OG-N 2.93Å; S215-T230 PolarHBondContact OG-O 3.39Å; S215-T230 VanDerWaalsContact OG-O 3.13Å; T230-N232 VanDerWaalsContact CG2-OD1 3.29Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.29Å; T230-A265 HydrophobicContact CG2-CB 4.47Å; T230-N267 WeakPolarHBondContact CB-OD1 3.24Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.17Å; T230-N267 PolarHBondContact OG1-OD1 3.48Å
231	C	95.6	Very high	95.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.9	166.2	179.3	0	0	0	0	109.8	S213 V214 V241 W243 A265 I266 C284	S213-C231 CarbonylContact O-C 3.58Å; S213-C231 WeakPolarHBondContact O-CA 3.31Å; V214-C231 HydrophobicContact CG1-CB 4.19Å; C231-V241 HydrophobicContact CB-CG1 4.38Å; C231-W243 HydrophobicContact CB-CH2 4.19Å; C231-W243 HydrophobicContact CB-CZ2 3.4Å; C231-W243 VanDerWaalsContact CB-CZ2 3.4Å; C231-A265 CarbonylContact O-C 3.56Å; C231-A265 VanDerWaalsContact O-CA 3.31Å; C231-A265 WeakPolarHBondContact O-CA 2.97Å; C231-I266 PolarHBondContact N-O 2.98Å; C231-I266 PolarHBondContact O-N 3.01Å; C231-C284 HydrophobicContact CB-CB 3.63Å; C231-C284 WeakPolarHBondContact CB-SG 3.38Å; C231-C284 WeakPolarHBondContact SG-CB 3.45Å; C231-C284 CovalentContact SG-SG 2.01Å; C231-C284 PolarHBondContact SG-SG 2.9Å
232	N	94.6	Very high	95.2	Very high	43 Å²	43	46.4 Å²	46.4	23%	0.23	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.3	179	-63.1	-22.1	0	0	0	108.9	I212 S213 T230 V263 A265	I212-N232 WeakPolarHBondContact CA-O 3.3Å; S213-N232 PolarHBondContact N-O 3.49Å; S213-N232 PolarHBondContact O-N 3.18Å; S213-N232 PolarHBondContact OG-O 3.45Å; T230-N232 VanDerWaalsContact CG2-OD1 3.29Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.29Å; N232-V263 HydrophobicContact CB-CG1 3.96Å; N232-A265 WeakPolarHBondContact OD1-CB 3.48Å
233	G	95.1	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	134.4	167.1	0	0	0	0	0	110.4	E211 V263 H264	E211-G233 CarbonylContact O-C 3.38Å; E211-G233 WeakPolarHBondContact O-CA 3.24Å; G233-V263 WeakPolarHBondContact O-CA 3.48Å; G233-H264 PolarHBondContact N-O 2.89Å; G233-H264 PolarHBondContact O-N 3.27Å
234	S	93.7	Very high	94.9	Very high	33 Å²	33	42 Å²	42	23%	0.231	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	161.2	175.2	67	0	0	0	0	109.9	E211	E211-S234 PolarHBondContact N-O 3.37Å; E211-S234 PolarHBondContact O-N 3.41Å
235	G	91.6	Very high	94.6	Very high	29 Å²	29	41.5 Å²	41.5	30%	0.299	24%	0.242	S	C	.	.			trans	142.2	177.6	-178.6	0	0	0	0	0	111.6	P237 L238	G235-P237 CarbonylContact C-O 3.55Å; G235-P237 CarbonylContact O-C 3.54Å; G235-L238 WeakPolarHBondContact O-CA 3.42Å; G235-L238 PolarHBondContact O-N 2.9Å
236	S	92.9	Very high	94.2	Very high	39 Å²	39	43.5 Å²	43.5	27%	0.273	26%	0.257	S	S	.	.	S	Bend	trans	-132.4	121.8	176.8	-171.2	0	0	0	0	110.6	Q206 C207 D208	Q206-S236 CarbonylContact C-O 3.39Å; Q206-S236 WeakPolarHBondContact CB-OG 3.35Å; Q206-S236 CarbonylContact O-C 3Å; Q206-S236 VanDerWaalsContact O-CB 3.3Å; Q206-S236 WeakPolarHBondContact O-CB 3.45Å; Q206-S236 VanDerWaalsContact O-O 3.12Å; Q206-S236 PolarHBondContact O-OG 3.08Å; C207-S236 CarbonylContact C-O 3.56Å; C207-S236 VanDerWaalsContact CA-O 3.28Å; C207-S236 WeakPolarHBondContact CA-O 3.23Å; C207-S236 PolarHBondContact N-O 3.24Å; D208-S236 PolarHBondContact N-O 2.87Å
237	P	94.8	Very high	93.9	Very high	47 Å²	47	41 Å²	41	31%	0.305	26%	0.256	S	S	.	.	S	Bend	cis	-62.3	154.4	-2.9	-24.5	37.2	0	0	0	113.2	G235 P239 N288 V289	G235-P237 CarbonylContact C-O 3.55Å; G235-P237 CarbonylContact O-C 3.54Å; P237-P239 WeakPolarHBondContact O-CD 3.12Å; P237-N288 PolarHBondContact O-ND2 3.47Å; P237-V289 HydrophobicContact CG-CG2 3.89Å
238	L	93.1	Very high	93.8	Very high	84 Å²	84	41.2 Å²	41.2	44%	0.44	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-54.6	121.7	178.8	-178.5	72.3	0	0	0	109.3	G235 N262 H264	G235-L238 WeakPolarHBondContact O-CA 3.42Å; G235-L238 PolarHBondContact O-N 2.9Å; L238-N262 WeakPolarHBondContact CD1-O 3.28Å; L238-H264 HydrophobicContact CD1-CB 4.38Å
239	P	95.3	Very high	93.8	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.013	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-74.8	150.3	-177.2	27.2	-32.6	0	0	0	113.2	P210 P237 H264 A286 E287 N288	P210-P239 HydrophobicContact CB-CB 3.73Å; P210-P239 HydrophobicContact CB-CG 3.88Å; P237-P239 WeakPolarHBondContact O-CD 3.12Å; P239-H264 WeakPolarHBondContact O-CB 3.45Å; P239-H264 PolarHBondContact O-ND1 3.29Å; P239-H264 VanDerWaalsContact O-ND1 3.16Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.36Å; P239-E287 CarbonylContact C-O 3.15Å; P239-E287 WeakPolarHBondContact CA-O 3.35Å; P239-E287 WeakPolarHBondContact CB-O 3.02Å; P239-N288 HydrophobicContact CB-CB 4.35Å
240	D	93.9	Very high	93.8	Very high	106 Å²	106	43.6 Å²	43.6	57%	0.567	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	140.4	159.3	-164.9	28.6	0	0	0	108.9	H264 A286 E287	D240-H264 IonicContact OD1-CE1 3.36Å; D240-H264 PolarHBondContact OD1-CE1 3.09Å; D240-H264 IonicContact OD1-ND1 3.28Å; D240-A286 CarbonylContact O-C 3.59Å; D240-A286 VanDerWaalsContact O-CA 3.27Å; D240-A286 WeakPolarHBondContact O-CA 3.34Å; D240-E287 PolarHBondContact N-O 3.11Å; D240-E287 PolarHBondContact O-N 3.47Å
241	V	95	Very high	93.7	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	140.5	-174.8	179	0	0	0	0	107.7	C231 H264 I266 C284 I285 A286	C231-V241 HydrophobicContact CB-CG1 4.38Å; V241-H264 HydrophobicContact CG2-CB 3.91Å; V241-I266 HydrophobicContact CB-CD1 4.35Å; V241-I266 HydrophobicContact CB-CG1 4.26Å; V241-I266 HydrophobicContact CG1-CB 4.41Å; V241-I266 HydrophobicContact CG1-CG1 4.23Å; V241-I266 WeakPolarHBondContact O-CD1 3.03Å; V241-C284 VanDerWaalsContact CG1-SG 3.58Å; V241-I285 VanDerWaalsContact CA-O 3.28Å; V241-I285 WeakPolarHBondContact CA-O 2.93Å; V241-A286 HydrophobicContact CG2-CB 4.15Å
242	D	94.8	Very high	93.6	Very high	69 Å²	69	49.8 Å²	49.8	37%	0.369	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	161.5	173.3	-161.8	14	0	0	0	111.6	H254 C284 I285	D242-H254 IonicContact OD1-CE1 3.53Å; D242-H254 IonicContact OD1-ND1 3.04Å; D242-H254 PolarHBondContact OD1-ND1 3.28Å; D242-C284 CarbonylContact O-C 3.51Å; D242-C284 WeakPolarHBondContact O-CA 3.35Å; D242-C284 PolarHBondContact O-SG 2.73Å; D242-I285 HydrophobicContact CB-CG1 4.24Å; D242-I285 PolarHBondContact N-O 2.91Å; D242-I285 PolarHBondContact O-N 2.92Å
243	W	95.6	Very high	93.6	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.015	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.5	172.6	-73.9	96.2	0	0	0	110.6	V214 I229 C231 V245 H254 I266 L268 L282 C284 V297	V214-W243 HydrophobicContact CG1-CH2 3.96Å; V214-W243 HydrophobicContact CG1-CZ2 4.5Å; I229-W243 HydrophobicContact CB-CZ2 4.47Å; I229-W243 HydrophobicContact CD1-CH2 3.96Å; I229-W243 HydrophobicContact CG1-CH2 4.05Å; I229-W243 HydrophobicContact CG1-CZ2 4.13Å; I229-W243 HydrophobicContact CG2-CH2 3.93Å; I229-W243 HydrophobicContact CG2-CZ2 3.79Å; C231-W243 HydrophobicContact CB-CH2 4.19Å; C231-W243 HydrophobicContact CB-CZ2 3.4Å; C231-W243 VanDerWaalsContact CB-CZ2 3.4Å; W243-V245 HydrophobicContact CB-CG1 4.1Å; W243-V245 PolarHBondContact O-N 2.98Å; W243-H254 PolarHBondContact O-CE1 3.46Å; W243-H254 VanDerWaalsContact O-CE1 3.31Å; W243-I266 PolarHBondContact NE1-O 3.09Å; W243-L268 HydrophobicContact CB-CD2 4.3Å; W243-L268 HydrophobicContact CD2-CB 4.02Å; W243-L268 HydrophobicContact CD2-CD2 3.92Å; W243-L268 HydrophobicContact CE3-CD2 4.07Å; W243-L268 HydrophobicContact CG-CB 3.88Å; W243-L268 HydrophobicContact CG-CD2 4.06Å; W243-L268 HydrophobicContact CG-CG 4.42Å; W243-L282 HydrophobicContact CE3-CB 4.27Å; W243-L282 HydrophobicContact CZ3-CB 3.91Å; W243-C284 HydrophobicContact CD2-CB 3.92Å; W243-C284 HydrophobicContact CE3-CB 3.71Å; W243-C284 HydrophobicContact CH2-CB 3.96Å; W243-C284 HydrophobicContact CZ2-CB 4.17Å; W243-C284 HydrophobicContact CZ3-CB 3.72Å; W243-V297 HydrophobicContact CH2-CG2 4.33Å
244	I	93.6	Very high	93.5	Very high	79 Å²	79	54.7 Å²	54.7	41%	0.405	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	101.5	169.4	-55.2	178.2	0	0	0	108.1	T283 I285	I244-T283 PolarHBondContact N-O 3.05Å; I244-I285 HydrophobicContact CD1-CD1 4.1Å; I244-I285 HydrophobicContact CD1-CG2 3.52Å; I244-I285 HydrophobicContact CG1-CD1 4.09Å; I244-I285 HydrophobicContact CG1-CG1 4.42Å; I244-I285 HydrophobicContact CG1-CG2 4.06Å
245	V	89.6	Confident	93.3	Very high	21 Å²	21	58.6 Å²	58.6	13%	0.127	33%	0.334	C	S	.	.			trans	-116.1	17.4	179.2	-64.9	0	0	0	0	112.8	W243 G247 L248 L268 L282	W243-V245 HydrophobicContact CB-CG1 4.1Å; W243-V245 PolarHBondContact O-N 2.98Å; V245-G247 PolarHBondContact O-N 2.89Å; V245-L248 HydrophobicContact CB-CB 4.22Å; V245-L248 HydrophobicContact CB-CD2 4.19Å; V245-L248 HydrophobicContact CG1-CD2 4.29Å; V245-L248 WeakPolarHBondContact O-CB 3.39Å; V245-L248 PolarHBondContact O-N 2.96Å; V245-L268 HydrophobicContact CG1-CD1 4.05Å; V245-L268 HydrophobicContact CG1-CD2 3.79Å; V245-L282 HydrophobicContact CG1-CD2 4.39Å
246	T	89.9	Confident	93.1	Very high	129 Å²	129	61.1 Å²	61.1	79%	0.791	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	122	177.2	-48.7	0	0	0	0	110.4
247	G	90.9	Very high	92.3	Very high	50 Å²	50	61.2 Å²	61.2	52%	0.515	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.4	-8.3	-178.1	0	0	0	0	0	114.7	V245 Q249	V245-G247 PolarHBondContact O-N 2.89Å; G247-Q249 PolarHBondContact O-NE2 3.48Å
248	L	94.6	Very high	91.1	Very high	17 Å²	17	65 Å²	65	9%	0.089	36%	0.358	C	S	.	.			trans	-68.8	130.3	171.6	-167	76.4	0	0	0	110.1	V245 N252 L270 D277 F280 L282 L299	V245-L248 HydrophobicContact CB-CB 4.22Å; V245-L248 HydrophobicContact CB-CD2 4.19Å; V245-L248 HydrophobicContact CG1-CD2 4.29Å; V245-L248 WeakPolarHBondContact O-CB 3.39Å; V245-L248 PolarHBondContact O-N 2.96Å; L248-N252 HydrophobicContact CD2-CB 4.37Å; L248-L270 HydrophobicContact CD2-CD2 3.58Å; L248-D277 HydrophobicContact CD1-CB 3.86Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.37Å; L248-F280 HydrophobicContact CB-CE1 4.31Å; L248-F280 HydrophobicContact CB-CE2 4.33Å; L248-F280 HydrophobicContact CB-CZ 4.07Å; L248-F280 HydrophobicContact CD1-CB 4.26Å; L248-F280 HydrophobicContact CD1-CD1 3.64Å; L248-F280 HydrophobicContact CD1-CD2 4.14Å; L248-F280 HydrophobicContact CD1-CE1 3.96Å; L248-F280 HydrophobicContact CD1-CE2 4.42Å; L248-F280 HydrophobicContact CD1-CG 3.74Å; L248-F280 HydrophobicContact CD1-CZ 4.34Å; L248-L282 HydrophobicContact CD1-CD2 4.17Å; L248-L282 HydrophobicContact CD2-CD2 4.27Å; L248-L299 HydrophobicContact CD1-CD2 4.39Å
249	Q	94.8	Very high	89.5	Confident	119 Å²	119	67 Å²	67	56%	0.556	37%	0.369	S	S	*	.			trans	-86.8	-29.4	-178	-58.8	-53.1	-51.2	0	0	112.5	G247 T274 E276 D277	G247-Q249 PolarHBondContact O-NE2 3.48Å; Q249-T274 HydrophobicContact CB-CG2 3.65Å; Q249-E276 HydrophobicContact CB-CB 4.49Å; Q249-E276 HydrophobicContact CG-CB 4.17Å; Q249-D277 PolarHBondContact N-OD1 3.08Å; Q249-D277 PolarHBondContact N-OD2 2.98Å
250	S	94.4	Very high	87.9	Confident	5 Å²	5	74.6 Å²	74.6	4%	0.035	40%	0.397	C	S	.	.	S	Bend	trans	-65.4	144.1	177.9	-62.5	0	0	0	0	112.2	N252 V273 T274 D277	S250-N252 PolarHBondContact O-N 2.8Å; S250-N252 PolarHBondContact O-ND2 3.27Å; S250-V273 WeakPolarHBondContact OG-CA 3.42Å; S250-T274 PolarHBondContact OG-N 3.04Å; S250-T274 VanDerWaalsContact OG-N 3.11Å; S250-D277 WeakPolarHBondContact CA-OD2 3.4Å; S250-D277 WeakPolarHBondContact CB-OD2 3.38Å; S250-D277 PolarHBondContact N-OD2 3.19Å; S250-D277 PolarHBondContact OG-OD2 3.18Å
251	I	93.2	Very high	86.7	Confident	116 Å²	116	75.6 Å²	75.6	60%	0.595	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	131.7	171.6	-60.8	171.2	0	0	0	108.1	V271	I251-V271 HydrophobicContact CB-CB 4.35Å; I251-V271 HydrophobicContact CG2-CB 4.45Å; I251-V271 PolarHBondContact O-N 3.2Å
252	N	94.5	Very high	85.9	Confident	50 Å²	50	80.9 Å²	80.9	27%	0.267	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	152.8	-177.3	60.5	82.9	0	0	0	112	L248 S250 L268 T269 L270	L248-N252 HydrophobicContact CD2-CB 4.37Å; S250-N252 PolarHBondContact O-N 2.8Å; S250-N252 PolarHBondContact O-ND2 3.27Å; N252-L268 HydrophobicContact CB-CD1 3.91Å; N252-T269 CarbonylContact C-O 3.47Å; N252-T269 WeakPolarHBondContact CA-O 3.28Å; N252-L270 HydrophobicContact CB-CD2 3.88Å
253	T	93.6	Very high	85.6	Confident	74 Å²	74	79.3 Å²	79.3	45%	0.454	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	141.4	176	57.2	0	0	0	0	110.3	T269	T253-T269 PolarHBondContact N-O 3.13Å; T253-T269 PolarHBondContact O-N 3.18Å; T253-T269 WeakPolarHBondContact OG1-CB 3.38Å
254	H	92.9	Very high	85.3	Confident	73 Å²	73	80.1 Å²	80.1	34%	0.338	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	119.7	-179	-64.7	-154.2	0	0	0	107.6	D242 W243 I266	D242-H254 IonicContact OD1-CE1 3.53Å; D242-H254 IonicContact OD1-ND1 3.04Å; D242-H254 PolarHBondContact OD1-ND1 3.28Å; W243-H254 PolarHBondContact O-CE1 3.46Å; W243-H254 VanDerWaalsContact O-CE1 3.31Å; H254-I266 HydrophobicContact CB-CG2 4.28Å
255	Q	91.1	Very high	85.3	Confident	115 Å²	115	76.5 Å²	76.5	54%	0.537	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.8	178.1	-176.9	177.9	-14.6	0	0	110.1	I266 N267	Q255-I266 WeakPolarHBondContact O-CA 3.2Å; Q255-N267 PolarHBondContact N-O 3.2Å; Q255-N267 PolarHBondContact O-N 2.03Å
256	T	86.4	Confident	85.5	Confident	81 Å²	81	75.9 Å²	75.9	50%	0.497	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.4	174.4	50.3	0	0	0	0	110.3	I266	T256-I266 HydrophobicContact CG2-CD1 3.71Å; T256-I266 HydrophobicContact CG2-CG1 3.9Å
257	N	77.3	Confident	85.7	Confident	41 Å²	41	71.2 Å²	71.2	22%	0.219	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	94.4	172.2	-72	-48.8	0	0	0	108.8	N259 A265 N267	N257-N259 PolarHBondContact O-N 3.49Å; N257-N259 VanDerWaalsContact O-N 3.1Å; N257-A265 HydrophobicContact CB-CB 4.32Å; N257-A265 PolarHBondContact N-O 3Å; N257-N267 VanDerWaalsContact ND2-CG 3.32Å; N257-N267 PolarHBondContact ND2-ND2 2.96Å; N257-N267 PolarHBondContact ND2-OD1 3.27Å
258	L	67.5	Low	86	Confident	126 Å²	126	68.8 Å²	68.8	66%	0.66	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	63.7	176	-66.4	167.3	0	0	0	110
259	N	61.3	Low	86.1	Confident	128 Å²	128	69.4 Å²	69.4	68%	0.684	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	-13.4	-178.8	-83	-9.9	0	0	0	113.7	N257	N257-N259 PolarHBondContact O-N 3.49Å; N257-N259 VanDerWaalsContact O-N 3.1Å
260	W	60.7	Low	86.2	Confident	160 Å²	160	63.8 Å²	63.8	61%	0.606	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	140.4	-174.1	-66.7	-56.5	0	0	0	112	N262 V263	W260-N262 PolarHBondContact O-N 3.11Å; W260-N262 VanDerWaalsContact O-N 3.13Å; W260-V263 HydrophobicContact CB-CB 4.01Å; W260-V263 HydrophobicContact CB-CG2 4.38Å; W260-V263 HydrophobicContact CE3-CB 4.13Å; W260-V263 HydrophobicContact CE3-CG1 4.2Å
261	T	69.4	Low	86.3	Confident	128 Å²	128	65.8 Å²	65.8	79%	0.785	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-18.8	-175.7	55.2	0	0	0	0	113.7
262	N	77.9	Confident	86.4	Confident	114 Å²	114	65.3 Å²	65.3	61%	0.61	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.5	10.8	-174.3	-58	-23.4	0	0	0	114	L238 W260	L238-N262 WeakPolarHBondContact CD1-O 3.28Å; W260-N262 PolarHBondContact O-N 3.11Å; W260-N262 VanDerWaalsContact O-N 3.13Å
263	V	87.6	Confident	86.6	Confident	36 Å²	36	63 Å²	63	22%	0.218	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	124.8	-179.6	-176.9	0	0	0	0	109	N232 G233 W260	N232-V263 HydrophobicContact CB-CG1 3.96Å; G233-V263 WeakPolarHBondContact O-CA 3.48Å; W260-V263 HydrophobicContact CB-CB 4.01Å; W260-V263 HydrophobicContact CB-CG2 4.38Å; W260-V263 HydrophobicContact CE3-CB 4.13Å; W260-V263 HydrophobicContact CE3-CG1 4.2Å
