A0A087WSX6_HUMAN Loading...

F-box and WD repeat domain containing 10B

AlphaFold DB , UniProt , Accession A0A087WSX6, Species HUMAN (Homo sapiens, Human), Gene FBXW10B, Length 714 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	36.4	Very low	232 Å²	232	141.2 Å²	141.2	100%	1.143	70%	0.702	S	S	*	*				0	32.6	0	-116.8	-156.8	-65.9	0	0	111.7
2	E	27.2	Very low	37	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	70%	0.699	S	S	*	*			trans	-116.4	7.4	-175.4	-78.4	177.4	156.5	0	0	114.8
3	N	34	Very low	37.4	Very low	138 Å²	138	144.2 Å²	144.2	74%	0.738	71%	0.711	S	S	*	*	S	Bend	trans	-123.9	15.5	-174.8	-99.7	-26.8	0	0	0	115.3	S6	N3-S6 PolarHBondContact O-OG 3.1Å
4	L	33.6	Very low	37.6	Very low	135 Å²	135	143.1 Å²	143.1	71%	0.707	70%	0.701	S	S	*	*	S	Bend	trans	-94.2	-20.6	172.1	-145.8	77.2	0	0	0	112.8	S6	L4-S6 VanDerWaalsContact C-N 3.35Å
5	E	31.2	Very low	38	Very low	165 Å²	165	145 Å²	145	77%	0.771	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-74.5	-21.9	178.7	-72.6	-175.4	154.9	0	0	113.5	R7	E5-R7 PolarHBondContact O-N 3.36Å
6	S	33.5	Very low	38.3	Very low	62 Å²	62	139.9 Å²	139.9	43%	0.434	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-77.4	-17.3	-176.7	58	0	0	0	0	114.2	N3 L4	N3-S6 PolarHBondContact O-OG 3.1Å; L4-S6 VanDerWaalsContact C-N 3.35Å
7	R	40.3	Very low	38.5	Very low	173 Å²	173	140.4 Å²	140.4	65%	0.653	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-88.7	-14.2	179.2	-77.7	-174	161.3	-177.5	-4.3	114.7	E5	E5-R7 PolarHBondContact O-N 3.36Å
8	L	38.3	Very low	38.9	Very low	123 Å²	123	142.9 Å²	142.9	64%	0.644	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-86	-6.7	175.3	-78	159	0	0	0	113.4	N10	L8-N10 VanDerWaalsContact C-N 3.3Å; L8-N10 PolarHBondContact O-N 3.07Å
9	K	41.2	Very low	38.7	Very low	161 Å²	161	138.6 Å²	138.6	70%	0.7	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-72.5	-19.1	174.8	-81.5	-177.3	175.9	178.1	0	113.7
10	N	42.3	Very low	38.5	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-104.7	11.8	-168.1	-65.6	-3.6	0	0	0	115.2	L8	L8-N10 VanDerWaalsContact C-N 3.3Å; L8-N10 PolarHBondContact O-N 3.07Å
11	A	39.8	Very low	39	Very low	39 Å²	39	139.6 Å²	139.6	32%	0.322	70%	0.701	S	S	.	*			trans	-122	89.7	-179.4	0	0	0	0	0	111.5	Y13 F14	A11-Y13 VanDerWaalsContact C-N 3.27Å; A11-Y13 PolarHBondContact O-N 3.25Å; A11-F14 HydrophobicContact CB-CD2 4.15Å; A11-F14 PolarHBondContact O-N 2.95Å
12	P	43	Very low	39	Very low	102 Å²	102	133.7 Å²	133.7	66%	0.662	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-68.4	-21.5	-174.4	24.6	-31.8	0	0	0	114	F14	P12-F14 PolarHBondContact O-N 3.42Å
13	Y	42.5	Very low	40	Very low	219 Å²	219	132.7 Å²	132.7	86%	0.859	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-72.5	-9	-179.1	-66.1	-80.8	0	0	0	115.1	A11	A11-Y13 VanDerWaalsContact C-N 3.27Å; A11-Y13 PolarHBondContact O-N 3.25Å
14	F	40.5	Very low	40.3	Very low	129 Å²	129	131.2 Å²	131.2	57%	0.566	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-111.9	14.9	-177.3	-67.6	-74.5	0	0	0	114.3	A11 P12	A11-F14 HydrophobicContact CB-CD2 4.15Å; A11-F14 PolarHBondContact O-N 2.95Å; P12-F14 PolarHBondContact O-N 3.42Å
15	R	43.2	Very low	41.1	Very low	172 Å²	172	131.3 Å²	131.3	65%	0.649	68%	0.68	S	S	*	*			trans	-100.7	137.3	173.8	-75.7	-168.6	179.5	-168.9	0.7	112.5
16	C	43	Very low	41.8	Very low	63 Å²	63	126 Å²	126	43%	0.426	66%	0.661	S	S	.	*			trans	-92.5	101.3	155.8	-166.2	0	0	0	0	106.9
17	E	41.1	Very low	42.5	Very low	149 Å²	149	133.1 Å²	133.1	70%	0.696	68%	0.678	S	S	*	*			trans	-69.8	145.6	163.7	-71.8	-166.2	160.7	0	0	108.7
18	K	45.8	Very low	43.2	Very low	185 Å²	185	134.1 Å²	134.1	80%	0.804	69%	0.687	S	S	*	*			cis	-149.3	152.2	-2	-96.5	163.2	-179.4	173.3	0	104.3
19	G	35.9	Very low	44.5	Very low	62 Å²	62	129.7 Å²	129.7	64%	0.639	67%	0.666	S	S	*	*				112	136.4	85.8	0	0	0	0	0	109.8
20	T	34.8	Very low	45.6	Very low	139 Å²	139	126.7 Å²	126.7	85%	0.853	66%	0.655	S	S	*	*			trans	75.8	134	174.7	61.4	0	0	0	0	119.3
21	D	47.8	Very low	46.8	Very low	158 Å²	158	122.2 Å²	122.2	85%	0.845	63%	0.633	S	S	*	*	S	Bend	trans	-54.9	149.3	174.5	-63.7	-58.6	0	0	0	112.1
22	S	40.4	Very low	48.2	Very low	109 Å²	109	127.2 Å²	127.2	76%	0.762	64%	0.643	S	S	*	*	S	Bend	trans	83.6	119.2	-164.3	77.7	0	0	0	0	114.1	P24	S22-P24 VanDerWaalsContact O-CD 3.23Å; S22-P24 WeakPolarHBondContact O-CD 3.39Å
23	I	48.7	Very low	49.8	Very low	161 Å²	161	124.6 Å²	124.6	83%	0.826	63%