264	H	90.9	Very high	86.7	Confident	20 Å²	20	61 Å²	61	9%	0.093	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	114	171.4	-172.3	177.1	0	0	0	108.1	G233 L238 P239 D240 V241	G233-H264 PolarHBondContact N-O 2.89Å; G233-H264 PolarHBondContact O-N 3.27Å; L238-H264 HydrophobicContact CD1-CB 4.38Å; P239-H264 WeakPolarHBondContact O-CB 3.45Å; P239-H264 PolarHBondContact O-ND1 3.29Å; P239-H264 VanDerWaalsContact O-ND1 3.16Å; D240-H264 IonicContact OD1-CE1 3.36Å; D240-H264 PolarHBondContact OD1-CE1 3.09Å; D240-H264 IonicContact OD1-ND1 3.28Å; V241-H264 HydrophobicContact CG2-CB 3.91Å
265	A	92.4	Very high	86.9	Confident	3 Å²	3	58.1 Å²	58.1	3%	0.025	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.3	179.6	0	0	0	0	0	111.3	T230 C231 N232 N257	T230-A265 HydrophobicContact CG2-CB 4.47Å; C231-A265 CarbonylContact O-C 3.56Å; C231-A265 VanDerWaalsContact O-CA 3.31Å; C231-A265 WeakPolarHBondContact O-CA 2.97Å; N232-A265 WeakPolarHBondContact OD1-CB 3.48Å; N257-A265 HydrophobicContact CB-CB 4.32Å; N257-A265 PolarHBondContact N-O 3Å
266	I	94.4	Very high	87	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.7	172.5	-60	-160.8	0	0	0	110.6	C231 V241 W243 H254 Q255 T256	C231-I266 PolarHBondContact N-O 2.98Å; C231-I266 PolarHBondContact O-N 3.01Å; V241-I266 HydrophobicContact CB-CD1 4.35Å; V241-I266 HydrophobicContact CB-CG1 4.26Å; V241-I266 HydrophobicContact CG1-CB 4.41Å; V241-I266 HydrophobicContact CG1-CG1 4.23Å; V241-I266 WeakPolarHBondContact O-CD1 3.03Å; W243-I266 PolarHBondContact NE1-O 3.09Å; H254-I266 HydrophobicContact CB-CG2 4.28Å; Q255-I266 WeakPolarHBondContact O-CA 3.2Å; T256-I266 HydrophobicContact CG2-CD1 3.71Å; T256-I266 HydrophobicContact CG2-CG1 3.9Å
267	N	94.8	Very high	87.5	Confident	31 Å²	31	55.9 Å²	55.9	17%	0.166	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.3	170.6	-67.2	-0.2	0	0	0	109.7	V228 I229 T230 Q255 N257	V228-N267 HydrophobicContact CG1-CB 4.3Å; I229-N267 CarbonylContact O-C 3.58Å; I229-N267 WeakPolarHBondContact O-CA 3.17Å; T230-N267 WeakPolarHBondContact CB-OD1 3.24Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.17Å; T230-N267 PolarHBondContact OG1-OD1 3.48Å; Q255-N267 PolarHBondContact N-O 3.2Å; Q255-N267 PolarHBondContact O-N 2.03Å; N257-N267 VanDerWaalsContact ND2-CG 3.32Å; N257-N267 PolarHBondContact ND2-ND2 2.96Å; N257-N267 PolarHBondContact ND2-OD1 3.27Å
268	L	96.4	Very high	88.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	117.8	165.6	175.7	66.7	0	0	0	108.5	V228 I229 W243 V245 N252 L270 L282	V228-L268 WeakPolarHBondContact CA-O 3.36Å; I229-L268 HydrophobicContact CG2-CB 3.8Å; I229-L268 HydrophobicContact CG2-CD2 4.04Å; I229-L268 HydrophobicContact CG2-CG 4.24Å; I229-L268 PolarHBondContact N-O 2.91Å; I229-L268 PolarHBondContact O-N 3.43Å; W243-L268 HydrophobicContact CB-CD2 4.3Å; W243-L268 HydrophobicContact CD2-CB 4.02Å; W243-L268 HydrophobicContact CD2-CD2 3.92Å; W243-L268 HydrophobicContact CE3-CD2 4.07Å; W243-L268 HydrophobicContact CG-CB 3.88Å; W243-L268 HydrophobicContact CG-CD2 4.06Å; W243-L268 HydrophobicContact CG-CG 4.42Å; V245-L268 HydrophobicContact CG1-CD1 4.05Å; V245-L268 HydrophobicContact CG1-CD2 3.79Å; N252-L268 HydrophobicContact CB-CD1 3.91Å; L268-L270 HydrophobicContact CD1-CD2 4.3Å; L268-L270 HydrophobicContact CD2-CD2 4.17Å; L268-L270 HydrophobicContact CG-CD2 4.06Å; L268-L282 HydrophobicContact CD2-CD1 4.36Å; L268-L282 HydrophobicContact CD2-CD2 4.02Å
269	T	96.3	Very high	89.6	Confident	30 Å²	30	52.5 Å²	52.5	18%	0.184	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.4	173.2	-55.1	0	0	0	0	109.1	A227 V228 N252 T253 V271	A227-T269 CarbonylContact O-C 3.54Å; A227-T269 WeakPolarHBondContact O-CA 3.39Å; V228-T269 HydrophobicContact CG2-CG2 3.93Å; N252-T269 CarbonylContact C-O 3.47Å; N252-T269 WeakPolarHBondContact CA-O 3.28Å; T253-T269 PolarHBondContact N-O 3.13Å; T253-T269 PolarHBondContact O-N 3.18Å; T253-T269 WeakPolarHBondContact OG1-CB 3.38Å; T269-V271 HydrophobicContact CG2-CG2 4.04Å
270	L	97.3	Very high	91.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.6	170.6	-54.3	-176.6	0	0	0	109.1	L219 N226 A227 L248 N252 L268 V273 L282 L299	L219-L270 HydrophobicContact CD2-CD1 4.45Å; N226-L270 CarbonylContact C-O 3.58Å; N226-L270 VanDerWaalsContact CA-O 3.22Å; N226-L270 WeakPolarHBondContact CA-O 3.25Å; N226-L270 WeakPolarHBondContact CB-O 3.49Å; A227-L270 PolarHBondContact N-O 3.48Å; A227-L270 PolarHBondContact O-N 3.44Å; L248-L270 HydrophobicContact CD2-CD2 3.58Å; N252-L270 HydrophobicContact CB-CD2 3.88Å; L268-L270 HydrophobicContact CD1-CD2 4.3Å; L268-L270 HydrophobicContact CD2-CD2 4.17Å; L268-L270 HydrophobicContact CG-CD2 4.06Å; L270-V273 HydrophobicContact CB-CG2 3.66Å; L270-V273 HydrophobicContact CD1-CG2 4.32Å; L270-L282 HydrophobicContact CD1-CD1 4.22Å; L270-L299 HydrophobicContact CD1-CD1 4.39Å; L270-L299 HydrophobicContact CD1-CD2 4.05Å
271	V	96.4	Very high	92.9	Very high	47 Å²	47	44.5 Å²	44.5	29%	0.285	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.2	-176.9	-178.3	0	0	0	0	109.7	N226 I251 T269	N226-V271 WeakPolarHBondContact OD1-CA 3.39Å; I251-V271 HydrophobicContact CB-CB 4.35Å; I251-V271 HydrophobicContact CG2-CB 4.45Å; I251-V271 PolarHBondContact O-N 3.2Å; T269-V271 HydrophobicContact CG2-CG2 4.04Å
272	N	96	Very high	94.2	Very high	105 Å²	105	38.4 Å²	38.4	56%	0.561	22%	0.22	S	C	*	.	S	Bend	trans	51.2	61.4	179.9	-172.3	43.4	0	0	0	111.5	G224 N226 T274	G224-N272 WeakPolarHBondContact CA-OD1 3.37Å; N226-N272 PolarHBondContact OD1-N 3.35Å; N272-T274 PolarHBondContact O-N 2.95Å
273	V	97.8	Very high	95.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	20%	0.199	C	C	.	.			trans	-60.4	131.4	-170.7	174.6	0	0	0	0	111.4	V221 E223 G224 D225 S250 L270 V301	V221-V273 HydrophobicContact CG1-CB 4.26Å; V221-V273 HydrophobicContact CG1-CG2 4.08Å; E223-V273 CarbonylContact C-O 3.57Å; E223-V273 WeakPolarHBondContact CA-O 3.49Å; G224-V273 PolarHBondContact N-O 3.09Å; D225-V273 WeakPolarHBondContact O-CG2 3.45Å; D225-V273 PolarHBondContact O-N 3.37Å; S250-V273 WeakPolarHBondContact OG-CA 3.42Å; L270-V273 HydrophobicContact CB-CG2 3.66Å; L270-V273 HydrophobicContact CD1-CG2 4.32Å; V273-V301 HydrophobicContact CG1-CB 4.44Å; V273-V301 HydrophobicContact CG1-CG1 3.96Å; V273-V301 HydrophobicContact CG1-CG2 3.57Å
274	T	96.7	Very high	95.5	Very high	33 Å²	33	32.6 Å²	32.6	20%	0.202	19%	0.189	C	C	.	.			trans	-92.5	148.8	178.7	175.6	0	0	0	0	112.4	Q249 S250 N272 E276 D277	Q249-T274 HydrophobicContact CB-CG2 3.65Å; S250-T274 PolarHBondContact OG-N 3.04Å; S250-T274 VanDerWaalsContact OG-N 3.11Å; N272-T274 PolarHBondContact O-N 2.95Å; T274-E276 HydrophobicContact CG2-CB 4.07Å; T274-E276 PolarHBondContact O-N 2.87Å; T274-E276 PolarHBondContact OG1-N 3.29Å; T274-D277 WeakPolarHBondContact CG2-OD2 3.22Å; T274-D277 PolarHBondContact O-N 3.44Å
275	S	95.7	Very high	95.8	Very high	13 Å²	13	32.6 Å²	32.6	9%	0.091	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-60	-22.1	172.1	59.1	0	0	0	0	113.5	E223 D277 N278	E223-S275 PolarHBondContact OE1-OG 3.49Å; S275-D277 PolarHBondContact O-N 3.5Å; S275-N278 VanDerWaalsContact O-CB 3.24Å; S275-N278 WeakPolarHBondContact O-CB 3.44Å; S275-N278 PolarHBondContact O-N 3.17Å; S275-N278 VanDerWaalsContact O-N 3.13Å
276	E	95	Very high	96	Very high	145 Å²	145	32.5 Å²	32.5	68%	0.678	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-65.9	-21.1	178.4	-64.5	-179.3	-179.1	0	0	113.1	Q249 T274 N278	Q249-E276 HydrophobicContact CB-CB 4.49Å; Q249-E276 HydrophobicContact CG-CB 4.17Å; T274-E276 HydrophobicContact CG2-CB 4.07Å; T274-E276 PolarHBondContact O-N 2.87Å; T274-E276 PolarHBondContact OG1-N 3.29Å; E276-N278 VanDerWaalsContact C-N 3.31Å
277	D	96.3	Very high	96.1	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.016	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-89.3	6.7	176	-65.7	-35.1	0	0	0	112.9	L248 Q249 S250 T274 S275 G279 F280 L299	L248-D277 HydrophobicContact CD1-CB 3.86Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.37Å; Q249-D277 PolarHBondContact N-OD1 3.08Å; Q249-D277 PolarHBondContact N-OD2 2.98Å; S250-D277 WeakPolarHBondContact CA-OD2 3.4Å; S250-D277 WeakPolarHBondContact CB-OD2 3.38Å; S250-D277 PolarHBondContact N-OD2 3.19Å; S250-D277 PolarHBondContact OG-OD2 3.18Å; T274-D277 WeakPolarHBondContact CG2-OD2 3.22Å; T274-D277 PolarHBondContact O-N 3.44Å; S275-D277 PolarHBondContact O-N 3.5Å; D277-G279 PolarHBondContact O-N 3.21Å; D277-F280 HydrophobicContact CB-CB 4.38Å; D277-F280 WeakPolarHBondContact O-CB 3.32Å; D277-F280 PolarHBondContact O-N 2.99Å; D277-L299 HydrophobicContact CB-CD2 3.94Å
278	N	95.5	Very high	96.2	Very high	41 Å²	41	33.2 Å²	33.2	22%	0.219	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	128.6	176.5	-174.7	47.5	0	0	0	111.1	S275 E276 F280 V301 Y303 N328 E357	S275-N278 VanDerWaalsContact O-CB 3.24Å; S275-N278 WeakPolarHBondContact O-CB 3.44Å; S275-N278 PolarHBondContact O-N 3.17Å; S275-N278 VanDerWaalsContact O-N 3.13Å; E276-N278 VanDerWaalsContact C-N 3.31Å; N278-F280 VanDerWaalsContact C-N 3.25Å; N278-F280 PolarHBondContact O-N 3.03Å; N278-V301 HydrophobicContact CB-CB 4.07Å; N278-V301 HydrophobicContact CB-CG2 4.45Å; N278-V301 PolarHBondContact OD1-N 3.24Å; N278-V301 PolarHBondContact OD1-O 2.97Å; N278-Y303 HydrophobicContact CB-CE1 4.44Å; N278-N328 PolarHBondContact ND2-ND2 3.26Å; N278-N328 PolarHBondContact OD1-ND2 2.81Å; N278-E357 PolarHBondContact ND2-OE2 3.14Å
279	G	93.4	Very high	96.2	Very high	55 Å²	55	35.4 Å²	35.4	57%	0.567	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	1.5	-175.3	0	0	0	0	0	114.1	D277 L299	D277-G279 PolarHBondContact O-N 3.21Å; G279-L299 WeakPolarHBondContact CA-O 3.13Å; G279-L299 PolarHBondContact N-O 3.31Å
280	F	95.6	Very high	96.3	Very high	48 Å²	48	34.1 Å²	34.1	21%	0.211	20%	0.196	C	C	.	.			trans	-63.7	141.1	175.5	-164.6	-85.7	0	0	0	110.7	L248 D277 N278 L282 L299	L248-F280 HydrophobicContact CB-CE1 4.31Å; L248-F280 HydrophobicContact CB-CE2 4.33Å; L248-F280 HydrophobicContact CB-CZ 4.07Å; L248-F280 HydrophobicContact CD1-CB 4.26Å; L248-F280 HydrophobicContact CD1-CD1 3.64Å; L248-F280 HydrophobicContact CD1-CD2 4.14Å; L248-F280 HydrophobicContact CD1-CE1 3.96Å; L248-F280 HydrophobicContact CD1-CE2 4.42Å; L248-F280 HydrophobicContact CD1-CG 3.74Å; L248-F280 HydrophobicContact CD1-CZ 4.34Å; D277-F280 HydrophobicContact CB-CB 4.38Å; D277-F280 WeakPolarHBondContact O-CB 3.32Å; D277-F280 PolarHBondContact O-N 2.99Å; N278-F280 VanDerWaalsContact C-N 3.25Å; N278-F280 PolarHBondContact O-N 3.03Å; F280-L282 HydrophobicContact CD1-CD2 3.87Å; F280-L282 HydrophobicContact CD1-CG 4.39Å; F280-L282 HydrophobicContact CE1-CD2 4.1Å; F280-L299 WeakPolarHBondContact O-CB 3.12Å; F280-L299 PolarHBondContact O-N 3.49Å
281	T	95.9	Very high	96.2	Very high	72 Å²	72	34.4 Å²	34.4	44%	0.442	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	102.4	177.6	-59.6	0	0	0	0	109.7	T283	T281-T283 PolarHBondContact O-N 3.1Å; T281-T283 PolarHBondContact O-OG1 3.07Å
282	L	96.3	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	118.2	175.7	-59.8	170.9	0	0	0	108.5	L219 I229 W243 V245 L248 L268 L270 F280 S296 V297 L299	L219-L282 HydrophobicContact CD2-CD1 4.16Å; I229-L282 HydrophobicContact CG2-CD1 4.43Å; W243-L282 HydrophobicContact CE3-CB 4.27Å; W243-L282 HydrophobicContact CZ3-CB 3.91Å; V245-L282 HydrophobicContact CG1-CD2 4.39Å; L248-L282 HydrophobicContact CD1-CD2 4.17Å; L248-L282 HydrophobicContact CD2-CD2 4.27Å; L268-L282 HydrophobicContact CD2-CD1 4.36Å; L268-L282 HydrophobicContact CD2-CD2 4.02Å; L270-L282 HydrophobicContact CD1-CD1 4.22Å; F280-L282 HydrophobicContact CD1-CD2 3.87Å; F280-L282 HydrophobicContact CD1-CG 4.39Å; F280-L282 HydrophobicContact CE1-CD2 4.1Å; L282-S296 CarbonylContact O-C 3.6Å; L282-S296 WeakPolarHBondContact O-CA 3.4Å; L282-V297 HydrophobicContact CB-CB 4.34Å; L282-V297 PolarHBondContact N-O 3.45Å; L282-V297 PolarHBondContact O-N 2.9Å; L282-L299 HydrophobicContact CD1-CB 4.38Å; L282-L299 HydrophobicContact CG-CB 4.42Å
283	T	96.5	Very high	96.2	Very high	28 Å²	28	32.3 Å²	32.3	17%	0.172	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.5	-176.8	-59.3	0	0	0	0	110	I244 T281 I285 N294 A295 S296	I244-T283 PolarHBondContact N-O 3.05Å; T281-T283 PolarHBondContact O-N 3.1Å; T281-T283 PolarHBondContact O-OG1 3.07Å; T283-I285 HydrophobicContact CG2-CG2 4.47Å; T283-N294 HydrophobicContact CG2-CB 4.29Å; T283-A295 CarbonylContact C-O 3.23Å; T283-A295 WeakPolarHBondContact CA-O 3.39Å; T283-S296 PolarHBondContact OG1-OG 3.01Å
284	C	96.8	Very high	96.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.7	168.8	-176	0	0	0	0	109.8	I212 V214 C231 V241 D242 W243 N294 A295	I212-C284 HydrophobicContact CD1-CB 4.06Å; I212-C284 WeakPolarHBondContact CD1-O 3.25Å; V214-C284 HydrophobicContact CG1-CB 4.34Å; C231-C284 HydrophobicContact CB-CB 3.63Å; C231-C284 WeakPolarHBondContact CB-SG 3.38Å; C231-C284 WeakPolarHBondContact SG-CB 3.45Å; C231-C284 CovalentContact SG-SG 2.01Å; C231-C284 PolarHBondContact SG-SG 2.9Å; V241-C284 VanDerWaalsContact CG1-SG 3.58Å; D242-C284 CarbonylContact O-C 3.51Å; D242-C284 WeakPolarHBondContact O-CA 3.35Å; D242-C284 PolarHBondContact O-SG 2.73Å; W243-C284 HydrophobicContact CD2-CB 3.92Å; W243-C284 HydrophobicContact CE3-CB 3.71Å; W243-C284 HydrophobicContact CH2-CB 3.96Å; W243-C284 HydrophobicContact CZ2-CB 4.17Å; W243-C284 HydrophobicContact CZ3-CB 3.72Å; C284-N294 CarbonylContact O-C 3.42Å; C284-N294 VanDerWaalsContact O-CA 3.25Å; C284-N294 WeakPolarHBondContact O-CA 3.41Å; C284-A295 PolarHBondContact N-O 3.42Å; C284-A295 PolarHBondContact O-N 3.12Å
285	I	96.6	Very high	96.1	Very high	21 Å²	21	36.6 Å²	36.6	11%	0.108	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.1	174.1	61.6	178.1	0	0	0	110.1	V241 D242 I244 T283 E287 M292 S293 N294	V241-I285 VanDerWaalsContact CA-O 3.28Å; V241-I285 WeakPolarHBondContact CA-O 2.93Å; D242-I285 HydrophobicContact CB-CG1 4.24Å; D242-I285 PolarHBondContact N-O 2.91Å; D242-I285 PolarHBondContact O-N 2.92Å; I244-I285 HydrophobicContact CD1-CD1 4.1Å; I244-I285 HydrophobicContact CD1-CG2 3.52Å; I244-I285 HydrophobicContact CG1-CD1 4.09Å; I244-I285 HydrophobicContact CG1-CG1 4.42Å; I244-I285 HydrophobicContact CG1-CG2 4.06Å; T283-I285 HydrophobicContact CG2-CG2 4.47Å; I285-E287 WeakPolarHBondContact CD1-OE1 3.1Å; I285-M292 HydrophobicContact CG2-SD 4.4Å; I285-S293 WeakPolarHBondContact CA-O 3.46Å; I285-N294 HydrophobicContact CG2-CB 4.23Å
286	A	96.8	Very high	96.1	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.3	169.9	0	0	0	0	0	108.4	P210 I212 P239 D240 V241 M292 S293	P210-A286 HydrophobicContact CB-CB 4.07Å; P210-A286 HydrophobicContact CG-CB 4.47Å; P210-A286 WeakPolarHBondContact CG-O 3.08Å; I212-A286 HydrophobicContact CB-CB 4.24Å; I212-A286 HydrophobicContact CD1-CB 3.98Å; I212-A286 HydrophobicContact CG1-CB 4.32Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.36Å; D240-A286 CarbonylContact O-C 3.59Å; D240-A286 VanDerWaalsContact O-CA 3.27Å; D240-A286 WeakPolarHBondContact O-CA 3.34Å; V241-A286 HydrophobicContact CG2-CB 4.15Å; A286-M292 WeakPolarHBondContact O-CA 3.28Å; A286-S293 PolarHBondContact N-O 2.62Å; A286-S293 PolarHBondContact O-N 3.2Å
287	E	96.4	Very high	96.2	Very high	44 Å²	44	32.1 Å²	32.1	21%	0.206	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.9	-171.7	-66.3	-176.3	-164.8	0	0	111.7	W144 P239 D240 I285 M292	W144-E287 HydrophobicContact CH2-CG 4.31Å; W144-E287 HydrophobicContact CZ2-CB 4.47Å; W144-E287 HydrophobicContact CZ2-CG 4.49Å; P239-E287 CarbonylContact C-O 3.15Å; P239-E287 WeakPolarHBondContact CA-O 3.35Å; P239-E287 WeakPolarHBondContact CB-O 3.02Å; D240-E287 PolarHBondContact N-O 3.11Å; D240-E287 PolarHBondContact O-N 3.47Å; I285-E287 WeakPolarHBondContact CD1-OE1 3.1Å; E287-M292 VanDerWaalsContact CD-CE 3.49Å; E287-M292 HydrophobicContact CG-CB 4.13Å; E287-M292 HydrophobicContact CG-CE 3.82Å; E287-M292 HydrophobicContact CG-CG 3.84Å; E287-M292 WeakPolarHBondContact OE1-CE 3.37Å
288	N	96.6	Very high	96.1	Very high	10 Å²	10	34 Å²	34	5%	0.053	21%	0.213	C	C	.	.			trans	-135.9	-175.1	165.9	73	10.2	0	0	0	110.6	W144 D208 P237 P239 V290 G291	W144-N288 PolarHBondContact NE1-O 2.81Å; D208-N288 PolarHBondContact O-ND2 2.86Å; P237-N288 PolarHBondContact O-ND2 3.47Å; P239-N288 HydrophobicContact CB-CB 4.35Å; N288-V290 PolarHBondContact O-N 2.93Å; N288-V290 WeakPolarHBondContact OD1-CA 3.31Å; N288-V290 VanDerWaalsContact OD1-CB 3.28Å; N288-V290 WeakPolarHBondContact OD1-CB 3.36Å; N288-V290 PolarHBondContact OD1-N 2.91Å; N288-G291 PolarHBondContact N-O 2.91Å; N288-G291 PolarHBondContact O-N 2.91Å; N288-G291 PolarHBondContact OD1-N 3.47Å; N288-G291 VanDerWaalsContact OD1-N 3.07Å; N288-G291 PolarHBondContact OD1-O 3.4Å
289	V	96.8	Very high	96.2	Very high	46 Å²	46	32 Å²	32	28%	0.279	20%	0.202	S	C	.	.	S	Bend	trans	-65.2	-17.9	-179.3	-57.8	0	0	0	0	113.7	W144 C166 P237	W144-V289 VanDerWaalsContact CD1-O 3.29Å; C166-V289 HydrophobicContact CB-CG2 4.19Å; P237-V289 HydrophobicContact CG-CG2 3.89Å
290	V	97.4	Very high	96.4	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.018	19%	0.188	C	C	.	.	S	Bend	trans	-86.4	-34.3	179.5	-173.9	0	0	0	0	111.6	C166 R169 W170 L173 C207 L209 N288	C166-V290 WeakPolarHBondContact SG-CG2 3.46Å; R169-V290 HydrophobicContact CB-CG1 4.09Å; R169-V290 HydrophobicContact CB-CG2 4.12Å; R169-V290 HydrophobicContact CG-CB 4.48Å; R169-V290 HydrophobicContact CG-CG1 3.62Å; R169-V290 HydrophobicContact CG-CG2 4.13Å; W170-V290 WeakPolarHBondContact CB-O 3.16Å; L173-V290 HydrophobicContact CD1-CG1 3.56Å; C207-V290 VanDerWaalsContact SG-CG2 3.57Å; L209-V290 HydrophobicContact CD2-CG1 4.02Å; L209-V290 HydrophobicContact CG-CG1 4.1Å; N288-V290 PolarHBondContact O-N 2.93Å; N288-V290 WeakPolarHBondContact OD1-CA 3.31Å; N288-V290 VanDerWaalsContact OD1-CB 3.28Å; N288-V290 WeakPolarHBondContact OD1-CB 3.36Å; N288-V290 PolarHBondContact OD1-N 2.91Å
291	G	96.3	Very high	96.5	Very high	8 Å²	8	29.1 Å²	29.1	8%	0.082	18%	0.178	C	C	.	.			trans	169.8	-161.5	178.4	0	0	0	0	0	114	N288	N288-G291 PolarHBondContact N-O 2.91Å; N288-G291 PolarHBondContact O-N 2.91Å; N288-G291 PolarHBondContact OD1-N 3.47Å; N288-G291 VanDerWaalsContact OD1-N 3.07Å; N288-G291 PolarHBondContact OD1-O 3.4Å
292	M	96.4	Very high	96.6	Very high	74 Å²	74	30.2 Å²	30.2	37%	0.365	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.1	-178.8	179.9	-170.7	-63.6	0	0	110.1	W144 I285 A286 E287	W144-M292 HydrophobicContact CH2-CB 3.62Å; W144-M292 HydrophobicContact CH2-CE 3.62Å; W144-M292 HydrophobicContact CZ2-CB 4.12Å; W144-M292 HydrophobicContact CZ3-CB 4.22Å; W144-M292 HydrophobicContact CZ3-CE 3.99Å; I285-M292 HydrophobicContact CG2-SD 4.4Å; A286-M292 WeakPolarHBondContact O-CA 3.28Å; E287-M292 VanDerWaalsContact CD-CE 3.49Å; E287-M292 HydrophobicContact CG-CB 4.13Å; E287-M292 HydrophobicContact CG-CE 3.82Å; E287-M292 HydrophobicContact CG-CG 3.84Å; E287-M292 WeakPolarHBondContact OE1-CE 3.37Å
293	S	95.9	Very high	96.7	Very high	34 Å²	34	30.4 Å²	30.4	24%	0.238	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.6	166.9	-63.5	0	0	0	0	109.6	P210 I285 A286	P210-S293 VanDerWaalsContact O-CB 3.24Å; P210-S293 WeakPolarHBondContact O-CB 3.01Å; P210-S293 PolarHBondContact O-OG 2.95Å; I285-S293 WeakPolarHBondContact CA-O 3.46Å; A286-S293 PolarHBondContact N-O 2.62Å; A286-S293 PolarHBondContact O-N 3.2Å
294	N	95.9	Very high	96.7	Very high	107 Å²	107	31 Å²	31	57%	0.572	18%	0.179	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.3	179.9	61.8	13.1	0	0	0	112	T283 C284 I285	T283-N294 HydrophobicContact CG2-CB 4.29Å; C284-N294 CarbonylContact O-C 3.42Å; C284-N294 VanDerWaalsContact O-CA 3.25Å; C284-N294 WeakPolarHBondContact O-CA 3.41Å; I285-N294 HydrophobicContact CG2-CB 4.23Å
295	A	96.3	Very high	96.8	Very high	17 Å²	17	31.3 Å²	31.3	14%	0.14	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.8	173.2	0	0	0	0	0	108.7	I212 V214 T283 C284	I212-A295 HydrophobicContact CD1-CB 3.96Å; I212-A295 HydrophobicContact CG1-CB 3.97Å; I212-A295 HydrophobicContact CG2-CB 4.07Å; V214-A295 HydrophobicContact CG1-CB 3.74Å; V214-A295 HydrophobicContact CG2-CB 4.31Å; T283-A295 CarbonylContact C-O 3.23Å; T283-A295 WeakPolarHBondContact CA-O 3.39Å; C284-A295 PolarHBondContact N-O 3.42Å; C284-A295 PolarHBondContact O-N 3.12Å
296	S	95.5	Very high	96.8	Very high	63 Å²	63	35.6 Å²	35.6	44%	0.441	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.5	-175.4	-64.3	0	0	0	0	111.1	L282 T283	L282-S296 CarbonylContact O-C 3.6Å; L282-S296 WeakPolarHBondContact O-CA 3.4Å; T283-S296 PolarHBondContact OG1-OG 3.01Å
297	V	96.4	Very high	96.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	121.5	180	-175.2	0	0	0	0	108.8	V214 H216 V217 L219 I229 W243 L282 L299	V214-V297 HydrophobicContact CB-CG2 4.05Å; V214-V297 HydrophobicContact CG1-CG2 4.18Å; V214-V297 HydrophobicContact CG2-CG2 3.87Å; H216-V297 HydrophobicContact CB-CG1 4.48Å; H216-V297 WeakPolarHBondContact O-CG2 3.48Å; V217-V297 WeakPolarHBondContact O-CA 3.13Å; V217-V297 WeakPolarHBondContact O-CG1 3.27Å; L219-V297 HydrophobicContact CB-CG1 4.01Å; I229-V297 HydrophobicContact CD1-CB 3.85Å; I229-V297 HydrophobicContact CD1-CG1 3.55Å; I229-V297 HydrophobicContact CD1-CG2 3.61Å; W243-V297 HydrophobicContact CH2-CG2 4.33Å; L282-V297 HydrophobicContact CB-CB 4.34Å; L282-V297 PolarHBondContact N-O 3.45Å; L282-V297 PolarHBondContact O-N 2.9Å; V297-L299 PolarHBondContact O-N 2.95Å
298	A	95.6	Very high	96.9	Very high	43 Å²	43	38.9 Å²	38.9	36%	0.355	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	120.5	177.1	0	0	0	0	0	110.2	V217 L219	V217-A298 PolarHBondContact O-N 2.93Å; L219-A298 PolarHBondContact N-O 3.41Å
299	L	96.9	Very high	96.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.4	174.1	178.3	62.9	0	0	0	109.9	L219 V221 L248 L270 D277 G279 F280 L282 V297 V301	L219-L299 HydrophobicContact CB-CD1 4.33Å; L219-L299 HydrophobicContact CD2-CD1 4.02Å; L219-L299 HydrophobicContact CG-CD1 4.05Å; L219-L299 CarbonylContact O-C 3.57Å; L219-L299 WeakPolarHBondContact O-CA 3.41Å; V221-L299 HydrophobicContact CG2-CD1 3.89Å; L248-L299 HydrophobicContact CD1-CD2 4.39Å; L270-L299 HydrophobicContact CD1-CD1 4.39Å; L270-L299 HydrophobicContact CD1-CD2 4.05Å; D277-L299 HydrophobicContact CB-CD2 3.94Å; G279-L299 WeakPolarHBondContact CA-O 3.13Å; G279-L299 PolarHBondContact N-O 3.31Å; F280-L299 WeakPolarHBondContact O-CB 3.12Å; F280-L299 PolarHBondContact O-N 3.49Å; L282-L299 HydrophobicContact CD1-CB 4.38Å; L282-L299 HydrophobicContact CG-CB 4.42Å; V297-L299 PolarHBondContact O-N 2.95Å; L299-V301 HydrophobicContact CD1-CG2 4.34Å; L299-V301 HydrophobicContact CD2-CG2 4.23Å; L299-V301 HydrophobicContact CG-CG2 3.99Å
300	T	96.9	Very high	96.9	Very high	42 Å²	42	38.1 Å²	38.1	26%	0.258	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	120.8	172.5	-59.7	0	0	0	0	108.7	L219 T220 V221 Y302	L219-T300 PolarHBondContact O-N 2.94Å; T220-T300 CarbonylContact C-O 3.59Å; T220-T300 WeakPolarHBondContact CA-O 3.44Å; V221-T300 PolarHBondContact N-O 2.99Å; T300-Y302 HydrophobicContact CG2-CD1 4.05Å; T300-Y302 HydrophobicContact CG2-CE1 3.64Å
301	V	97.9	Very high	96.9	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.6	179.3	-172.2	0	0	0	0	109.5	V221 E223 V273 N278 L299 Y303 N328	V221-V301 CarbonylContact O-C 3.56Å; V221-V301 VanDerWaalsContact O-CA 3.27Å; V221-V301 WeakPolarHBondContact O-CA 3.3Å; E223-V301 HydrophobicContact CB-CG1 4.12Å; V273-V301 HydrophobicContact CG1-CB 4.44Å; V273-V301 HydrophobicContact CG1-CG1 3.96Å; V273-V301 HydrophobicContact CG1-CG2 3.57Å; N278-V301 HydrophobicContact CB-CB 4.07Å; N278-V301 HydrophobicContact CB-CG2 4.45Å; N278-V301 PolarHBondContact OD1-N 3.24Å; N278-V301 PolarHBondContact OD1-O 2.97Å; L299-V301 HydrophobicContact CD1-CG2 4.34Å; L299-V301 HydrophobicContact CD2-CG2 4.23Å; L299-V301 HydrophobicContact CG-CG2 3.99Å; V301-Y303 WeakPolarHBondContact O-CD1 3.43Å; V301-N328 PolarHBondContact O-ND2 3.22Å
302	Y	97.9	Very high	96.8	Very high	94 Å²	94	49.3 Å²	49.3	37%	0.369	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.4	174.9	-66.8	-31.6	0	0	0	111.7	V221 R222 E223 T300 N328 P329 L384	V221-Y302 PolarHBondContact O-N 2.97Å; R222-Y302 CarbonylContact C-O 3.57Å; R222-Y302 WeakPolarHBondContact CA-O 3.23Å; E223-Y302 PolarHBondContact N-O 3.36Å; T300-Y302 HydrophobicContact CG2-CD1 4.05Å; T300-Y302 HydrophobicContact CG2-CE1 3.64Å; Y302-N328 CarbonylContact C-O 3.5Å; Y302-N328 WeakPolarHBondContact CA-O 3.23Å; Y302-N328 HydrophobicContact CD1-CB 4.4Å; Y302-N328 WeakPolarHBondContact CD1-ND2 3.38Å; Y302-P329 HydrophobicContact CD1-CG 4.2Å; Y302-P329 HydrophobicContact CE1-CG 4.1Å; Y302-L384 VanDerWaalsContact C-CD1 3.4Å
303	Y	98	Very high	96.7	Very high	4 Å²	4	47 Å²	47	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.7	-177.9	59.6	-88	0	0	0	112	E223 N278 V301 R326 N328 E357 N382 L384	E223-Y303 WeakPolarHBondContact OE2-CB 3.5Å; N278-Y303 HydrophobicContact CB-CE1 4.44Å; V301-Y303 WeakPolarHBondContact O-CD1 3.43Å; Y303-R326 HydrophobicContact CE2-CB 4.39Å; Y303-N328 HydrophobicContact CD1-CB 3.86Å; Y303-N328 HydrophobicContact CE1-CB 3.53Å; Y303-N328 PolarHBondContact N-O 2.92Å; Y303-N328 PolarHBondContact O-N 3.15Å; Y303-E357 WeakPolarHBondContact CE1-OE2 3.44Å; Y303-E357 WeakPolarHBondContact OH-CB 3.11Å; Y303-E357 PolarHBondContact OH-OE1 2.97Å; Y303-E357 PolarHBondContact OH-OE2 3.35Å; Y303-N382 PolarHBondContact O-ND2 3.46Å; Y303-L384 VanDerWaalsContact N-CD1 3.33Å
304	P	97.8	Very high	96.6	Very high	41 Å²	41	50.2 Å²	50.2	27%	0.266	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	158.8	177.6	29.7	-36.4	0	0	0	111.7	L384	P304-L384 HydrophobicContact CB-CB 4.23Å
305	P	97.8	Very high	96.3	Very high	6 Å²	6	50.5 Å²	50.5	4%	0.039	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	151.9	-179.3	27.8	-34	0	0	0	111.9	V325 R326 P331 A380 N382 A387	P305-V325 HydrophobicContact CB-CG1 4.39Å; P305-R326 CarbonylContact C-O 3.58Å; P305-R326 WeakPolarHBondContact CA-O 3.27Å; P305-P331 HydrophobicContact CB-CB 3.87Å; P305-P331 HydrophobicContact CB-CG 4.11Å; P305-P331 HydrophobicContact CG-CB 4.44Å; P305-A380 HydrophobicContact CB-CB 3.81Å; P305-A380 HydrophobicContact CG-CB 4.26Å; P305-A380 VanDerWaalsContact CG-O 3.25Å; P305-A380 WeakPolarHBondContact CG-O 3.37Å; P305-N382 VanDerWaalsContact CD-OD1 3.27Å; P305-N382 WeakPolarHBondContact CD-OD1 3.35Å; P305-A387 HydrophobicContact CB-CB 4.39Å; P305-A387 HydrophobicContact CG-CB 4.27Å; P305-A387 WeakPolarHBondContact O-CB 3.19Å
306	R	97.2	Very high	95.9	Very high	112 Å²	112	56.1 Å²	56.1	42%	0.423	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	129.4	174.7	-61	179.3	-176.2	170.7	2.3	108.4	E223 V308 V325 R326	E223-R306 IonicContact OE1-CZ 3.54Å; E223-R306 IonicContact OE1-NH1 3.65Å; E223-R306 IonicContact OE1-NH2 2.67Å; E223-R306 PolarHBondContact OE1-NH2 2.9Å; E223-R306 IonicContact OE2-CZ 3.81Å; E223-R306 IonicContact OE2-NH2 2.76Å; E223-R306 PolarHBondContact OE2-NH2 3.14Å; R306-V308 PolarHBondContact O-N 2.94Å; R306-V325 WeakPolarHBondContact O-CA 3.36Å; R306-R326 PolarHBondContact N-O 3.14Å; R306-R326 PolarHBondContact O-N 3.19Å
307	V	97.5	Very high	95.6	Very high	26 Å²	26	61.7 Å²	61.7	16%	0.158	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	112.1	170.8	-170.7	0	0	0	0	106.9	S309 L310 V325 L378 A387 Q389	V307-S309 WeakPolarHBondContact CG1-O 3.24Å; V307-L310 HydrophobicContact CG1-CB 4.24Å; V307-V325 HydrophobicContact CG1-CG2 4.4Å; V307-V325 HydrophobicContact CG2-CG2 4.31Å; V307-L378 HydrophobicContact CG1-CD2 4.27Å; V307-A387 HydrophobicContact CG2-CB 4.33Å; V307-Q389 HydrophobicContact CB-CB 4.1Å; V307-Q389 HydrophobicContact CG1-CB 4.03Å; V307-Q389 HydrophobicContact CG2-CB 4.16Å
308	V	96.8	Very high	95.5	Very high	86 Å²	86	63.8 Å²	63.8	52%	0.521	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-43.8	-177	178.7	0	0	0	0	110.2	R306 V324 R326	R306-V308 PolarHBondContact O-N 2.94Å; V308-V324 WeakPolarHBondContact CA-O 3.46Å; V308-V324 HydrophobicContact CB-CB 4.27Å; V308-V324 HydrophobicContact CB-CG1 4.13Å; V308-V324 WeakPolarHBondContact CB-O 3.29Å; V308-V324 PolarHBondContact N-O 3.46Å; V308-R326 HydrophobicContact CG2-CB 4.1Å; V308-R326 HydrophobicContact CG2-CG 3.75Å
309	S	97.1	Very high	95.5	Very high	26 Å²	26	63.6 Å²	63.6	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	147.7	173.5	71.1	0	0	0	0	111.1	V307 F323 V324	V307-S309 WeakPolarHBondContact CG1-O 3.24Å; S309-F323 VanDerWaalsContact O-CA 3.3Å; S309-F323 WeakPolarHBondContact O-CA 3.15Å; S309-V324 PolarHBondContact N-O 3.14Å; S309-V324 VanDerWaalsContact N-O 3.17Å; S309-V324 PolarHBondContact O-N 3.21Å; S309-V324 WeakPolarHBondContact OG-CB 3.33Å; S309-V324 VanDerWaalsContact OG-CG2 3.31Å; S309-V324 WeakPolarHBondContact OG-CG2 3.26Å; S309-V324 PolarHBondContact OG-N 2.77Å
310	L	97.7	Very high	95.4	Very high	14 Å²	14	63.7 Å²	63.7	7%	0.073	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	105.6	168.8	-178.3	65.9	0	0	0	106.6	V307 I321 E322 F323 W335 Q389 I391	V307-L310 HydrophobicContact CG1-CB 4.24Å; L310-I321 HydrophobicContact CD1-CG2 3.68Å; L310-E322 WeakPolarHBondContact CA-O 3.44Å; L310-F323 HydrophobicContact CD1-CB 4.02Å; L310-W335 HydrophobicContact CD1-CH2 3.58Å; L310-W335 HydrophobicContact CD1-CZ3 4.15Å; L310-Q389 HydrophobicContact CB-CG 4.3Å; L310-Q389 HydrophobicContact CD2-CB 3.86Å; L310-Q389 HydrophobicContact CD2-CG 3.84Å; L310-Q389 WeakPolarHBondContact CD2-O 3.5Å; L310-I391 HydrophobicContact CD1-CG2 4.2Å; L310-I391 HydrophobicContact CD2-CB 3.85Å; L310-I391 HydrophobicContact CD2-CG2 3.82Å; L310-I391 HydrophobicContact CG-CB 4.01Å; L310-I391 HydrophobicContact CG-CD1 4.45Å; L310-I391 HydrophobicContact CG-CG2 3.82Å; L310-I391 VanDerWaalsContact O-CD1 3.22Å; L310-I391 WeakPolarHBondContact O-CD1 3.45Å
311	E	96.5	Very high	95.5	Very high	93 Å²	93	61.7 Å²	61.7	44%	0.435	30%	0.299	S	S	.	.			trans	-101.8	155.1	-167.7	-59.4	-168.3	175.5	0	0	112.9	I321 E322 I391	E311-I321 WeakPolarHBondContact O-CG2 3.45Å; E311-E322 HydrophobicContact CB-CB 4.33Å; E311-E322 PolarHBondContact N-O 3.36Å; E311-I391 WeakPolarHBondContact O-CD1 3.5Å
312	E	94.8	Very high	95.4	Very high	153 Å²	153	64.2 Å²	64.2	72%	0.715	31%	0.311	S	S	*	.			trans	-61.4	149.8	175.5	-71	-172.7	175.8	0	0	110.4	E314 I391	E312-E314 PolarHBondContact O-N 2.8Å; E312-I391 HydrophobicContact CG-CD1 3.98Å; E312-I391 HydrophobicContact CG-CG1 4.38Å
313	P	94.2	Very high	95.4	Very high	25 Å²	25	59.7 Å²	59.7	16%	0.162	29%	0.293	C	S	.	.			trans	-60.9	114.7	-177	24	-34.1	0	0	0	111.9	C320 I321 F395	P313-C320 WeakPolarHBondContact CA-O 3.36Å; P313-I321 HydrophobicContact CB-CG1 3.84Å; P313-I321 HydrophobicContact CG-CG1 4.47Å; P313-F395 HydrophobicContact CB-CD1 4.15Å; P313-F395 HydrophobicContact CB-CE1 3.51Å; P313-F395 HydrophobicContact CB-CZ 4.09Å; P313-F395 HydrophobicContact CG-CD1 4.44Å; P313-F395 HydrophobicContact CG-CE1 4.05Å; P313-F395 HydrophobicContact CG-CZ 4.37Å
314	E	93.3	Very high	95.4	Very high	102 Å²	102	60.6 Å²	60.6	48%	0.477	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.9	175.7	-168.7	-172.6	-161.9	0	0	110	E312 R316 H319 C320	E312-E314 PolarHBondContact O-N 2.8Å; E314-R316 PolarHBondContact O-N 3.17Å; E314-R316 IonicContact OE2-CZ 3.1Å; E314-R316 IonicContact OE2-NE 2.74Å; E314-R316 PolarHBondContact OE2-NE 3.06Å; E314-R316 VanDerWaalsContact OE2-NE 3.1Å; E314-R316 IonicContact OE2-NH2 3.25Å; E314-R316 PolarHBondContact OE2-NH2 3.22Å; E314-R316 VanDerWaalsContact OE2-NH2 3.08Å; E314-H319 CarbonylContact O-C 3.25Å; E314-H319 VanDerWaalsContact O-CA 3.3Å; E314-H319 WeakPolarHBondContact O-CA 3.27Å; E314-C320 PolarHBondContact N-O 3.15Å; E314-C320 PolarHBondContact O-N 2.98Å
315	L	90.9	Very high	95.4	Very high	114 Å²	114	58.7 Å²	58.7	60%	0.597	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.5	109.9	173.5	176.3	61.6	0	0	0	110.3
316	R	87.8	Confident	95.4	Very high	135 Å²	135	63.7 Å²	63.7	51%	0.509	31%	0.305	S	S	.	.	S	Bend	trans	-105.3	-115.7	168.9	-61.3	-176.7	177.4	164.6	3.2	109.4	E314 E318 E322	E314-R316 PolarHBondContact O-N 3.17Å; E314-R316 IonicContact OE2-CZ 3.1Å; E314-R316 IonicContact OE2-NE 2.74Å; E314-R316 PolarHBondContact OE2-NE 3.06Å; E314-R316 VanDerWaalsContact OE2-NE 3.1Å; E314-R316 IonicContact OE2-NH2 3.25Å; E314-R316 PolarHBondContact OE2-NH2 3.22Å; E314-R316 VanDerWaalsContact OE2-NH2 3.08Å; R316-E318 PolarHBondContact N-O 2.86Å; R316-E322 IonicContact CZ-OE2 2.94Å; R316-E322 VanDerWaalsContact CZ-OE2 3.25Å; R316-E322 IonicContact NH1-OE2 3.96Å; R316-E322 PolarHBondContact NH1-OE2 3.38Å; R316-E322 IonicContact NH2-OE2 2.94Å; R316-E322 PolarHBondContact NH2-OE2 2.84Å
317	L	89.4	Confident	95.4	Very high	180 Å²	180	58.3 Å²	58.3	94%	0.942	28%	0.284	S	S	*	.	S	Bend	trans	-73.3	-42.7	163	-115.8	88.4	0	0	0	110.9
318	E	92.9	Very high	95.4	Very high	44 Å²	44	58 Å²	58	21%	0.206	28%	0.282	C	S	.	.	S	Bend	trans	-123.4	163.9	171.1	-68.9	-176.5	140.4	0	0	107.5	R316 C320 H349 L364 F365 N366	R316-E318 PolarHBondContact N-O 2.86Å; E318-C320 PolarHBondContact O-N 3.39Å; E318-H349 IonicContact OE2-CE1 3.51Å; E318-H349 PolarHBondContact OE2-CE1 2.97Å; E318-H349 VanDerWaalsContact OE2-CE1 3.28Å; E318-H349 IonicContact OE2-NE2 3.82Å; E318-L364 HydrophobicContact CB-CD2 4.4Å; E318-F365 WeakPolarHBondContact CB-O 3.48Å; E318-N366 WeakPolarHBondContact OE1-CB 3.49Å; E318-N366 PolarHBondContact OE1-ND2 3.42Å
319	H	95.4	Very high	95.4	Very high	38 Å²	38	55.6 Å²	55.6	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.3	171.7	-64.7	70.8	0	0	0	108.4	E314 L364 F365 P368 F395	E314-H319 CarbonylContact O-C 3.25Å; E314-H319 VanDerWaalsContact O-CA 3.3Å; E314-H319 WeakPolarHBondContact O-CA 3.27Å; H319-L364 CarbonylContact O-C 3.59Å; H319-L364 WeakPolarHBondContact O-CA 3.34Å; H319-F365 HydrophobicContact CB-CB 4.13Å; H319-F365 PolarHBondContact N-O 3.08Å; H319-F365 PolarHBondContact O-N 3.28Å; H319-P368 HydrophobicContact CB-CG 4.34Å; H319-P368 WeakPolarHBondContact ND1-CD 3.26Å; H319-P368 WeakPolarHBondContact ND1-CG 3.48Å; H319-F395 HydrophobicContact CB-CD1 3.98Å; H319-F395 HydrophobicContact CB-CE1 3.75Å; H319-F395 AromaticContact CD2-CD1 3.74Å; H319-F395 AromaticContact CG-CD1 3.83Å
320	C	96.4	Very high	95.3	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.02	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124.6	178.4	163.5	0	0	0	0	109.3	P313 E314 E318 E322 C362 L364	P313-C320 WeakPolarHBondContact CA-O 3.36Å; E314-C320 PolarHBondContact N-O 3.15Å; E314-C320 PolarHBondContact O-N 2.98Å; E318-C320 PolarHBondContact O-N 3.39Å; C320-E322 VanDerWaalsContact SG-CA 3.58Å; C320-E322 PolarHBondContact SG-N 3.33Å; C320-E322 VanDerWaalsContact SG-N 3.37Å; C320-C362 HydrophobicContact CB-CB 3.84Å; C320-C362 WeakPolarHBondContact CB-SG 3.25Å; C320-C362 WeakPolarHBondContact SG-CB 3.45Å; C320-C362 CovalentContact SG-SG 2.03Å; C320-C362 PolarHBondContact SG-SG 2.9Å; C320-L364 HydrophobicContact CB-CD2 4.02Å
321	I	97.4	Very high	95.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	99.8	157.1	-65.4	177.8	0	0	0	105.7	L310 E311 P313 W335 C362 L363 F365 Y376 I391 F395	L310-I321 HydrophobicContact CD1-CG2 3.68Å; E311-I321 WeakPolarHBondContact O-CG2 3.45Å; P313-I321 HydrophobicContact CB-CG1 3.84Å; P313-I321 HydrophobicContact CG-CG1 4.47Å; I321-W335 HydrophobicContact CG2-CH2 3.88Å; I321-W335 HydrophobicContact CG2-CZ3 4.38Å; I321-C362 WeakPolarHBondContact O-CA 3.44Å; I321-L363 HydrophobicContact CB-CB 4.24Å; I321-L363 HydrophobicContact CD1-CD2 4.42Å; I321-L363 PolarHBondContact N-O 3.32Å; I321-L363 PolarHBondContact O-N 2.88Å; I321-F365 HydrophobicContact CD1-CE2 3.69Å; I321-F365 HydrophobicContact CD1-CZ 3.98Å; I321-F365 HydrophobicContact CG1-CE2 3.9Å; I321-Y376 HydrophobicContact CD1-CD2 3.85Å; I321-Y376 HydrophobicContact CD1-CG 3.95Å; I321-I391 HydrophobicContact CD1-CG2 4.3Å; I321-I391 HydrophobicContact CG2-CG2 3.87Å; I321-F395 HydrophobicContact CD1-CZ 4.47Å
322	E	97.2	Very high	95.2	Very high	52 Å²	52	55.5 Å²	55.5	24%	0.243	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	139.1	-178.2	-169.9	166.3	158.8	0	0	110	L310 E311 R316 C320 G361	L310-E322 WeakPolarHBondContact CA-O 3.44Å; E311-E322 HydrophobicContact CB-CB 4.33Å; E311-E322 PolarHBondContact N-O 3.36Å; R316-E322 IonicContact CZ-OE2 2.94Å; R316-E322 VanDerWaalsContact CZ-OE2 3.25Å; R316-E322 IonicContact NH1-OE2 3.96Å; R316-E322 PolarHBondContact NH1-OE2 3.38Å; R316-E322 IonicContact NH2-OE2 2.94Å; R316-E322 PolarHBondContact NH2-OE2 2.84Å; C320-E322 VanDerWaalsContact SG-CA 3.58Å; C320-E322 PolarHBondContact SG-N 3.33Å; C320-E322 VanDerWaalsContact SG-N 3.37Å; E322-G361 WeakPolarHBondContact CA-O 3.23Å
323	F	97.6	Very high	95.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147.6	176.8	68.8	-92.2	0	0	0	111.9	S309 L310 V325 L333 W335 V350 Y352 E360 G361 L378	S309-F323 VanDerWaalsContact O-CA 3.3Å; S309-F323 WeakPolarHBondContact O-CA 3.15Å; L310-F323 HydrophobicContact CD1-CB 4.02Å; F323-V325 HydrophobicContact CD2-CG2 4.17Å; F323-L333 HydrophobicContact CD2-CD1 4.33Å; F323-L333 HydrophobicContact CE2-CD1 3.37Å; F323-L333 HydrophobicContact CZ-CD1 3.84Å; F323-W335 HydrophobicContact CD1-CH2 4.35Å; F323-W335 AromaticContact CD1-CZ2 3.54Å; F323-W335 HydrophobicContact CD1-CZ2 3.54Å; F323-W335 AromaticContact CE1-CZ2 3.87Å; F323-W335 HydrophobicContact CE1-CZ2 3.87Å; F323-W335 HydrophobicContact CG-CZ2 4.17Å; F323-V350 HydrophobicContact CE1-CG1 4.28Å; F323-V350 HydrophobicContact CZ-CG1 4.36Å; F323-Y352 HydrophobicContact CZ-CG 4.15Å; F323-E360 WeakPolarHBondContact O-CA 3.3Å; F323-G361 VanDerWaalsContact CD1-O 3.28Å; F323-G361 WeakPolarHBondContact CD1-O 3.49Å; F323-G361 VanDerWaalsContact CE1-C 3.49Å; F323-G361 PolarHBondContact N-O 3.39Å; F323-G361 PolarHBondContact O-N 2.97Å; F323-L378 HydrophobicContact CB-CD2 3.73Å; F323-L378 HydrophobicContact CD2-CD2 3.78Å; F323-L378 HydrophobicContact CG-CD2 3.8Å
324	V	97.9	Very high	95.4	Very high	23 Å²	23	53.4 Å²	53.4	14%	0.139	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.7	169.5	-179.1	0	0	0	0	108.1	V308 S309 I358 E360	V308-V324 WeakPolarHBondContact CA-O 3.46Å; V308-V324 HydrophobicContact CB-CB 4.27Å; V308-V324 HydrophobicContact CB-CG1 4.13Å; V308-V324 WeakPolarHBondContact CB-O 3.29Å; V308-V324 PolarHBondContact N-O 3.46Å; S309-V324 PolarHBondContact N-O 3.14Å; S309-V324 VanDerWaalsContact N-O 3.17Å; S309-V324 PolarHBondContact O-N 3.21Å; S309-V324 WeakPolarHBondContact OG-CB 3.33Å; S309-V324 VanDerWaalsContact OG-CG2 3.31Å; S309-V324 WeakPolarHBondContact OG-CG2 3.26Å; S309-V324 PolarHBondContact OG-N 2.77Å; V324-I358 HydrophobicContact CG1-CG2 4.07Å; V324-E360 HydrophobicContact CG2-CB 4.03Å
325	V	98	Very high	95.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.8	177	179.6	0	0	0	0	108.7	P305 R306 V307 F323 P331 L333 S359 L378 A380	P305-V325 HydrophobicContact CB-CG1 4.39Å; R306-V325 WeakPolarHBondContact O-CA 3.36Å; V307-V325 HydrophobicContact CG1-CG2 4.4Å; V307-V325 HydrophobicContact CG2-CG2 4.31Å; F323-V325 HydrophobicContact CD2-CG2 4.17Å; V325-P331 HydrophobicContact CG1-CG 3.72Å; V325-L333 HydrophobicContact CB-CD2 4.3Å; V325-L333 HydrophobicContact CG1-CD2 4.22Å; V325-L333 HydrophobicContact CG2-CD2 4.05Å; V325-S359 PolarHBondContact N-O 3.05Å; V325-S359 PolarHBondContact O-N 2.87Å; V325-L378 HydrophobicContact CG2-CD2 3.59Å; V325-L378 HydrophobicContact CG2-CG 4.49Å; V325-A380 HydrophobicContact CG1-CB 3.56Å; V325-A380 HydrophobicContact CG2-CB 4.4Å
326	R	97.4	Very high	96	Very high	111 Å²	111	45.7 Å²	45.7	42%	0.419	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.2	169.6	-72.1	-171.6	-179.8	-178.4	-0.2	111.2	Y303 P305 R306 V308 E357 I358	Y303-R326 HydrophobicContact CE2-CB 4.39Å; P305-R326 CarbonylContact C-O 3.58Å; P305-R326 WeakPolarHBondContact CA-O 3.27Å; R306-R326 PolarHBondContact N-O 3.14Å; R306-R326 PolarHBondContact O-N 3.19Å; V308-R326 HydrophobicContact CG2-CB 4.1Å; V308-R326 HydrophobicContact CG2-CG 3.75Å; R326-E357 CarbonylContact C-O 3.55Å; R326-E357 VanDerWaalsContact CA-O 3.24Å; R326-E357 WeakPolarHBondContact CA-O 3.18Å; R326-I358 HydrophobicContact CG-CG1 4.22Å
327	G	97.2	Very high	96.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	140.9	173.8	0	0	0	0	0	112	P329 P330 E357	G327-P329 CarbonylContact C-O 3.57Å; G327-P329 CarbonylContact O-C 3.59Å; G327-P330 WeakPolarHBondContact O-CA 3.48Å; G327-E357 PolarHBondContact N-O 3.19Å; G327-E357 WeakPolarHBondContact O-CA 3.37Å
328	N	97.7	Very high	96.7	Very high	20 Å²	20	37.2 Å²	37.2	11%	0.107	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	115.4	175.1	-170	21.4	0	0	0	110.4	N278 V301 Y302 Y303 E357	N278-N328 PolarHBondContact ND2-ND2 3.26Å; N278-N328 PolarHBondContact OD1-ND2 2.81Å; V301-N328 PolarHBondContact O-ND2 3.22Å; Y302-N328 CarbonylContact C-O 3.5Å; Y302-N328 WeakPolarHBondContact CA-O 3.23Å; Y302-N328 HydrophobicContact CD1-CB 4.4Å; Y302-N328 WeakPolarHBondContact CD1-ND2 3.38Å; Y303-N328 HydrophobicContact CD1-CB 3.86Å; Y303-N328 HydrophobicContact CE1-CB 3.53Å; Y303-N328 PolarHBondContact N-O 2.92Å; Y303-N328 PolarHBondContact O-N 3.15Å; N328-E357 HydrophobicContact CB-CB 4.29Å
329	P	96.8	Very high	96.8	Very high	34 Å²	34	37.5 Å²	37.5	22%	0.221	20%	0.203	C	C	.	.	S	Bend	cis	-62.4	158.2	2.5	-23.5	35	0	0	0	113.9	Y302 G327 N382	Y302-P329 HydrophobicContact CD1-CG 4.2Å; Y302-P329 HydrophobicContact CE1-CG 4.1Å; G327-P329 CarbonylContact C-O 3.57Å; G327-P329 CarbonylContact O-C 3.59Å; P329-N382 WeakPolarHBondContact O-CB 3.48Å; P329-N382 PolarHBondContact O-ND2 3.35Å
330	P	95.3	Very high	96.8	Very high	53 Å²	53	42.2 Å²	42.2	34%	0.344	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-57.9	131.9	-175.8	-22.9	34	0	0	0	111.5	G327 Q354 G356	G327-P330 WeakPolarHBondContact O-CA 3.48Å; P330-Q354 HydrophobicContact CB-CG 4.27Å; P330-G356 WeakPolarHBondContact CG-O 3.42Å
331	P	96.3	Very high	96.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-82.4	148.7	-172.6	30.9	-32.9	0	0	0	113.4	P305 V325 L333 A380 K381 N382	P305-P331 HydrophobicContact CB-CB 3.87Å; P305-P331 HydrophobicContact CB-CG 4.11Å; P305-P331 HydrophobicContact CG-CB 4.44Å; V325-P331 HydrophobicContact CG1-CG 3.72Å; P331-L333 HydrophobicContact CG-CD2 4.43Å; P331-A380 HydrophobicContact CB-CB 4.15Å; P331-A380 HydrophobicContact CG-CB 4.4Å; P331-K381 CarbonylContact C-O 3.59Å; P331-K381 VanDerWaalsContact CA-O 3.24Å; P331-K381 WeakPolarHBondContact CA-O 3.48Å; P331-K381 WeakPolarHBondContact CB-O 3.37Å; P331-N382 HydrophobicContact CB-CB 4.28Å
332	T	96.1	Very high	96.7	Very high	78 Å²	78	47.8 Å²	47.8	48%	0.479	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.8	165.4	56.3	0	0	0	0	110.2	A380 K381	T332-A380 WeakPolarHBondContact O-CA 3.17Å; T332-K381 PolarHBondContact N-O 2.8Å; T332-K381 PolarHBondContact O-N 3.44Å; T332-K381 PolarHBondContact OG1-O 2.83Å
333	L	97	Very high	96.5	Very high	21 Å²	21	55.9 Å²	55.9	11%	0.11	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.3	-176.8	-55	-177	0	0	0	112.4	F323 V325 P331 Y352 L378 I379 A380	F323-L333 HydrophobicContact CD2-CD1 4.33Å; F323-L333 HydrophobicContact CE2-CD1 3.37Å; F323-L333 HydrophobicContact CZ-CD1 3.84Å; V325-L333 HydrophobicContact CB-CD2 4.3Å; V325-L333 HydrophobicContact CG1-CD2 4.22Å; V325-L333 HydrophobicContact CG2-CD2 4.05Å; P331-L333 HydrophobicContact CG-CD2 4.43Å; L333-Y352 HydrophobicContact CD1-CD2 4.09Å; L333-Y352 HydrophobicContact CD1-CE2 4.13Å; L333-Y352 HydrophobicContact CD1-CG 4.44Å; L333-L378 HydrophobicContact CB-CD1 4.21Å; L333-L378 HydrophobicContact CD2-CD1 4.35Å; L333-I379 CarbonylContact C-O 3.54Å; L333-I379 WeakPolarHBondContact CA-O 3.34Å; L333-A380 HydrophobicContact CD2-CB 3.61Å
334	H	95.9	Very high	96.2	Very high	112 Å²	112	61.7 Å²	61.7	52%	0.519	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.7	174.3	-59.7	-52.1	0	0	0	110.6	I379	H334-I379 HydrophobicContact CB-CB 4.47Å; H334-I379 PolarHBondContact N-O 2.99Å; H334-I379 PolarHBondContact O-N 2.95Å
335	W	97.9	Very high	96	Very high	16 Å²	16	63.6 Å²	63.6	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.8	178.2	-75.2	91.8	0	0	0	111.9	L310 I321 F323 L342 V350 L363 T377 L378	L310-W335 HydrophobicContact CD1-CH2 3.58Å; L310-W335 HydrophobicContact CD1-CZ3 4.15Å; I321-W335 HydrophobicContact CG2-CH2 3.88Å; I321-W335 HydrophobicContact CG2-CZ3 4.38Å; F323-W335 HydrophobicContact CD1-CH2 4.35Å; F323-W335 AromaticContact CD1-CZ2 3.54Å; F323-W335 HydrophobicContact CD1-CZ2 3.54Å; F323-W335 AromaticContact CE1-CZ2 3.87Å; F323-W335 HydrophobicContact CE1-CZ2 3.87Å; F323-W335 HydrophobicContact CG-CZ2 4.17Å; W335-L342 HydrophobicContact CB-CB 3.81Å; W335-L342 HydrophobicContact CB-CD1 4.12Å; W335-L342 HydrophobicContact CB-CD2 4.48Å; W335-L342 HydrophobicContact CB-CG 4.37Å; W335-L342 WeakPolarHBondContact O-CB 3.48Å; W335-L342 PolarHBondContact O-N 2.93Å; W335-V350 HydrophobicContact CG-CG2 4.5Å; W335-L363 HydrophobicContact CD2-CB 4.45Å; W335-L363 HydrophobicContact CD2-CD1 4.46Å; W335-L363 HydrophobicContact CD2-CD2 3.95Å; W335-L363 HydrophobicContact CE3-CD2 3.75Å; W335-L363 HydrophobicContact CG-CD1 4.42Å; W335-L363 HydrophobicContact CH2-CB 4.03Å; W335-L363 HydrophobicContact CH2-CD2 4.27Å; W335-L363 HydrophobicContact CZ2-CB 3.76Å; W335-L363 HydrophobicContact CZ2-CD2 4.48Å; W335-L363 HydrophobicContact CZ3-CD2 3.92Å; W335-T377 CarbonylContact C-O 3.6Å; W335-T377 WeakPolarHBondContact CA-O 3.47Å; W335-L378 HydrophobicContact CD2-CB 4.33Å; W335-L378 HydrophobicContact CD2-CD1 4.16Å; W335-L378 HydrophobicContact CE3-CB 4.12Å; W335-L378 HydrophobicContact CH2-CB 3.92Å; W335-L378 HydrophobicContact CZ2-CB 4.08Å; W335-L378 HydrophobicContact CZ2-CD1 3.92Å; W335-L378 HydrophobicContact CZ2-CD2 4.3Å; W335-L378 HydrophobicContact CZ2-CG 4.32Å; W335-L378 HydrophobicContact CZ3-CB 3.92Å
336	L	97.8	Very high	95.6	Very high	39 Å²	39	73 Å²	73	20%	0.204	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	144	166.3	-50.2	-179.3	0	0	0	110	Q340 P341 Y376 T377 I379	L336-Q340 CarbonylContact C-O 3.52Å; L336-Q340 WeakPolarHBondContact CA-O 3.32Å; L336-Q340 WeakPolarHBondContact CB-O 3.24Å; L336-P341 HydrophobicContact CD2-CB 4.44Å; L336-P341 HydrophobicContact CD2-CG 4.32Å; L336-Y376 CarbonylContact O-C 3.47Å; L336-Y376 WeakPolarHBondContact O-CA 3.48Å; L336-T377 PolarHBondContact N-O 2.89Å; L336-T377 PolarHBondContact O-N 2.85Å; L336-I379 HydrophobicContact CD1-CD1 3.64Å; L336-I379 HydrophobicContact CD2-CD1 4.3Å; L336-I379 HydrophobicContact CG-CD1 3.78Å
337	H	96.8	Very high	95.4	Very high	42 Å²	42	71.4 Å²	71.4	19%	0.194	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.9	167	-177.8	-152.1	0	0	0	108.5	G339 Q340 L342 N375 Y376	H337-G339 PolarHBondContact O-N 2.99Å; H337-Q340 PolarHBondContact N-O 3.32Å; H337-Q340 PolarHBondContact O-N 3.33Å; H337-L342 HydrophobicContact CB-CB 4.45Å; H337-L342 HydrophobicContact CB-CD1 4.18Å; H337-N375 WeakPolarHBondContact CA-O 3.35Å; H337-Y376 HydrophobicContact CB-CD1 4.36Å; H337-Y376 HydrophobicContact CB-CE1 4.11Å; H337-Y376 AromaticContact CD2-CE1 3.68Å; H337-Y376 AromaticContact CD2-CE2 3.96Å; H337-Y376 AromaticContact CD2-CZ 3.56Å; H337-Y376 AromaticContact CG-CE1 3.81Å; H337-Y376 AromaticContact NE2-CZ 3.67Å; H337-Y376 PolarHBondContact NE2-OH 2.8Å
338	N	95.6	Very high	95.3	Very high	94 Å²	94	72.1 Å²	72.1	50%	0.503	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	40.2	-176.9	-61.5	-33.4	0	0	0	113.1	Q340 N375	N338-Q340 VanDerWaalsContact C-N 3.29Å; N338-Q340 PolarHBondContact O-N 3.33Å; N338-N375 PolarHBondContact N-O 3.36Å; N338-N375 PolarHBondContact OD1-N 2.75Å
339	G	94.3	Very high	95.2	Very high	51 Å²	51	73.2 Å²	73.2	53%	0.526	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	-3.3	178.9	0	0	0	0	0	115.5	H337	H337-G339 PolarHBondContact O-N 2.99Å
340	Q	96.4	Very high	95.1	Very high	137 Å²	137	72.9 Å²	72.9	64%	0.64	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	147.5	176.9	-66	-65.4	-31.3	0	0	111.1	L336 H337 N338 L342	L336-Q340 CarbonylContact C-O 3.52Å; L336-Q340 WeakPolarHBondContact CA-O 3.32Å; L336-Q340 WeakPolarHBondContact CB-O 3.24Å; H337-Q340 PolarHBondContact N-O 3.32Å; H337-Q340 PolarHBondContact O-N 3.33Å; N338-Q340 VanDerWaalsContact C-N 3.29Å; N338-Q340 PolarHBondContact O-N 3.33Å; Q340-L342 PolarHBondContact O-N 3.07Å; Q340-L342 VanDerWaalsContact O-N 3.17Å
341	P	96.4	Very high	95.1	Very high	91 Å²	91	76 Å²	76	59%	0.591	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.4	121.8	175.3	-26.2	35	0	0	0	112	L336 R343	L336-P341 HydrophobicContact CD2-CB 4.44Å; L336-P341 HydrophobicContact CD2-CG 4.32Å; P341-R343 PolarHBondContact O-N 3.04Å
342	L	95.8	Very high	95.1	Very high	29 Å²	29	81.3 Å²	81.3	15%	0.152	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-70.2	127.5	178.1	-173.3	151	0	0	0	108.6	W335 H337 Q340 E344 I348 L363 Y376	W335-L342 HydrophobicContact CB-CB 3.81Å; W335-L342 HydrophobicContact CB-CD1 4.12Å; W335-L342 HydrophobicContact CB-CD2 4.48Å; W335-L342 HydrophobicContact CB-CG 4.37Å; W335-L342 WeakPolarHBondContact O-CB 3.48Å; W335-L342 PolarHBondContact O-N 2.93Å; H337-L342 HydrophobicContact CB-CB 4.45Å; H337-L342 HydrophobicContact CB-CD1 4.18Å; Q340-L342 PolarHBondContact O-N 3.07Å; Q340-L342 VanDerWaalsContact O-N 3.17Å; L342-E344 HydrophobicContact CD2-CG 4.47Å; L342-I348 HydrophobicContact CD1-CG2 4.19Å; L342-I348 HydrophobicContact CD2-CG2 4.01Å; L342-L363 HydrophobicContact CD1-CD1 4.15Å; L342-L363 HydrophobicContact CD1-CD2 3.92Å; L342-L363 HydrophobicContact CD2-CD1 4.25Å; L342-Y376 HydrophobicContact CD1-CD1 3.74Å; L342-Y376 HydrophobicContact CD1-CE1 3.71Å
343	R	92.2	Very high	95.1	Very high	221 Å²	221	83.4 Å²	83.4	83%	0.834	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-103.1	124.8	173.7	-65.1	-175.4	-178.6	-175.8	0.4	109	P341	P341-R343 PolarHBondContact O-N 3.04Å
344	E	91.5	Very high	95	Very high	122 Å²	122	86.2 Å²	86.2	57%	0.57	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-63.6	147.3	175.3	-63.8	-173.1	-128.1	0	0	111.2	L342 I348 H349 V350	L342-E344 HydrophobicContact CD2-CG 4.47Å; E344-I348 CarbonylContact C-O 3.33Å; E344-I348 VanDerWaalsContact CA-O 3.27Å; E344-I348 WeakPolarHBondContact CA-O 3.37Å; E344-H349 WeakPolarHBondContact OE2-CA 3.27Å; E344-H349 WeakPolarHBondContact OE2-CB 3.29Å; E344-V350 PolarHBondContact OE2-N 3.19Å; E344-V350 VanDerWaalsContact OE2-N 3.12Å
345	S	93	Very high	94.8	Very high	63 Å²	63	87 Å²	87	44%	0.441	42%	0.422	S	S	.	.			trans	-151.1	-179.1	-175.2	69.5	0	0	0	0	109.8	I347 I348	S345-I347 PolarHBondContact O-N 3.1Å; S345-I347 PolarHBondContact OG-N 2.75Å; S345-I348 PolarHBondContact N-O 3.31Å; S345-I348 CarbonylContact O-C 3.54Å; S345-I348 PolarHBondContact O-N 3.02Å; S345-I348 PolarHBondContact OG-N 2.89Å
346	K	91.2	Very high	94.5	Very high	198 Å²	198	88.9 Å²	88.9	86%	0.861	45%	0.446	S	S	*	.	S	Bend	trans	-63.6	-18.1	172.5	-64.7	-175.8	179.7	-178.6	0	113.7
347	I	91.4	Very high	94.3	Very high	78 Å²	78	89 Å²	89	40%	0.4	45%	0.446	S	S	.	.	S	Bend	trans	-95.6	-39	-179	-60.5	173.2	0	0	0	110.3	S345 F365 N366	S345-I347 PolarHBondContact O-N 3.1Å; S345-I347 PolarHBondContact OG-N 2.75Å; I347-F365 CarbonylContact O-C 3.46Å; I347-F365 WeakPolarHBondContact O-CA 3.29Å; I347-N366 PolarHBondContact O-N 3.48Å
348	I	95.8	Very high	94.3	Very high	15 Å²	15	89.3 Å²	89.3	8%	0.077	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	122.7	-173.4	-47.8	177.2	0	0	0	109.1	L342 E344 S345 L363 L364 F365	L342-I348 HydrophobicContact CD1-CG2 4.19Å; L342-I348 HydrophobicContact CD2-CG2 4.01Å; E344-I348 CarbonylContact C-O 3.33Å; E344-I348 VanDerWaalsContact CA-O 3.27Å; E344-I348 WeakPolarHBondContact CA-O 3.37Å; S345-I348 PolarHBondContact N-O 3.31Å; S345-I348 CarbonylContact O-C 3.54Å; S345-I348 PolarHBondContact O-N 3.02Å; S345-I348 PolarHBondContact OG-N 2.89Å; I348-L363 HydrophobicContact CG2-CD1 3.64Å; I348-L363 HydrophobicContact CG2-CG 4.15Å; I348-L364 VanDerWaalsContact CA-O 3.31Å; I348-L364 WeakPolarHBondContact CA-O 3.48Å; I348-F365 HydrophobicContact CB-CD1 4.44Å; I348-F365 HydrophobicContact CB-CE1 4.42Å; I348-F365 HydrophobicContact CD1-CD1 4.14Å; I348-F365 HydrophobicContact CD1-CE1 3.78Å; I348-F365 HydrophobicContact CG1-CD1 3.71Å; I348-F365 HydrophobicContact CG1-CE1 3.8Å; I348-F365 HydrophobicContact CG2-CD1 4.21Å; I348-F365 HydrophobicContact CG2-CE1 3.85Å; I348-F365 HydrophobicContact CG2-CZ 4.18Å
349	H	95.1	Very high	94.3	Very high	42 Å²	42	84.8 Å²	84.8	19%	0.194	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	158.5	175.9	61.4	-69.7	0	0	0	110.5	E318 E344 E351 L364	E318-H349 IonicContact OE2-CE1 3.51Å; E318-H349 PolarHBondContact OE2-CE1 2.97Å; E318-H349 VanDerWaalsContact OE2-CE1 3.28Å; E318-H349 IonicContact OE2-NE2 3.82Å; E344-H349 WeakPolarHBondContact OE2-CA 3.27Å; E344-H349 WeakPolarHBondContact OE2-CB 3.29Å; H349-E351 IonicContact CD2-OE1 3.81Å; H349-E351 IonicContact NE2-OE1 3.08Å; H349-L364 PolarHBondContact N-O 3.04Å; H349-L364 VanDerWaalsContact N-O 3.09Å; H349-L364 WeakPolarHBondContact NE2-CD1 3.3Å; H349-L364 PolarHBondContact O-N 2.99Å
350	V	95.9	Very high	94.5	Very high	27 Å²	27	86.9 Å²	86.9	16%	0.164	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.3	-179.8	-172.2	0	0	0	0	108.9	F323 W335 E344 Y352 L363	F323-V350 HydrophobicContact CE1-CG1 4.28Å; F323-V350 HydrophobicContact CZ-CG1 4.36Å; W335-V350 HydrophobicContact CG-CG2 4.5Å; E344-V350 PolarHBondContact OE2-N 3.19Å; E344-V350 VanDerWaalsContact OE2-N 3.12Å; V350-Y352 HydrophobicContact CG1-CD1 3.86Å; V350-Y352 HydrophobicContact CG1-CE1 4.47Å; V350-L363 HydrophobicContact CG2-CD1 3.59Å
351	E	95.1	Very high	94.5	Very high	120 Å²	120	81.1 Å²	81.1	56%	0.561	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.5	169.7	-69.5	-169.6	168.6	0	0	108.9	H349 G361 C362 L364	H349-E351 IonicContact CD2-OE1 3.81Å; H349-E351 IonicContact NE2-OE1 3.08Å; E351-G361 CarbonylContact O-C 3.55Å; E351-G361 VanDerWaalsContact O-CA 3.29Å; E351-G361 WeakPolarHBondContact O-CA 3.37Å; E351-C362 PolarHBondContact N-O 3.13Å; E351-C362 PolarHBondContact O-N 2.89Å; E351-L364 HydrophobicContact CB-CD1 3.91Å; E351-L364 HydrophobicContact CG-CD1 3.77Å
352	Y	95.9	Very high	94.5	Very high	111 Å²	111	77.9 Å²	77.9	44%	0.435	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	156.7	178.9	73.1	-79.5	0	0	0	111.5	F323 L333 V350 E360	F323-Y352 HydrophobicContact CZ-CG 4.15Å; L333-Y352 HydrophobicContact CD1-CD2 4.09Å; L333-Y352 HydrophobicContact CD1-CE2 4.13Å; L333-Y352 HydrophobicContact CD1-CG 4.44Å; V350-Y352 HydrophobicContact CG1-CD1 3.86Å; V350-Y352 HydrophobicContact CG1-CE1 4.47Å; Y352-E360 CarbonylContact C-O 3.58Å; Y352-E360 VanDerWaalsContact CA-O 3.31Å; Y352-E360 WeakPolarHBondContact CA-O 3.41Å; Y352-E360 WeakPolarHBondContact CB-O 3.49Å
353	Y	95.4	Very high	94.5	Very high	122 Å²	122	76.5 Å²	76.5	48%	0.478	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.9	174	171.3	-115.6	0	0	0	109.1	E355 S359 E360	Y353-E355 HydrophobicContact CD1-CB 4.31Å; Y353-E355 HydrophobicContact CE1-CB 3.42Å; Y353-E355 VanDerWaalsContact CE1-CB 3.42Å; Y353-E355 HydrophobicContact CE1-CG 4.13Å; Y353-E355 WeakPolarHBondContact CE1-OE2 3.33Å; Y353-E355 WeakPolarHBondContact OH-CB 3.37Å; Y353-E355 VanDerWaalsContact OH-CG 3.23Å; Y353-E355 WeakPolarHBondContact OH-CG 3.36Å; Y353-E355 PolarHBondContact OH-OE2 3.23Å; Y353-S359 WeakPolarHBondContact O-CA 3.1Å; Y353-E360 PolarHBondContact N-O 3.35Å; Y353-E360 PolarHBondContact O-N 3.3Å
354	Q	94.8	Very high	94.7	Very high	81 Å²	81	66.9 Å²	66.9	38%	0.379	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	116.1	178.2	-172.6	177.7	-64.9	0	0	109.4	P330 I358 S359	P330-Q354 HydrophobicContact CB-CG 4.27Å; Q354-I358 CarbonylContact C-O 3.55Å; Q354-I358 WeakPolarHBondContact CA-O 3.22Å; Q354-S359 PolarHBondContact OE1-OG 2.89Å
355	E	93.5	Very high	95	Very high	127 Å²	127	61.1 Å²	61.1	59%	0.593	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	112.2	178.3	-163.2	169.8	-171.6	0	0	110.4	Y353 E357 I358	Y353-E355 HydrophobicContact CD1-CB 4.31Å; Y353-E355 HydrophobicContact CE1-CB 3.42Å; Y353-E355 VanDerWaalsContact CE1-CB 3.42Å; Y353-E355 HydrophobicContact CE1-CG 4.13Å; Y353-E355 WeakPolarHBondContact CE1-OE2 3.33Å; Y353-E355 WeakPolarHBondContact OH-CB 3.37Å; Y353-E355 VanDerWaalsContact OH-CG 3.23Å; Y353-E355 WeakPolarHBondContact OH-CG 3.36Å; Y353-E355 PolarHBondContact OH-OE2 3.23Å; E355-E357 PolarHBondContact O-N 3.32Å; E355-I358 PolarHBondContact N-O 3.44Å; E355-I358 PolarHBondContact O-N 3.01Å
356	G	91.2	Very high	95.1	Very high	56 Å²	56	61.1 Å²	61.1	58%	0.577	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	-119.5	-176.7	0	0	0	0	0	110.6	P330	P330-G356 WeakPolarHBondContact CG-O 3.42Å
357	E	93.4	Very high	95.1	Very high	41 Å²	41	60.3 Å²	60.3	19%	0.192	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-4.6	-178.2	64.6	176.2	-154.1	0	0	115.3	N278 Y303 R326 G327 N328 E355	N278-E357 PolarHBondContact ND2-OE2 3.14Å; Y303-E357 WeakPolarHBondContact CE1-OE2 3.44Å; Y303-E357 WeakPolarHBondContact OH-CB 3.11Å; Y303-E357 PolarHBondContact OH-OE1 2.97Å; Y303-E357 PolarHBondContact OH-OE2 3.35Å; R326-E357 CarbonylContact C-O 3.55Å; R326-E357 VanDerWaalsContact CA-O 3.24Å; R326-E357 WeakPolarHBondContact CA-O 3.18Å; G327-E357 PolarHBondContact N-O 3.19Å; G327-E357 WeakPolarHBondContact O-CA 3.37Å; N328-E357 HydrophobicContact CB-CB 4.29Å; E355-E357 PolarHBondContact O-N 3.32Å
358	I	96.1	Very high	95.3	Very high	49 Å²	49	57 Å²	57	25%	0.251	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130	-174.7	-50.8	-175.9	0	0	0	109.9	V324 R326 Q354 E355	V324-I358 HydrophobicContact CG1-CG2 4.07Å; R326-I358 HydrophobicContact CG-CG1 4.22Å; Q354-I358 CarbonylContact C-O 3.55Å; Q354-I358 WeakPolarHBondContact CA-O 3.22Å; E355-I358 PolarHBondContact N-O 3.44Å; E355-I358 PolarHBondContact O-N 3.01Å
359	S	96.8	Very high	95.1	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	115.5	167.3	-53.1	0	0	0	0	108.6	V325 Y353 Q354	V325-S359 PolarHBondContact N-O 3.05Å; V325-S359 PolarHBondContact O-N 2.87Å; Y353-S359 WeakPolarHBondContact O-CA 3.1Å; Q354-S359 PolarHBondContact OE1-OG 2.89Å
360	E	96.9	Very high	95	Very high	94 Å²	94	58.7 Å²	58.7	44%	0.439	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.7	-178.7	64.8	179.5	-170.9	0	0	111.5	F323 V324 Y352 Y353	F323-E360 WeakPolarHBondContact O-CA 3.3Å; V324-E360 HydrophobicContact CG2-CB 4.03Å; Y352-E360 CarbonylContact C-O 3.58Å; Y352-E360 VanDerWaalsContact CA-O 3.31Å; Y352-E360 WeakPolarHBondContact CA-O 3.41Å; Y352-E360 WeakPolarHBondContact CB-O 3.49Å; Y353-E360 PolarHBondContact N-O 3.35Å; Y353-E360 PolarHBondContact O-N 3.3Å
361	G	96.3	Very high	94.8	Very high	17 Å²	17	66.1 Å²	66.1	18%	0.175	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-163.5	-178.1	0	0	0	0	0	114.5	E322 F323 E351	E322-G361 WeakPolarHBondContact CA-O 3.23Å; F323-G361 VanDerWaalsContact CD1-O 3.28Å; F323-G361 WeakPolarHBondContact CD1-O 3.49Å; F323-G361 VanDerWaalsContact CE1-C 3.49Å; F323-G361 PolarHBondContact N-O 3.39Å; F323-G361 PolarHBondContact O-N 2.97Å; E351-G361 CarbonylContact O-C 3.55Å; E351-G361 VanDerWaalsContact O-CA 3.29Å; E351-G361 WeakPolarHBondContact O-CA 3.37Å
362	C	96.3	Very high	94.7	Very high	22 Å²	22	61.3 Å²	61.3	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.6	-177.5	-74.7	0	0	0	0	110.8	C320 I321 E351 L364	C320-C362 HydrophobicContact CB-CB 3.84Å; C320-C362 WeakPolarHBondContact CB-SG 3.25Å; C320-C362 WeakPolarHBondContact SG-CB 3.45Å; C320-C362 CovalentContact SG-SG 2.03Å; C320-C362 PolarHBondContact SG-SG 2.9Å; I321-C362 WeakPolarHBondContact O-CA 3.44Å; E351-C362 PolarHBondContact N-O 3.13Å; E351-C362 PolarHBondContact O-N 2.89Å; C362-L364 HydrophobicContact CB-CD2 3.53Å; C362-L364 HydrophobicContact CB-CG 3.69Å; C362-L364 PolarHBondContact O-N 3.24Å
363	L	97.4	Very high	94.7	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	107.1	150.5	178.9	70.9	0	0	0	107	I321 W335 L342 I348 V350 F365 Y376	I321-L363 HydrophobicContact CB-CB 4.24Å; I321-L363 HydrophobicContact CD1-CD2 4.42Å; I321-L363 PolarHBondContact N-O 3.32Å; I321-L363 PolarHBondContact O-N 2.88Å; W335-L363 HydrophobicContact CD2-CB 4.45Å; W335-L363 HydrophobicContact CD2-CD1 4.46Å; W335-L363 HydrophobicContact CD2-CD2 3.95Å; W335-L363 HydrophobicContact CE3-CD2 3.75Å; W335-L363 HydrophobicContact CG-CD1 4.42Å; W335-L363 HydrophobicContact CH2-CB 4.03Å; W335-L363 HydrophobicContact CH2-CD2 4.27Å; W335-L363 HydrophobicContact CZ2-CB 3.76Å; W335-L363 HydrophobicContact CZ2-CD2 4.48Å; W335-L363 HydrophobicContact CZ3-CD2 3.92Å; L342-L363 HydrophobicContact CD1-CD1 4.15Å; L342-L363 HydrophobicContact CD1-CD2 3.92Å; L342-L363 HydrophobicContact CD2-CD1 4.25Å; I348-L363 HydrophobicContact CG2-CD1 3.64Å; I348-L363 HydrophobicContact CG2-CG 4.15Å; V350-L363 HydrophobicContact CG2-CD1 3.59Å; L363-F365 HydrophobicContact CB-CE2 4.29Å; L363-F365 HydrophobicContact CD2-CE2 3.82Å; L363-F365 HydrophobicContact CD2-CZ 3.54Å; L363-F365 HydrophobicContact CG-CE2 3.66Å; L363-F365 HydrophobicContact CG-CZ 3.78Å; L363-F365 WeakPolarHBondContact O-CD2 3.49Å; L363-F365 VanDerWaalsContact O-CE2 3.28Å; L363-F365 WeakPolarHBondContact O-CE2 3.39Å; L363-Y376 HydrophobicContact CD2-CD1 3.52Å; L363-Y376 HydrophobicContact CD2-CE1 4.07Å; L363-Y376 HydrophobicContact CD2-CG 4.18Å
364	L	96.8	Very high	94.7	Very high	20 Å²	20	52.5 Å²	52.5	11%	0.105	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	141.1	-171.7	-68.6	171.2	0	0	0	111.7	E318 H319 C320 I348 H349 E351 C362	E318-L364 HydrophobicContact CB-CD2 4.4Å; H319-L364 CarbonylContact O-C 3.59Å; H319-L364 WeakPolarHBondContact O-CA 3.34Å; C320-L364 HydrophobicContact CB-CD2 4.02Å; I348-L364 VanDerWaalsContact CA-O 3.31Å; I348-L364 WeakPolarHBondContact CA-O 3.48Å; H349-L364 PolarHBondContact N-O 3.04Å; H349-L364 VanDerWaalsContact N-O 3.09Å; H349-L364 WeakPolarHBondContact NE2-CD1 3.3Å; H349-L364 PolarHBondContact O-N 2.99Å; E351-L364 HydrophobicContact CB-CD1 3.91Å; E351-L364 HydrophobicContact CG-CD1 3.77Å; C362-L364 HydrophobicContact CB-CD2 3.53Å; C362-L364 HydrophobicContact CB-CG 3.69Å; C362-L364 PolarHBondContact O-N 3.24Å
365	F	96.8	Very high	94.8	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	113.5	178	-57.5	-103.2	0	0	0	111.8	E318 H319 I321 I347 I348 L363 K367 P368 Y376 F395	E318-F365 WeakPolarHBondContact CB-O 3.48Å; H319-F365 HydrophobicContact CB-CB 4.13Å; H319-F365 PolarHBondContact N-O 3.08Å; H319-F365 PolarHBondContact O-N 3.28Å; I321-F365 HydrophobicContact CD1-CE2 3.69Å; I321-F365 HydrophobicContact CD1-CZ 3.98Å; I321-F365 HydrophobicContact CG1-CE2 3.9Å; I347-F365 CarbonylContact O-C 3.46Å; I347-F365 WeakPolarHBondContact O-CA 3.29Å; I348-F365 HydrophobicContact CB-CD1 4.44Å; I348-F365 HydrophobicContact CB-CE1 4.42Å; I348-F365 HydrophobicContact CD1-CD1 4.14Å; I348-F365 HydrophobicContact CD1-CE1 3.78Å; I348-F365 HydrophobicContact CG1-CD1 3.71Å; I348-F365 HydrophobicContact CG1-CE1 3.8Å; I348-F365 HydrophobicContact CG2-CD1 4.21Å; I348-F365 HydrophobicContact CG2-CE1 3.85Å; I348-F365 HydrophobicContact CG2-CZ 4.18Å; L363-F365 HydrophobicContact CB-CE2 4.29Å; L363-F365 HydrophobicContact CD2-CE2 3.82Å; L363-F365 HydrophobicContact CD2-CZ 3.54Å; L363-F365 HydrophobicContact CG-CE2 3.66Å; L363-F365 HydrophobicContact CG-CZ 3.78Å; L363-F365 WeakPolarHBondContact O-CD2 3.49Å; L363-F365 VanDerWaalsContact O-CE2 3.28Å; L363-F365 WeakPolarHBondContact O-CE2 3.39Å; F365-K367 PolarHBondContact O-N 3.34Å; F365-P368 HydrophobicContact CB-CB 3.98Å; F365-P368 HydrophobicContact CB-CG 3.76Å; F365-P368 HydrophobicContact CD1-CB 4.37Å; F365-Y376 AromaticContact CE1-CE1 3.74Å; F365-Y376 HydrophobicContact CE1-CE1 3.74Å; F365-Y376 HydrophobicContact CE1-CE2 4.36Å; F365-Y376 AromaticContact CE1-CZ 3.56Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.37Å; F365-Y376 HydrophobicContact CZ-CD1 4.04Å; F365-Y376 AromaticContact CZ-CE1 3.53Å; F365-Y376 HydrophobicContact CZ-CE1 3.53Å; F365-Y376 HydrophobicContact CZ-CE2 4.12Å; F365-Y376 AromaticContact CZ-CZ 3.58Å; F365-F395 HydrophobicContact CB-CE1 4.17Å; F365-F395 HydrophobicContact CB-CZ 4.47Å; F365-F395 HydrophobicContact CD1-CE1 4.15Å; F365-F395 HydrophobicContact CD1-CE2 4.07Å; F365-F395 AromaticContact CD1-CZ 3.61Å; F365-F395 HydrophobicContact CD1-CZ 3.61Å; F365-F395 AromaticContact CD2-CE1 3.76Å; F365-F395 HydrophobicContact CD2-CE1 3.76Å; F365-F395 AromaticContact CD2-CZ 3.62Å; F365-F395 HydrophobicContact CD2-CZ 3.62Å; F365-F395 AromaticContact CE1-CE2 3.93Å; F365-F395 HydrophobicContact CE1-CE2 3.93Å; F365-F395 AromaticContact CE1-CZ 3.6Å; F365-F395 HydrophobicContact CE1-CZ 3.6Å; F365-F395 HydrophobicContact CE2-CE1 4.17Å; F365-F395 AromaticContact CE2-CZ 3.6Å; F365-F395 HydrophobicContact CE2-CZ 3.6Å; F365-F395 AromaticContact CG-CE1 3.77Å; F365-F395 HydrophobicContact CG-CE1 3.77Å; F365-F395 HydrophobicContact CG-CE2 4.5Å; F365-F395 AromaticContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CZ-CE2 4.22Å; F365-F395 AromaticContact CZ-CZ 3.59Å; F365-F395 HydrophobicContact CZ-CZ 3.59Å
366	N	95.1	Very high	95	Very high	64 Å²	64	46.4 Å²	46.4	34%	0.342	25%	0.245	S	C	.	.	S	Bend	trans	-84.4	106.9	174.7	-164.8	-28.5	0	0	0	110.7	E318 I347	E318-N366 WeakPolarHBondContact OE1-CB 3.49Å; E318-N366 PolarHBondContact OE1-ND2 3.42Å; I347-N366 PolarHBondContact O-N 3.48Å
367	K	92.2	Very high	95.4	Very high	181 Å²	181	44.6 Å²	44.6	79%	0.787	22%	0.222	S	C	*	.	S	Bend	trans	48.4	56.9	178.7	-62.1	171.1	-175.7	174.4	0	112.8	F365	F365-K367 PolarHBondContact O-N 3.34Å
368	P	94.2	Very high	95.6	Very high	7 Å²	7	42.6 Å²	42.6	5%	0.045	21%	0.213	C	C	.	.			trans	-63	155.8	179.4	27	-33.6	0	0	0	111.9	H319 F365 N372 F395	H319-P368 HydrophobicContact CB-CG 4.34Å; H319-P368 WeakPolarHBondContact ND1-CD 3.26Å; H319-P368 WeakPolarHBondContact ND1-CG 3.48Å; F365-P368 HydrophobicContact CB-CB 3.98Å; F365-P368 HydrophobicContact CB-CG 3.76Å; F365-P368 HydrophobicContact CD1-CB 4.37Å; P368-N372 WeakPolarHBondContact CA-OD1 3.15Å; P368-N372 HydrophobicContact CB-CB 3.94Å; P368-F395 HydrophobicContact CB-CB 3.88Å; P368-F395 HydrophobicContact CB-CD1 3.8Å; P368-F395 HydrophobicContact CB-CD2 4.03Å; P368-F395 HydrophobicContact CB-CE1 4.34Å; P368-F395 HydrophobicContact CB-CG 3.61Å; P368-F395 HydrophobicContact CG-CB 3.79Å; P368-F395 HydrophobicContact CG-CD1 3.29Å; P368-F395 HydrophobicContact CG-CD2 4.43Å; P368-F395 HydrophobicContact CG-CE1 3.94Å; P368-F395 HydrophobicContact CG-CG 3.57Å
369	T	92.6	Very high	95.7	Very high	57 Å²	57	42 Å²	42	35%	0.35	21%	0.21	S	C	.	.			trans	-116.9	178.4	175.8	65.7	0	0	0	0	111.1	Y371 N372	T369-Y371 PolarHBondContact O-N 3.36Å; T369-Y371 VanDerWaalsContact O-N 3.13Å; T369-N372 PolarHBondContact N-OD1 3.07Å; T369-N372 WeakPolarHBondContact O-CB 3.23Å; T369-N372 PolarHBondContact O-N 3.4Å; T369-N372 PolarHBondContact O-OD1 3.31Å; T369-N372 PolarHBondContact OG1-OD1 3.18Å
370	H	92.4	Very high	95.7	Very high	36 Å²	36	42 Å²	42	17%	0.167	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-57.9	-24.8	175.1	62.8	-87.6	0	0	0	113	N372 N373 L396 E398	H370-N372 PolarHBondContact O-N 2.92Å; H370-N373 VanDerWaalsContact O-CB 3.26Å; H370-N373 WeakPolarHBondContact O-CB 3.36Å; H370-N373 VanDerWaalsContact O-CG 3.31Å; H370-N373 PolarHBondContact O-N 2.85Å; H370-L396 VanDerWaalsContact CB-O 3.31Å; H370-L396 WeakPolarHBondContact CB-O 3.27Å; H370-E398 HydrophobicContact CB-CG 3.95Å
371	Y	91.5	Very high	95.8	Very high	183 Å²	183	43.2 Å²	43.2	72%	0.718	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-66.4	-18.1	173.2	-66.2	-68.9	0	0	0	114.2	T369 N373	T369-Y371 PolarHBondContact O-N 3.36Å; T369-Y371 VanDerWaalsContact O-N 3.13Å; Y371-N373 VanDerWaalsContact C-N 3.32Å
372	N	94.1	Very high	95.8	Very high	20 Å²	20	43 Å²	43	11%	0.107	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-89.5	-2.8	174.5	-57.1	105.4	0	0	0	111.6	P368 T369 H370 Y376 F395	P368-N372 WeakPolarHBondContact CA-OD1 3.15Å; P368-N372 HydrophobicContact CB-CB 3.94Å; T369-N372 PolarHBondContact N-OD1 3.07Å; T369-N372 WeakPolarHBondContact O-CB 3.23Å; T369-N372 PolarHBondContact O-N 3.4Å; T369-N372 PolarHBondContact O-OD1 3.31Å; T369-N372 PolarHBondContact OG1-OD1 3.18Å; H370-N372 PolarHBondContact O-N 2.92Å; N372-Y376 WeakPolarHBondContact O-CE2 3.36Å; N372-Y376 PolarHBondContact O-OH 2.83Å; N372-F395 HydrophobicContact CB-CD2 3.83Å; N372-F395 HydrophobicContact CB-CE2 4.04Å; N372-F395 VanDerWaalsContact O-CE2 3.25Å; N372-F395 WeakPolarHBondContact O-CE2 3.36Å
373	N	94.8	Very high	95.9	Very high	37 Å²	37	47.5 Å²	47.5	20%	0.198	24%	0.238	C	C	.	.			trans	-68.6	141.2	176.1	-63.7	-9.7	0	0	0	110.6	H370 Y371 G393 F395 L396	H370-N373 VanDerWaalsContact O-CB 3.26Å; H370-N373 WeakPolarHBondContact O-CB 3.36Å; H370-N373 VanDerWaalsContact O-CG 3.31Å; H370-N373 PolarHBondContact O-N 2.85Å; Y371-N373 VanDerWaalsContact C-N 3.32Å; N373-G393 WeakPolarHBondContact CA-O 3.39Å; N373-F395 PolarHBondContact OD1-N 3.44Å; N373-L396 PolarHBondContact ND2-O 3.41Å
374	G	95.3	Very high	95.9	Very high	11 Å²	11	49.9 Å²	49.9	11%	0.113	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.3	-173.1	175.8	0	0	0	0	0	113.6	Y376 N392 G393	G374-Y376 VanDerWaalsContact O-CD2 3.28Å; G374-Y376 WeakPolarHBondContact O-CD2 3.33Å; G374-N392 PolarHBondContact O-OD1 3.42Å; G374-G393 PolarHBondContact N-O 2.74Å; G374-G393 VanDerWaalsContact N-O 3.08Å; G374-G393 PolarHBondContact O-N 3.4Å
375	N	97.6	Very high	95.9	Very high	80 Å²	80	50.1 Å²	50.1	43%	0.428	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.1	-178.2	-70.7	-21.3	0	0	0	110.4	H337 N338 T390 I391	H337-N375 WeakPolarHBondContact CA-O 3.35Å; N338-N375 PolarHBondContact N-O 3.36Å; N338-N375 PolarHBondContact OD1-N 2.75Å; N375-T390 HydrophobicContact CB-CG2 3.81Å; N375-I391 WeakPolarHBondContact CA-O 3.26Å
376	Y	97.9	Very high	95.9	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.7	174	-68.1	-87.2	0	0	0	109.2	I321 L336 H337 L342 L363 F365 N372 G374 T390 I391 F395	I321-Y376 HydrophobicContact CD1-CD2 3.85Å; I321-Y376 HydrophobicContact CD1-CG 3.95Å; L336-Y376 CarbonylContact O-C 3.47Å; L336-Y376 WeakPolarHBondContact O-CA 3.48Å; H337-Y376 HydrophobicContact CB-CD1 4.36Å; H337-Y376 HydrophobicContact CB-CE1 4.11Å; H337-Y376 AromaticContact CD2-CE1 3.68Å; H337-Y376 AromaticContact CD2-CE2 3.96Å; H337-Y376 AromaticContact CD2-CZ 3.56Å; H337-Y376 AromaticContact CG-CE1 3.81Å; H337-Y376 AromaticContact NE2-CZ 3.67Å; H337-Y376 PolarHBondContact NE2-OH 2.8Å; L342-Y376 HydrophobicContact CD1-CD1 3.74Å; L342-Y376 HydrophobicContact CD1-CE1 3.71Å; L363-Y376 HydrophobicContact CD2-CD1 3.52Å; L363-Y376 HydrophobicContact CD2-CE1 4.07Å; L363-Y376 HydrophobicContact CD2-CG 4.18Å; F365-Y376 AromaticContact CE1-CE1 3.74Å; F365-Y376 HydrophobicContact CE1-CE1 3.74Å; F365-Y376 HydrophobicContact CE1-CE2 4.36Å; F365-Y376 AromaticContact CE1-CZ 3.56Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.37Å; F365-Y376 HydrophobicContact CZ-CD1 4.04Å; F365-Y376 AromaticContact CZ-CE1 3.53Å; F365-Y376 HydrophobicContact CZ-CE1 3.53Å; F365-Y376 HydrophobicContact CZ-CE2 4.12Å; F365-Y376 AromaticContact CZ-CZ 3.58Å; N372-Y376 WeakPolarHBondContact O-CE2 3.36Å; N372-Y376 PolarHBondContact O-OH 2.83Å; G374-Y376 VanDerWaalsContact O-CD2 3.28Å; G374-Y376 WeakPolarHBondContact O-CD2 3.33Å; Y376-T390 CarbonylContact O-C 3.5Å; Y376-T390 VanDerWaalsContact O-CA 3.3Å; Y376-T390 WeakPolarHBondContact O-CA 3.47Å; Y376-I391 PolarHBondContact N-O 3.37Å; Y376-I391 PolarHBondContact O-N 3.35Å; Y376-F395 AromaticContact CE2-CE2 3.99Å; Y376-F395 HydrophobicContact CE2-CE2 3.99Å; Y376-F395 HydrophobicContact CE2-CZ 4.46Å
377	T	98.2	Very high	96	Very high	17 Å²	17	51.9 Å²	51.9	10%	0.104	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.3	179.7	-52.5	0	0	0	0	110.1	W335 L336 I379 N388 Q389 T390	W335-T377 CarbonylContact C-O 3.6Å; W335-T377 WeakPolarHBondContact CA-O 3.47Å; L336-T377 PolarHBondContact N-O 2.89Å; L336-T377 PolarHBondContact O-N 2.85Å; T377-I379 HydrophobicContact CG2-CG1 4.27Å; T377-N388 HydrophobicContact CG2-CB 4.18Å; T377-Q389 CarbonylContact C-O 3.44Å; T377-Q389 VanDerWaalsContact CA-O 3.32Å; T377-Q389 WeakPolarHBondContact CA-O 3.31Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.44Å; T377-T390 WeakPolarHBondContact OG1-CG2 3.36Å; T377-T390 PolarHBondContact OG1-OG1 3.37Å
378	L	98.3	Very high	96.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.1	169.3	176.5	60.1	0	0	0	109	V307 F323 V325 L333 W335 N388 Q389	V307-L378 HydrophobicContact CG1-CD2 4.27Å; F323-L378 HydrophobicContact CB-CD2 3.73Å; F323-L378 HydrophobicContact CD2-CD2 3.78Å; F323-L378 HydrophobicContact CG-CD2 3.8Å; V325-L378 HydrophobicContact CG2-CD2 3.59Å; V325-L378 HydrophobicContact CG2-CG 4.49Å; L333-L378 HydrophobicContact CB-CD1 4.21Å; L333-L378 HydrophobicContact CD2-CD1 4.35Å; W335-L378 HydrophobicContact CD2-CB 4.33Å; W335-L378 HydrophobicContact CD2-CD1 4.16Å; W335-L378 HydrophobicContact CE3-CB 4.12Å; W335-L378 HydrophobicContact CH2-CB 3.92Å; W335-L378 HydrophobicContact CZ2-CB 4.08Å; W335-L378 HydrophobicContact CZ2-CD1 3.92Å; W335-L378 HydrophobicContact CZ2-CD2 4.3Å; W335-L378 HydrophobicContact CZ2-CG 4.32Å; W335-L378 HydrophobicContact CZ3-CB 3.92Å; L378-N388 CarbonylContact O-C 3.47Å; L378-N388 WeakPolarHBondContact O-CA 3.26Å; L378-N388 VanDerWaalsContact O-CB 3.31Å; L378-N388 WeakPolarHBondContact O-CB 3.42Å; L378-Q389 PolarHBondContact N-O 2.93Å; L378-Q389 PolarHBondContact O-N 3.33Å; L378-Q389 VanDerWaalsContact O-N 3.09Å
379	I	98	Very high	96.5	Very high	37 Å²	37	51.8 Å²	51.8	19%	0.19	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.7	175.2	-57	179.2	0	0	0	108.2	L333 H334 L336 T377 T386 A387 N388	L333-I379 CarbonylContact C-O 3.54Å; L333-I379 WeakPolarHBondContact CA-O 3.34Å; H334-I379 HydrophobicContact CB-CB 4.47Å; H334-I379 PolarHBondContact N-O 2.99Å; H334-I379 PolarHBondContact O-N 2.95Å; L336-I379 HydrophobicContact CD1-CD1 3.64Å; L336-I379 HydrophobicContact CD2-CD1 4.3Å; L336-I379 HydrophobicContact CG-CD1 3.78Å; T377-I379 HydrophobicContact CG2-CG1 4.27Å; I379-T386 HydrophobicContact CG2-CG2 3.71Å; I379-A387 WeakPolarHBondContact CA-O 3.39Å; I379-N388 HydrophobicContact CG1-CB 4.04Å
380	A	98.2	Very high	96.7	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.7	175	0	0	0	0	0	110.1	P305 V325 P331 T332 L333 T386 A387	P305-A380 HydrophobicContact CB-CB 3.81Å; P305-A380 HydrophobicContact CG-CB 4.26Å; P305-A380 VanDerWaalsContact CG-O 3.25Å; P305-A380 WeakPolarHBondContact CG-O 3.37Å; V325-A380 HydrophobicContact CG1-CB 3.56Å; V325-A380 HydrophobicContact CG2-CB 4.4Å; P331-A380 HydrophobicContact CB-CB 4.15Å; P331-A380 HydrophobicContact CG-CB 4.4Å; T332-A380 WeakPolarHBondContact O-CA 3.17Å; L333-A380 HydrophobicContact CD2-CB 3.61Å; A380-T386 CarbonylContact O-C 3.49Å; A380-T386 VanDerWaalsContact O-CA 3.26Å; A380-T386 WeakPolarHBondContact O-CA 3.49Å; A380-T386 WeakPolarHBondContact O-CG2 3.1Å; A380-A387 PolarHBondContact N-O 3.03Å; A380-A387 PolarHBondContact O-N 2.77Å
381	K	97.8	Very high	97	Very high	119 Å²	119	52.1 Å²	52.1	52%	0.517	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	132.8	-177.2	-177.7	173.3	-179	-178.7	0	111.9	P331 T332 T386	P331-K381 CarbonylContact C-O 3.59Å; P331-K381 VanDerWaalsContact CA-O 3.24Å; P331-K381 WeakPolarHBondContact CA-O 3.48Å; P331-K381 WeakPolarHBondContact CB-O 3.37Å; T332-K381 PolarHBondContact N-O 2.8Å; T332-K381 PolarHBondContact O-N 3.44Å; T332-K381 PolarHBondContact OG1-O 2.83Å; K381-T386 HydrophobicContact CB-CG2 4.35Å
382	N	97.4	Very high	97.2	Very high	12 Å²	12	47.6 Å²	47.6	6%	0.064	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	178.3	166.7	82.6	-1.3	0	0	0	109.8	Y303 P305 P329 P331 L384 G385	Y303-N382 PolarHBondContact O-ND2 3.46Å; P305-N382 VanDerWaalsContact CD-OD1 3.27Å; P305-N382 WeakPolarHBondContact CD-OD1 3.35Å; P329-N382 WeakPolarHBondContact O-CB 3.48Å; P329-N382 PolarHBondContact O-ND2 3.35Å; P331-N382 HydrophobicContact CB-CB 4.28Å; N382-L384 PolarHBondContact O-N 2.67Å; N382-L384 VanDerWaalsContact O-N 3.11Å; N382-L384 WeakPolarHBondContact OD1-CA 3.23Å; N382-L384 WeakPolarHBondContact OD1-CB 3.39Å; N382-L384 PolarHBondContact OD1-N 3.03Å; N382-G385 PolarHBondContact N-O 2.75Å; N382-G385 PolarHBondContact O-N 3.48Å; N382-G385 PolarHBondContact OD1-N 2.73Å; N382-G385 VanDerWaalsContact OD1-N 3.15Å
383	P	97.5	Very high	97.2	Very high	116 Å²	116	46.7 Å²	46.7	75%	0.753	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.3	-179.9	-26.8	36.5	0	0	0	115.4
384	L	96.8	Very high	97.1	Very high	50 Å²	50	49.5 Å²	49.5	26%	0.262	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-15.5	-177.5	-65	-175.8	0	0	0	113.9	R222 Y302 Y303 P304 N382	R222-L384 HydrophobicContact CG-CD1 4.36Å; Y302-L384 VanDerWaalsContact C-CD1 3.4Å; Y303-L384 VanDerWaalsContact N-CD1 3.33Å; P304-L384 HydrophobicContact CB-CB 4.23Å; N382-L384 PolarHBondContact O-N 2.67Å; N382-L384 VanDerWaalsContact O-N 3.11Å; N382-L384 WeakPolarHBondContact OD1-CA 3.23Å; N382-L384 WeakPolarHBondContact OD1-CB 3.39Å; N382-L384 PolarHBondContact OD1-N 3.03Å
385	G	96.4	Very high	97	Very high	25 Å²	25	49.8 Å²	49.8	26%	0.258	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-167.9	179.8	0	0	0	0	0	114.8	N382	N382-G385 PolarHBondContact N-O 2.75Å; N382-G385 PolarHBondContact O-N 3.48Å; N382-G385 PolarHBondContact OD1-N 2.73Å; N382-G385 VanDerWaalsContact OD1-N 3.15Å
386	T	97.8	Very high	96.6	Very high	82 Å²	82	50.4 Å²	50.4	50%	0.503	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	137.3	179.4	-55.5	0	0	0	0	108.5	I379 A380 K381	I379-T386 HydrophobicContact CG2-CG2 3.71Å; A380-T386 CarbonylContact O-C 3.49Å; A380-T386 VanDerWaalsContact O-CA 3.26Å; A380-T386 WeakPolarHBondContact O-CA 3.49Å; A380-T386 WeakPolarHBondContact O-CG2 3.1Å; K381-T386 HydrophobicContact CB-CG2 4.35Å
387	A	97.9	Very high	96.2	Very high	20 Å²	20	58.7 Å²	58.7	17%	0.165	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.2	172.3	0	0	0	0	0	109.3	P305 V307 I379 A380	P305-A387 HydrophobicContact CB-CB 4.39Å; P305-A387 HydrophobicContact CG-CB 4.27Å; P305-A387 WeakPolarHBondContact O-CB 3.19Å; V307-A387 HydrophobicContact CG2-CB 4.33Å; I379-A387 WeakPolarHBondContact CA-O 3.39Å; A380-A387 PolarHBondContact N-O 3.03Å; A380-A387 PolarHBondContact O-N 2.77Å
388	N	97.3	Very high	95.6	Very high	108 Å²	108	63.6 Å²	63.6	58%	0.578	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.3	173.9	59.8	24.2	0	0	0	111	T377 L378 I379	T377-N388 HydrophobicContact CG2-CB 4.18Å; L378-N388 CarbonylContact O-C 3.47Å; L378-N388 WeakPolarHBondContact O-CA 3.26Å; L378-N388 VanDerWaalsContact O-CB 3.31Å; L378-N388 WeakPolarHBondContact O-CB 3.42Å; I379-N388 HydrophobicContact CG1-CB 4.04Å
389	Q	97.9	Very high	94.6	Very high	77 Å²	77	67.6 Å²	67.6	36%	0.36	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	141.8	173.6	-167.7	174.2	-0.1	0	0	108.7	V307 L310 T377 L378	V307-Q389 HydrophobicContact CB-CB 4.1Å; V307-Q389 HydrophobicContact CG1-CB 4.03Å; V307-Q389 HydrophobicContact CG2-CB 4.16Å; L310-Q389 HydrophobicContact CB-CG 4.3Å; L310-Q389 HydrophobicContact CD2-CB 3.86Å; L310-Q389 HydrophobicContact CD2-CG 3.84Å; L310-Q389 WeakPolarHBondContact CD2-O 3.5Å; T377-Q389 CarbonylContact C-O 3.44Å; T377-Q389 VanDerWaalsContact CA-O 3.32Å; T377-Q389 WeakPolarHBondContact CA-O 3.31Å; L378-Q389 PolarHBondContact N-O 2.93Å; L378-Q389 PolarHBondContact O-N 3.33Å; L378-Q389 VanDerWaalsContact O-N 3.09Å
390	T	97.9	Very high	93.5	Very high	75 Å²	75	73.8 Å²	73.8	46%	0.46	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	138.6	-177.5	-54.4	0	0	0	0	110	N375 Y376 T377	N375-T390 HydrophobicContact CB-CG2 3.81Å; Y376-T390 CarbonylContact O-C 3.5Å; Y376-T390 VanDerWaalsContact O-CA 3.3Å; Y376-T390 WeakPolarHBondContact O-CA 3.47Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.44Å; T377-T390 WeakPolarHBondContact OG1-CG2 3.36Å; T377-T390 PolarHBondContact OG1-OG1 3.37Å
391	I	97.4	Very high	92	Very high	25 Å²	25	78.6 Å²	78.6	13%	0.128	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.4	172	-165.3	141.1	0	0	0	110.6	L310 E311 E312 I321 N375 Y376 G393	L310-I391 HydrophobicContact CD1-CG2 4.2Å; L310-I391 HydrophobicContact CD2-CB 3.85Å; L310-I391 HydrophobicContact CD2-CG2 3.82Å; L310-I391 HydrophobicContact CG-CB 4.01Å; L310-I391 HydrophobicContact CG-CD1 4.45Å; L310-I391 HydrophobicContact CG-CG2 3.82Å; L310-I391 VanDerWaalsContact O-CD1 3.22Å; L310-I391 WeakPolarHBondContact O-CD1 3.45Å; E311-I391 WeakPolarHBondContact O-CD1 3.5Å; E312-I391 HydrophobicContact CG-CD1 3.98Å; E312-I391 HydrophobicContact CG-CG1 4.38Å; I321-I391 HydrophobicContact CD1-CG2 4.3Å; I321-I391 HydrophobicContact CG2-CG2 3.87Å; N375-I391 WeakPolarHBondContact CA-O 3.26Å; Y376-I391 PolarHBondContact N-O 3.37Å; Y376-I391 PolarHBondContact O-N 3.35Å; I391-G393 PolarHBondContact O-N 2.84Å
392	N	96.1	Very high	90.3	Very high	89 Å²	89	79.3 Å²	79.3	48%	0.476	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	109.6	174.1	-178.1	37	0	0	0	109.3	G374 H394	G374-N392 PolarHBondContact O-OD1 3.42Å; N392-H394 PolarHBondContact O-N 2.74Å
393	G	94.3	Very high	88.4	Confident	0 Å²	0	85.2 Å²	85.2	0%	0	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	107.5	172.6	0	0	0	0	0	109.4	N373 G374 I391	N373-G393 WeakPolarHBondContact CA-O 3.39Å; G374-G393 PolarHBondContact N-O 2.74Å; G374-G393 VanDerWaalsContact N-O 3.08Å; G374-G393 PolarHBondContact O-N 3.4Å; I391-G393 PolarHBondContact O-N 2.84Å
394	H	93.5	Very high	86.2	Confident	97 Å²	97	88.6 Å²	88.6	45%	0.449	47%	0.47	S	S	.	.			trans	-113	115.7	174.9	174.7	-77.1	0	0	0	110.4	N392	N392-H394 PolarHBondContact O-N 2.74Å
395	F	92.8	Very high	83.9	Confident	16 Å²	16	93 Å²	93	7%	0.07	50%	0.499	C	S	.	.			trans	-107.8	-51.6	-173.4	-57.4	-77.7	0	0	0	113	P313 H319 I321 F365 P368 N372 N373 Y376	P313-F395 HydrophobicContact CB-CD1 4.15Å; P313-F395 HydrophobicContact CB-CE1 3.51Å; P313-F395 HydrophobicContact CB-CZ 4.09Å; P313-F395 HydrophobicContact CG-CD1 4.44Å; P313-F395 HydrophobicContact CG-CE1 4.05Å; P313-F395 HydrophobicContact CG-CZ 4.37Å; H319-F395 HydrophobicContact CB-CD1 3.98Å; H319-F395 HydrophobicContact CB-CE1 3.75Å; H319-F395 AromaticContact CD2-CD1 3.74Å; H319-F395 AromaticContact CG-CD1 3.83Å; I321-F395 HydrophobicContact CD1-CZ 4.47Å; F365-F395 HydrophobicContact CB-CE1 4.17Å; F365-F395 HydrophobicContact CB-CZ 4.47Å; F365-F395 HydrophobicContact CD1-CE1 4.15Å; F365-F395 HydrophobicContact CD1-CE2 4.07Å; F365-F395 AromaticContact CD1-CZ 3.61Å; F365-F395 HydrophobicContact CD1-CZ 3.61Å; F365-F395 AromaticContact CD2-CE1 3.76Å; F365-F395 HydrophobicContact CD2-CE1 3.76Å; F365-F395 AromaticContact CD2-CZ 3.62Å; F365-F395 HydrophobicContact CD2-CZ 3.62Å; F365-F395 AromaticContact CE1-CE2 3.93Å; F365-F395 HydrophobicContact CE1-CE2 3.93Å; F365-F395 AromaticContact CE1-CZ 3.6Å; F365-F395 HydrophobicContact CE1-CZ 3.6Å; F365-F395 HydrophobicContact CE2-CE1 4.17Å; F365-F395 AromaticContact CE2-CZ 3.6Å; F365-F395 HydrophobicContact CE2-CZ 3.6Å; F365-F395 AromaticContact CG-CE1 3.77Å; F365-F395 HydrophobicContact CG-CE1 3.77Å; F365-F395 HydrophobicContact CG-CE2 4.5Å; F365-F395 AromaticContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CZ-CE2 4.22Å; F365-F395 AromaticContact CZ-CZ 3.59Å; F365-F395 HydrophobicContact CZ-CZ 3.59Å; P368-F395 HydrophobicContact CB-CB 3.88Å; P368-F395 HydrophobicContact CB-CD1 3.8Å; P368-F395 HydrophobicContact CB-CD2 4.03Å; P368-F395 HydrophobicContact CB-CE1 4.34Å; P368-F395 HydrophobicContact CB-CG 3.61Å; P368-F395 HydrophobicContact CG-CB 3.79Å; P368-F395 HydrophobicContact CG-CD1 3.29Å; P368-F395 HydrophobicContact CG-CD2 4.43Å; P368-F395 HydrophobicContact CG-CE1 3.94Å; P368-F395 HydrophobicContact CG-CG 3.57Å; N372-F395 HydrophobicContact CB-CD2 3.83Å; N372-F395 HydrophobicContact CB-CE2 4.04Å; N372-F395 VanDerWaalsContact O-CE2 3.25Å; N372-F395 WeakPolarHBondContact O-CE2 3.36Å; N373-F395 PolarHBondContact OD1-N 3.44Å; Y376-F395 AromaticContact CE2-CE2 3.99Å; Y376-F395 HydrophobicContact CE2-CE2 3.99Å; Y376-F395 HydrophobicContact CE2-CZ 4.46Å
396	L	90	Very high	81.5	Confident	93 Å²	93	96.7 Å²	96.7	49%	0.487	52%	0.52	S	S	.	.	S	Bend	trans	-141.2	149.1	179.9	-74.9	179.4	0	0	0	110.8	H370 N373	H370-L396 VanDerWaalsContact CB-O 3.31Å; H370-L396 WeakPolarHBondContact CB-O 3.27Å; N373-L396 PolarHBondContact ND2-O 3.41Å
397	K	88.9	Confident	79.2	Confident	175 Å²	175	98.2 Å²	98.2	76%	0.761	53%	0.531	S	S	*	.			trans	-72.8	146.6	173.7	-67.2	-175.8	179.9	-178.7	0	110.8
398	E	85.6	Confident	76.7	Confident	120 Å²	120	103.8 Å²	103.8	56%	0.561	56%	0.563	S	S	*	*			trans	-64.2	135.8	172	-66.1	-172.1	167.1	0	0	110.4	H370 F400	H370-E398 HydrophobicContact CB-CG 3.95Å; E398-F400 VanDerWaalsContact C-N 3.27Å; E398-F400 PolarHBondContact O-N 3.17Å
399	P	77.7	Confident	74.3	Confident	84 Å²	84	103.7 Å²	103.7	55%	0.545	57%	0.569	S	S	.	*	S	Bend	trans	-69.7	-19.7	-174	22	-29.2	0	0	0	114.1
400	F	74.3	Confident	71.8	Confident	167 Å²	167	105.9 Å²	105.9	73%	0.732	59%	0.59	S	S	*	*	S	Bend	trans	-149	132.4	175	-56.5	-77.6	0	0	0	110.7	E398 V402	E398-F400 VanDerWaalsContact C-N 3.27Å; E398-F400 PolarHBondContact O-N 3.17Å; F400-V402 PolarHBondContact O-N 2.75Å
401	P	67.1	Low	69.5	Low	101 Å²	101	110 Å²	110	66%	0.656	61%	0.607	S	S	*	*			trans	-62.3	133.3	167	23.8	-26.3	0	0	0	108.6	D403	P401-D403 PolarHBondContact O-N 2.95Å
402	V	61.7	Low	66.6	Low	134 Å²	134	115.1 Å²	115.1	81%	0.812	64%	0.64	S	S	*	*			trans	-71.3	81.8	173.4	-173.4	0	0	0	0	107.5	F400 E404	F400-V402 PolarHBondContact O-N 2.75Å; V402-E404 PolarHBondContact O-N 2.83Å
403	D	57.3	Low	64.2	Low	136 Å²	136	116.6 Å²	116.6	73%	0.727	65%	0.652	S	S	*	*			trans	-65.6	122.8	168.1	-76.7	-33.2	0	0	0	108	P401 V405	P401-D403 PolarHBondContact O-N 2.95Å; D403-V405 PolarHBondContact O-N 2.8Å
404	E	51.9	Low	61.4	Low	187 Å²	187	123.2 Å²	123.2	87%	0.874	69%	0.692	S	S	*	*			trans	-49.7	125.4	173.9	-71.2	-178.1	154.9	0	0	109.9	V402 S406	V402-E404 PolarHBondContact O-N 2.83Å; E404-S406 PolarHBondContact O-N 3.35Å
405	V	48.6	Very low	58.7	Low	143 Å²	143	127 Å²	127	87%	0.867	71%	0.71	S	S	*	*			trans	-63.8	95.5	175.3	178.9	0	0	0	0	108.8	D403	D403-V405 PolarHBondContact O-N 2.8Å
406	S	44.6	Very low	56.4	Low	101 Å²	101	135.5 Å²	135.5	71%	0.706	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-71.8	130.5	166.9	-178.6	0	0	0	0	109.4	E404 T408	E404-S406 PolarHBondContact O-N 3.35Å; S406-T408 PolarHBondContact O-N 2.95Å
407	P	49.8	Very low	54.3	Low	114 Å²	114	136.1 Å²	136.1	74%	0.74	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-72	129.5	179.5	27.8	-30.8	0	0	0	110.9
408	T	46.4	Very low	51.9	Low	137 Å²	137	136.1 Å²	136.1	84%	0.84	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-62.4	130.6	178.4	-28.7	0	0	0	0	111.7	S406	S406-T408 PolarHBondContact O-N 2.95Å
409	P	46.7	Very low	50.3	Low	107 Å²	107	139.2 Å²	139.2	70%	0.695	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-85.4	154.3	167.1	32.5	-29.4	0	0	0	111.4
410	P	45.5	Very low	48.6	Very low	122 Å²	122	142.5 Å²	142.5	79%	0.792	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-81.1	153.9	-174.4	33.3	-32.9	0	0	0	112.7
411	I	48.2	Very low	47.7	Very low	162 Å²	162	140.6 Å²	140.6	83%	0.831	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.5	125.3	-178	-58.9	162.1	0	0	0	110.6
412	T	36.6	Very low	46.9	Very low	133 Å²	133	144.7 Å²	144.7	82%	0.816	80%	0.796	S	S	*	*			trans	-132.5	125.1	157.5	40.8	0	0	0	0	111.2
413	V	46.7	Very low	46.5	Very low	120 Å²	120	140.9 Å²	140.9	73%	0.727	79%	0.785	S	S	*	*			trans	-72.4	136.7	177.3	175.3	0	0	0	0	110.3
414	T	36.4	Very low	46.3	Very low	139 Å²	139	139.3 Å²	139.3	85%	0.853	78%	0.78	S	S	*	*			trans	-154.3	147.4	153.6	8.9	0	0	0	0	112.2
415	H	36.3	Very low	46.6	Very low	177 Å²	177	135.6 Å²	135.6	82%	0.819	77%	0.774	S	S	*	*			trans	-71.8	159.3	-163.7	-88.2	-110.7	0	0	0	117.4
416	K	43.8	Very low	47	Very low	194 Å²	194	134.6 Å²	134.6	84%	0.843	76%	0.763	S	S	*	*			trans	-53.2	140.1	163.6	-161	-170.3	177.4	179.6	0	112.6
417	P	45.3	Very low	47.7	Very low	106 Å²	106	132.8 Å²	132.8	69%	0.688	75%	0.754	S	S	*	*				-144.7	179.9	101.4	36.4	-19.1	0	0	0	110.3
418	E	39.5	Very low	48.4	Very low	174 Å²	174	132 Å²	132	81%	0.813	75%	0.747	S	S	*	*			cis	-158.6	149.6	-16	-113.7	170.1	160.1	0	0	103.7
419	E	51.4	Low	49.2	Very low	186 Å²	186	127.7 Å²	127.7	87%	0.869	73%	0.729	S	S	*	*			trans	-78.4	120	178.1	-71.4	178.9	151.9	0	0	110.7
420	D	42.3	Very low	50.2	Low	153 Å²	153	128.3 Å²	128.3	82%	0.818	73%	0.726	S	S	*	*			trans	-106.4	114.4	164.5	-85.2	-29	0	0	0	111.3	F422	D420-F422 PolarHBondContact O-N 3.17Å
421	T	55.8	Low	51.2	Low	126 Å²	126	125.3 Å²	125.3	77%	0.773	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	35.4	-172	-30.5	0	0	0	0	113.9
422	F	50.1	Low	52.3	Low	187 Å²	187	120.4 Å²	120.4	82%	0.82	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-5.9	-171.8	-109.8	-89.3	0	0	0	116	D420	D420-F422 PolarHBondContact O-N 3.17Å
423	G	52.9	Low	54.1	Low	55 Å²	55	121 Å²	121	57%	0.567	69%	0.687	S	S	*	*	S	Bend	trans	-84.8	-15.9	-177.3	0	0	0	0	0	116.2
424	V	54.5	Low	55.6	Low	103 Å²	103	117.6 Å²	117.6	62%	0.624	67%	0.672	S	S	*	*	H	α-helix	trans	-82.7	-24.1	-166.7	-174	0	0	0	0	113	V428	V424-V428 WeakPolarHBondContact O-CG2 3.32Å
425	S	56.5	Low	57.5	Low	108 Å²	108	115 Å²	115	76%	0.755	66%	0.659	S	S	*	*	H	α-helix	trans	-78.9	-26.4	-179.7	-80	0	0	0	0	114.5	G429	S425-G429 PolarHBondContact O-N 3.35Å
426	I	58.5	Low	59.6	Low	122 Å²	122	111.1 Å²	111.1	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-80.2	-37.2	-178.3	-61.7	174.9	0	0	0	110.9	G429 L430	I426-G429 PolarHBondContact O-N 2.85Å; I426-L430 HydrophobicContact CG2-CD1 4.06Å; I426-L430 WeakPolarHBondContact O-CG 3.34Å; I426-L430 PolarHBondContact O-N 2.8Å; I426-L430 VanDerWaalsContact O-N 3.15Å
427	A	58.5	Low	61.2	Low	63 Å²	63	106.2 Å²	106.2	52%	0.521	63%	0.629	S	S	.	*	H	α-helix	trans	-67.3	-37.9	179	0	0	0	0	0	112.7	A431	A427-A431 PolarHBondContact O-N 3.15Å; A427-A431 VanDerWaalsContact O-N 3.17Å
428	V	63.5	Low	63	Low	99 Å²	99	107 Å²	107	60%	0.6	63%	0.627	S	S	*	*	H	α-helix	trans	-71.6	-34.3	178.7	-179.7	0	0	0	0	111.4	V424 A432	V424-V428 WeakPolarHBondContact O-CG2 3.32Å; V428-A432 PolarHBondContact O-N 3.4Å
429	G	63.3	Low	65	Low	45 Å²	45	103.2 Å²	103.2	46%	0.464	62%	0.616	S	S	.	*	H	α-helix	trans	-67	-40.7	174.5	0	0	0	0	0	113.7	S425 I426 F433	S425-G429 PolarHBondContact O-N 3.35Å; I426-G429 PolarHBondContact O-N 2.85Å; G429-F433 PolarHBondContact O-N 3.46Å
430	L	67.9	Low	66.3	Low	120 Å²	120	98.4 Å²	98.4	63%	0.628	60%	0.599	S	S	*	*	H	α-helix	trans	-71.1	-35.9	179.3	-70.9	171.6	0	0	0	112.6	I426 F433 A434	I426-L430 HydrophobicContact CG2-CD1 4.06Å; I426-L430 WeakPolarHBondContact O-CG 3.34Å; I426-L430 PolarHBondContact O-N 2.8Å; I426-L430 VanDerWaalsContact O-N 3.15Å; L430-F433 PolarHBondContact O-N 3.13Å; L430-A434 PolarHBondContact O-N 3.34Å; L430-A434 VanDerWaalsContact O-N 3.1Å
431	A	67.4	Low	67.9	Low	60 Å²	60	95.7 Å²	95.7	50%	0.496	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-39.2	176.2	0	0	0	0	0	112.3	A427 A434 C435	A427-A431 PolarHBondContact O-N 3.15Å; A427-A431 VanDerWaalsContact O-N 3.17Å; A431-A434 PolarHBondContact O-N 2.7Å; A431-C435 PolarHBondContact O-N 2.81Å; A431-C435 VanDerWaalsContact O-N 3.14Å
432	A	71.1	Confident	68.9	Low	59 Å²	59	96.3 Å²	96.3	49%	0.488	58%	0.576	S	S	.	*	H	α-helix	trans	-64.7	-39.6	176	0	0	0	0	0	112	V428 C435 V436	V428-A432 PolarHBondContact O-N 3.4Å; A432-C435 PolarHBondContact O-N 3.24Å; A432-V436 WeakPolarHBondContact O-CG2 3.43Å; A432-V436 PolarHBondContact O-N 2.93Å
433	F	74.6	Confident	70.2	Confident	144 Å²	144	91.1 Å²	91.1	63%	0.632	56%	0.56	S	S	*	*	H	α-helix	trans	-67.8	-39.7	178.4	-162.7	-98	0	0	0	112.6	G429 L430 V436 L437	G429-F433 PolarHBondContact O-N 3.46Å; L430-F433 PolarHBondContact O-N 3.13Å; F433-V436 PolarHBondContact O-N 2.76Å; F433-L437 HydrophobicContact CD1-CD1 3.91Å; F433-L437 HydrophobicContact CE1-CD1 3.65Å; F433-L437 PolarHBondContact O-N 3.35Å; F433-L437 VanDerWaalsContact O-N 3.09Å
434	A	77.4	Confident	71.1	Confident	50 Å²	50	93.6 Å²	93.6	41%	0.413	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-40.1	176	0	0	0	0	0	112.4	L430 A431 L437 L438	L430-A434 PolarHBondContact O-N 3.34Å; L430-A434 VanDerWaalsContact O-N 3.1Å; A431-A434 PolarHBondContact O-N 2.7Å; A434-L437 PolarHBondContact O-N 3.38Å; A434-L438 WeakPolarHBondContact O-CG 3.5Å; A434-L438 PolarHBondContact O-N 2.94Å
435	C	76.3	Confident	71.9	Confident	85 Å²	85	93.8 Å²	93.8	57%	0.574	55%	0.554	S	S	*	*	H	α-helix	trans	-63.7	-41.3	175.8	-88.2	0	0	0	0	112.5	A431 A432 L437 L438 V439	A431-C435 PolarHBondContact O-N 2.81Å; A431-C435 VanDerWaalsContact O-N 3.14Å; A432-C435 PolarHBondContact O-N 3.24Å; C435-L437 VanDerWaalsContact C-N 3.35Å; C435-L438 PolarHBondContact O-N 2.74Å; C435-V439 WeakPolarHBondContact O-CG2 3.06Å; C435-V439 PolarHBondContact O-N 2.03Å; C435-V439 VanDerWaalsContact O-N 3.16Å
436	V	80.8	Confident	72.5	Confident	95 Å²	95	93.7 Å²	93.7	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-65	-40.6	177	175.2	0	0	0	0	111	A432 F433 L438 V439 V440	A432-V436 WeakPolarHBondContact O-CG2 3.43Å; A432-V436 PolarHBondContact O-N 2.93Å; F433-V436 PolarHBondContact O-N 2.76Å; V436-L438 PolarHBondContact O-N 3.21Å; V436-V439 PolarHBondContact O-N 2.91Å; V436-V440 WeakPolarHBondContact O-CG2 3.36Å; V436-V440 PolarHBondContact O-N 3.44Å; V436-V440 VanDerWaalsContact O-N 3.09Å
437	L	77.6	Confident	72.8	Confident	90 Å²	90	95.1 Å²	95.1	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-61.1	-42.8	176.4	-105.5	162.3	0	0	0	112.6	F433 A434 C435 V440 L441	F433-L437 HydrophobicContact CD1-CD1 3.91Å; F433-L437 HydrophobicContact CE1-CD1 3.65Å; F433-L437 PolarHBondContact O-N 3.35Å; F433-L437 VanDerWaalsContact O-N 3.09Å; A434-L437 PolarHBondContact O-N 3.38Å; C435-L437 VanDerWaalsContact C-N 3.35Å; L437-V440 PolarHBondContact O-N 2.04Å; L437-L441 WeakPolarHBondContact O-CB 3.45Å; L437-L441 PolarHBondContact O-N 3.4Å
438	L	82.1	Confident	72.9	Confident	122 Å²	122	99.9 Å²	99.9	64%	0.639	55%	0.553	S	S	*	*	H	α-helix	trans	-67.1	-36.2	178.7	-72.4	175.1	0	0	0	112.6	A434 C435 V436 L441 F442	A434-L438 WeakPolarHBondContact O-CG 3.5Å; A434-L438 PolarHBondContact O-N 2.94Å; C435-L438 PolarHBondContact O-N 2.74Å; V436-L438 PolarHBondContact O-N 3.21Å; L438-L441 PolarHBondContact O-N 3.25Å; L438-F442 WeakPolarHBondContact O-CB 3.05Å; L438-F442 PolarHBondContact O-N 2.82Å
439	V	81.9	Confident	72.7	Confident	95 Å²	95	98 Å²	98	58%	0.576	55%	0.554	S	S	*	*	H	α-helix	trans	-66.7	-41.4	175.4	174.7	0	0	0	0	111.1	C435 V436 L441 F442 V443	C435-V439 WeakPolarHBondContact O-CG2 3.06Å; C435-V439 PolarHBondContact O-N 2.03Å; C435-V439 VanDerWaalsContact O-N 3.16Å; V436-V439 PolarHBondContact O-N 2.91Å; V439-L441 VanDerWaalsContact C-N 3.35Å; V439-L441 PolarHBondContact O-N 2.91Å; V439-F442 PolarHBondContact O-N 3.08Å; V439-V443 WeakPolarHBondContact O-CG2 3.43Å; V439-V443 PolarHBondContact O-N 3.07Å
440	V	79.8	Confident	72.4	Confident	85 Å²	85	107.4 Å²	107.4	52%	0.515	58%	0.575	S	S	.	*	H	α-helix	trans	-63.3	-42.2	175.6	173.3	0	0	0	0	111.1	V436 L437 V443 M444	V436-V440 WeakPolarHBondContact O-CG2 3.36Å; V436-V440 PolarHBondContact O-N 3.44Å; V436-V440 VanDerWaalsContact O-N 3.09Å; L437-V440 PolarHBondContact O-N 2.04Å; V440-V443 PolarHBondContact O-N 3.16Å; V440-M444 WeakPolarHBondContact O-CG 3.06Å; V440-M444 PolarHBondContact O-N 3.45Å
441	L	75.1	Confident	71.8	Confident	96 Å²	96	113 Å²	113	50%	0.503	59%	0.588	S	S	.	*	H	α-helix	trans	-65.4	-39.9	178.4	-131.8	130.7	0	0	0	111.7	L437 L438 V439 V443 M444 I445	L437-L441 WeakPolarHBondContact O-CB 3.45Å; L437-L441 PolarHBondContact O-N 3.4Å; L438-L441 PolarHBondContact O-N 3.25Å; V439-L441 VanDerWaalsContact C-N 3.35Å; V439-L441 PolarHBondContact O-N 2.91Å; L441-V443 PolarHBondContact O-N 2.87Å; L441-M444 PolarHBondContact O-N 3.26Å; L441-I445 HydrophobicContact CD2-CD1 3.81Å; L441-I445 WeakPolarHBondContact O-CG1 3.49Å; L441-I445 PolarHBondContact O-N 3.21Å
442	F	77.6	Confident	70.8	Confident	139 Å²	139	115.3 Å²	115.3	61%	0.61	60%	0.6	S	S	*	*	H	α-helix	trans	-63.8	-39.2	175.1	-174.3	-100.1	0	0	0	112.5	L438 V439 N446	L438-F442 WeakPolarHBondContact O-CB 3.05Å; L438-F442 PolarHBondContact O-N 2.82Å; V439-F442 PolarHBondContact O-N 3.08Å; F442-N446 WeakPolarHBondContact CE1-ND2 3.04Å; F442-N446 WeakPolarHBondContact CE2-ND2 3.39Å; F442-N446 WeakPolarHBondContact CZ-ND2 3.4Å; F442-N446 WeakPolarHBondContact O-CB 3.04Å; F442-N446 PolarHBondContact O-N 2.74Å; F442-N446 VanDerWaalsContact O-N 3.08Å; F442-N446 PolarHBondContact O-ND2 3.32Å
443	V	76.3	Confident	69.9	Low	79 Å²	79	122.5 Å²	122.5	48%	0.479	62%	0.62	S	S	.	*	H	α-helix	trans	-67.8	-39.7	174.7	173.6	0	0	0	0	111.3	V439 V440 L441 N446 K447	V439-V443 WeakPolarHBondContact O-CG2 3.43Å; V439-V443 PolarHBondContact O-N 3.07Å; V440-V443 PolarHBondContact O-N 3.16Å; L441-V443 PolarHBondContact O-N 2.87Å; V443-N446 PolarHBondContact O-N 2.79Å; V443-K447 WeakPolarHBondContact O-CB 3.29Å; V443-K447 PolarHBondContact O-N 2.96Å
444	M	72.4	Confident	68.5	Low	107 Å²	107	124.8 Å²	124.8	53%	0.527	63%	0.63	S	S	.	*	H	α-helix	trans	-66.4	-41.8	177.8	-72.2	-70.1	-93.5	0	0	112.3	V440 L441 K447 Y448	V440-M444 WeakPolarHBondContact O-CG 3.06Å; V440-M444 PolarHBondContact O-N 3.45Å; L441-M444 PolarHBondContact O-N 3.26Å; M444-K447 PolarHBondContact O-N 3.18Å; M444-Y448 PolarHBondContact O-N 3.01Å; M444-Y448 HydrophobicContact SD-CD2 4.07Å; M444-Y448 HydrophobicContact SD-CE2 3.92Å
445	I	70.9	Confident	66.8	Low	106 Å²	106	126.2 Å²	126.2	54%	0.544	65%	0.649	S	S	.	*	H	α-helix	trans	-64.5	-42.3	176.5	-69.1	169.8	0	0	0	110.8	L441 G449	L441-I445 HydrophobicContact CD2-CD1 3.81Å; L441-I445 WeakPolarHBondContact O-CG1 3.49Å; L441-I445 PolarHBondContact O-N 3.21Å; I445-G449 VanDerWaalsContact O-CA 3.27Å; I445-G449 WeakPolarHBondContact O-CA 3.22Å; I445-G449 PolarHBondContact O-N 3.39Å
446	N	68.4	Low	65.1	Low	107 Å²	107	131.4 Å²	131.4	57%	0.572	67%	0.668	S	S	*	*	H	α-helix	trans	-77.4	-27.1	-179.8	-76.8	-41.8	0	0	0	114	F442 V443	F442-N446 WeakPolarHBondContact CE1-ND2 3.04Å; F442-N446 WeakPolarHBondContact CE2-ND2 3.39Å; F442-N446 WeakPolarHBondContact CZ-ND2 3.4Å; F442-N446 WeakPolarHBondContact O-CB 3.04Å; F442-N446 PolarHBondContact O-N 2.74Å; F442-N446 VanDerWaalsContact O-N 3.08Å; F442-N446 PolarHBondContact O-ND2 3.32Å; V443-N446 PolarHBondContact O-N 2.79Å
447	K	66.2	Low	63.1	Low	151 Å²	151	137.2 Å²	137.2	66%	0.657	69%	0.685	S	S	*	*	H	α-helix	trans	-85.8	-26.1	-179.8	-166.4	173.2	-179.2	178.8	0	113.5	V443 M444	V443-K447 WeakPolarHBondContact O-CB 3.29Å; V443-K447 PolarHBondContact O-N 2.96Å; M444-K447 PolarHBondContact O-N 3.18Å
448	Y	60.5	Low	61.2	Low	164 Å²	164	136.4 Å²	136.4	64%	0.643	70%	0.698	S	S	*	*	H	α-helix	trans	-118.6	-3.3	-178.5	-66.9	-80.4	0	0	0	114.9	M444 R450	M444-Y448 PolarHBondContact O-N 3.01Å; M444-Y448 HydrophobicContact SD-CD2 4.07Å; M444-Y448 HydrophobicContact SD-CE2 3.92Å; Y448-R450 VanDerWaalsContact C-N 3.28Å; Y448-R450 PolarHBondContact O-N 2.76Å
449	G	58.5	Low	59.5	Low	60 Å²	60	136.4 Å²	136.4	62%	0.619	71%	0.705	S	S	*	*			trans	-77.2	8.8	-178	0	0	0	0	0	117.1	I445	I445-G449 VanDerWaalsContact O-CA 3.27Å; I445-G449 WeakPolarHBondContact O-CA 3.22Å; I445-G449 PolarHBondContact O-N 3.39Å
450	R	57	Low	57.2	Low	242 Å²	242	137.6 Å²	137.6	91%	0.913	71%	0.713	S	S	*	*	S	Bend	trans	-113.4	66.1	172	-84.2	-171.2	176.8	178.9	0.6	111.4	Y448	Y448-R450 VanDerWaalsContact C-N 3.28Å; Y448-R450 PolarHBondContact O-N 2.76Å
451	R	54.8	Low	54.9	Low	238 Å²	238	138.2 Å²	138.2	90%	0.898	73%	0.727	S	S	*	*	S	Bend	trans	173.7	99.8	144.8	-98	171.9	-164.3	-160.4	5.8	109.6
452	S	47.8	Very low	52.7	Low	107 Å²	107	140 Å²	140	75%	0.748	74%	0.741	S	S	*	*				162	120.5	124	61.6	0	0	0	0	110.2
453	K	51.8	Low	50.7	Low	211 Å²	211	140.9 Å²	140.9	92%	0.917	75%	0.751	S	S	*	*			trans	-81.9	110.2	153.6	-85.5	-178.4	173.4	179.6	0	105.7
454	F	44.3	Very low	48.5	Very low	192 Å²	192	143 Å²	143	84%	0.842	77%	0.769	S	S	*	*			trans	-126.6	108.8	157.5	-96.4	-80.5	0	0	0	107.8
455	G	42.9	Very low	46.4	Very low	79 Å²	79	140.5 Å²	140.5	81%	0.814	77%	0.771	S	S	*	*			trans	-79.3	130.1	167.5	0	0	0	0	0	109.2
456	M	39.6	Very low	44.5	Very low	195 Å²	195	144 Å²	144	96%	0.961	79%	0.785	S	S	*	*			trans	-89.5	111	167.4	-81.4	172.4	59.4	0	0	109.3
457	K	38.9	Very low	42.7	Very low	217 Å²	217	147 Å²	147	94%	0.943	80%	0.795	S	S	*	*			trans	-109	130.1	144.2	-94	-176.3	175.3	-179.7	0	106.5
458	G	38.9	Very low	40.9	Very low	72 Å²	72	147 Å²	147	74%	0.742	80%	0.803	S	S	*	*			trans	-132	170.3	164.4	0	0	0	0	0	110
459	P	46.4	Very low	39.5	Very low	122 Å²	122	144.3 Å²	144.3	79%	0.792	81%	0.808	S	S	*	*			cis	-122.3	136.4	3.7	30.1	-11.1	0	0	0	115.4
460	V	32.7	Very low	38.1	Very low	121 Å²	121	145.9 Å²	145.9	73%	0.733	82%	0.815	S	S	*	*			trans	56.7	106.3	134.1	-166.1	0	0	0	0	120	V462	V460-V462 HydrophobicContact CG1-CG2 3.66Å
461	A	30.7	Very low	37	Very low	98 Å²	98	139.7 Å²	139.7	81%	0.81	81%	0.809	S	S	*	*			trans	-104.2	127.9	134.9	0	0	0	0	0	108.1
462	V	31	Very low	36.2	Very low	132 Å²	132	133.7 Å²	133.7	80%	0.8	80%	0.801	S	S	*	*			trans	-75.6	131.3	175.4	174.2	0	0	0	0	109.1	V460	V460-V462 HydrophobicContact CG1-CG2 3.66Å
463	I	34	Very low	35.3	Very low	158 Å²	158	135.3 Å²	135.3	81%	0.81	80%	0.8	S	S	*	*			trans	-87.4	141.4	169.7	-64.4	166.3	0	0	0	108.9
464	S	30.2	Very low	34.3	Very low	124 Å²	124	132.9 Å²	132.9	87%	0.867	79%	0.792	S	S	*	*			trans	170.1	132.8	136.5	174.4	0	0	0	0	107
465	G	29.7	Very low	33.5	Very low	55 Å²	55	131.6 Å²	131.6	57%	0.567	79%	0.788	S	S	*	*			cis	-166.3	146	2	0	0	0	0	0	105.8
466	E	29.1	Very low	33.1	Very low	178 Å²	178	135.2 Å²	135.2	83%	0.832	79%	0.787	S	S	*	*				72.5	108.4	113.7	-145.1	90.4	-154.3	0	0	114.4
467	E	31.7	Very low	32.6	Very low	170 Å²	170	132 Å²	132	79%	0.794	77%	0.774	S	S	*	*			trans	26.8	114.5	153.2	-53.5	-161.7	163.6	0	0	120.5
468	D	28.3	Very low	32.2	Very low	151 Å²	151	131 Å²	131	81%	0.807	77%	0.772	S	S	*	*				-164.8	129.3	123.4	-114.3	-38.1	0	0	0	112.8
469	S	31.6	Very low	31.6	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	77%	0.768	S	S	*	*			trans	48.1	111.5	138.2	-57.3	0	0	0	0	120
470	A	29	Very low	30.8	Very low	93 Å²	93	132.9 Å²	132.9	77%	0.769	77%	0.772	S	S	*	*			trans	-68.2	153.8	174.7	0	0	0	0	0	115.1
471	S	32.8	Very low	30.6	Very low	113 Å²	113	133 Å²	133	79%	0.79	77%	0.773	S	S	*	*			trans	83.7	140.9	161.4	-46.8	0	0	0	0	115.7
472	P	38.7	Very low	30.8	Very low	111 Å²	111	134.1 Å²	134.1	72%	0.721	77%	0.77	S	S	*	*			cis	-149	173.3	41.9	40.3	-18.7	0	0	0	118.6
473	L	27.9	Very low	30.9	Very low	141 Å²	141	134 Å²	134	74%	0.738	77%	0.772	S	S	*	*			trans	54.2	112.4	142	-96.5	72.3	0	0	0	119.6
474	H	32.6	Very low	30.7	Very low	161 Å²	161	131.2 Å²	131.2	75%	0.745	77%	0.767	S	S	*	*				-177.1	116.5	89.5	-108.6	-74.6	0	0	0	112.8
475	H	27.6	Very low	30.9	Very low	165 Å²	165	130.7 Å²	130.7	76%	0.764	76%	0.763	S	S	*	*			trans	-62.8	134.7	152.8	-107.4	-93.3	0	0	0	110.9
476	I	33.3	Very low	31	Very low	154 Å²	154	136.3 Å²	136.3	79%	0.79	78%	0.779	S	S	*	*			trans	-148.9	90.1	148.4	-54.5	-178.3	0	0	0	106.9
477	N	28.6	Very low	31.5	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	78%	0.782	S	S	*	*				55.8	101.6	95.2	-84.4	0.6	0	0	0	116.6
478	H	31.2	Very low	31.5	Very low	197 Å²	197	132.3 Å²	132.3	91%	0.912	78%	0.782	S	S	*	*			trans	-114.2	99.6	135.2	-82.1	-69.1	0	0	0	108.1
479	G	27.4	Very low	31.9	Very low	64 Å²	64	128.1 Å²	128.1	66%	0.66	77%	0.774	S	S	*	*			trans	-71.3	125.6	173.6	0	0	0	0	0	110.5	T481	G479-T481 PolarHBondContact O-N 2.96Å
480	I	29.2	Very low	32.2	Very low	169 Å²	169	128.7 Å²	128.7	87%	0.867	78%	0.776	S	S	*	*			trans	-79.6	97	159.7	-64	170.9	0	0	0	105.6
481	T	28.3	Very low	32.9	Very low	124 Å²	124	131.8 Å²	131.8	76%	0.761	78%	0.779	S	S	*	*			trans	-79.2	117.1	162.2	47	0	0	0	0	108	G479	G479-T481 PolarHBondContact O-N 2.96Å
482	T	34.9	Very low	32.9	Very low	122 Å²	122	132.4 Å²	132.4	75%	0.748	78%	0.778	S	S	*	*			trans	-53.6	146.2	156.6	44.6	0	0	0	0	110.1
483	P	33.2	Very low	32.8	Very low	128 Å²	128	133.9 Å²	133.9	83%	0.831	79%	0.785	S	S	*	*			trans	-117.9	110.2	146.8	20.2	-2.7	0	0	0	109.1
484	S	29.6	Very low	33	Very low	101 Å²	101	133.4 Å²	133.4	71%	0.706	79%	0.788	S	S	*	*			trans	-62.9	140	148.2	10.5	0	0	0	0	109.6
485	S	35.1	Very low	33.1	Very low	112 Å²	112	133 Å²	133	78%	0.783	79%	0.79	S	S	*	*			trans	50.4	111.3	159	65.3	0	0	0	0	119
486	L	31.6	Very low	33.3	Very low	174 Å²	174	128.5 Å²	128.5	91%	0.911	79%	0.788	S	S	*	*			trans	-149.5	117.1	143.6	-103	148.2	0	0	0	109.2
487	D	38.8	Very low	33.2	Very low	168 Å²	168	129.8 Å²	129.8	90%	0.898	79%	0.792	S	S	*	*			trans	-50.7	132.1	160.6	-88.4	-43.2	0	0	0	110.2
488	A	33	Very low	33.5	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	80%	0.801	S	S	*	*			trans	-144.8	123.9	158.8	0	0	0	0	0	108.9
489	G	36.2	Very low	33.6	Very low	63 Å²	63	132.5 Å²	132.5	65%	0.649	80%	0.801	S	S	*	*			trans	-69	-173.4	-179.3	0	0	0	0	0	114.1	D491	G489-D491 PolarHBondContact O-N 3.04Å
490	P	38.3	Very low	33.9	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	81%	0.807	S	S	*	*	S	Bend	trans	-73.9	130.5	-165.1	32.2	-31.6	0	0	0	110
491	D	43.5	Very low	34.2	Very low	158 Å²	158	134 Å²	134	85%	0.845	80%	0.8	S	S	*	*			trans	128.4	64.3	161.2	-64.9	-15.8	0	0	0	113	G489	G489-D491 PolarHBondContact O-N 3.04Å
492	T	32.3	Very low	34.3	Very low	126 Å²	126	134.1 Å²	134.1	77%	0.773	80%	0.8	S	S	*	*			trans	-140.4	120.1	156.4	54.5	0	0	0	0	111.1
493	V	36	Very low	34.2	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	80%	0.802	S	S	*	*			trans	-75.8	125.9	179.5	175.5	0	0	0	0	110
494	V	32.9	Very low	34.2	Very low	131 Å²	131	138 Å²	138	79%	0.794	80%	0.802	S	S	*	*			trans	-106.5	117.9	175.3	-179.5	0	0	0	0	109.5
495	I	33.9	Very low	34.1	Very low	152 Å²	152	140.6 Å²	140.6	78%	0.779	81%	0.808	S	S	*	*			trans	-80.8	112.6	172.5	-63.1	168.3	0	0	0	107.6
496	G	31.6	Very low	34	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	81%	0.805	S	S	*	*			trans	-80	115.9	178.7	0	0	0	0	0	112.2
497	M	31.8	Very low	33.9	Very low	181 Å²	181	139.9 Å²	139.9	89%	0.892	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.2	130.1	166.1	-71.1	177.5	170.9	0	0	109.9
498	T	34.2	Very low	33.5	Very low	139 Å²	139	141.1 Å²	141.1	85%	0.853	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.9	132.5	178.2	39.7	0	0	0	0	111.4
499	R	33.5	Very low	33.4	Very low	243 Å²	243	146.7 Å²	146.7	92%	0.917	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-78.7	131.5	175.4	-75.9	-173.2	176.9	-169.9	-0.2	110.6
500	I	34.4	Very low	33	Very low	154 Å²	154	155.1 Å²	155.1	79%	0.79	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-71.9	129	168.9	-59.3	164.6	0	0	0	108.6
501	P	34.5	Very low	32.6	Very low	109 Å²	109	158.2 Å²	158.2	71%	0.708	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-80.3	123.5	171.1	29.5	-28.8	0	0	0	110.5	I503	P501-I503 PolarHBondContact O-N 3.26Å
502	V	31.4	Very low	32.1	Very low	128 Å²	128	154 Å²	154	78%	0.776	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.9	118.8	167.8	175.9	0	0	0	0	107.8
503	I	32.8	Very low	32.2	Very low	153 Å²	153	156.5 Å²	156.5	79%	0.785	81%	0.81	S	S	*	*			trans	-87.6	110.2	172.3	-63.3	171	0	0	0	107.2	P501	P501-I503 PolarHBondContact O-N 3.26Å
504	E	33.2	Very low	32.2	Very low	177 Å²	177	157.7 Å²	157.7	83%	0.827	81%	0.812	S	S	*	*			trans	-85.3	117.3	168.7	-76.5	-175.2	165	0	0	109.7
505	N	26.9	Very low	32.2	Very low	157 Å²	157	157.4 Å²	157.4	84%	0.84	81%	0.814	S	S	*	*			trans	-95.2	121.3	174	-149.3	8.5	0	0	0	108.3
506	P	34.3	Very low	32.1	Very low	111 Å²	111	159.2 Å²	159.2	72%	0.721	82%	0.819	S	S	*	*			trans	-101.8	93.4	-170.5	35.4	-27.6	0	0	0	110.7
507	Q	29.3	Very low	32.4	Very low	159 Å²	159	164.9 Å²	164.9	74%	0.743	82%	0.824	S	S	*	*			trans	-151	139.8	154.7	-76	-145.7	-9.1	0	0	113.1
508	Y	30	Very low	33	Very low	195 Å²	195	161.9 Å²	161.9	77%	0.765	82%	0.818	S	S	*	*			trans	78.9	97.6	172.8	-61.8	-83.9	0	0	0	117.5
509	F	29.8	Very low	33.2	Very low	211 Å²	211	162.4 Å²	162.4	93%	0.925	82%	0.816	S	S	*	*				-166	110.9	112.3	-100.1	-74.4	0	0	0	110.2
510	R	28.4	Very low	33.4	Very low	240 Å²	240	161.3 Å²	161.3	91%	0.906	84%	0.836	S	S	*	*			trans	-95	117.5	155.8	-94.1	-174.7	173.6	179.1	-0.5	106.8
511	Q	30.8	Very low	33.3	Very low	185 Å²	185	161.7 Å²	161.7	86%	0.864	84%	0.838	S	S	*	*			trans	-173.9	127.2	138.1	-106.5	164.4	0.9	0	0	109.5
512	G	32.7	Very low	33.2	Very low	69 Å²	69	164.4 Å²	164.4	71%	0.711	85%	0.845	S	S	*	*			trans	-80.1	152.4	-177.7	0	0	0	0	0	112.8
513	H	34	Very low	33.3	Very low	180 Å²	180	166.4 Å²	166.4	83%	0.833	85%	0.849	S	S	*	*			trans	-140.2	119.5	157.2	-85.1	-70.7	0	0	0	109.8
514	N	34.6	Very low	33.4	Very low	167 Å²	167	167.2 Å²	167.2	89%	0.893	85%	0.853	S	S	*	*			trans	-56.8	132.8	160.6	-83.5	-30.8	0	0	0	109.4
515	C	33	Very low	33.4	Very low	126 Å²	126	166.6 Å²	166.6	85%	0.851	85%	0.854	S	S	*	*			trans	-133.3	116	158.3	-82	0	0	0	0	109.6
516	H	32.1	Very low	33.8	Very low	189 Å²	189	167.3 Å²	167.3	88%	0.875	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-59.7	141.5	166.6	-104.7	33.6	0	0	0	110.8
517	K	39.2	Very low	33.8	Very low	189 Å²	189	171.3 Å²	171.3	82%	0.822	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-62.4	150.7	156	-80.9	179.4	171.6	-179.3	0	110
518	P	43.8	Very low	34.1	Very low	119 Å²	119	172.2 Å²	172.2	77%	0.773	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-96.5	136.6	142.7	31.3	-20	0	0	0	109.9
519	D	37.8	Very low	34.5	Very low	150 Å²	150	170.3 Å²	170.3	80%	0.802	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-61.4	134	164.6	-66.9	-47.7	0	0	0	110.5
520	T	37.4	Very low	34.9	Very low	219 Å²	219	166.6 Å²	166.6	100%	1.344	88%	0.879	S	S	*	*			trans	-170	0	132.4	18.5	0	0	0	0	110

Retrieved 520 of 520 residues in 82.8 ms (Link to these results)

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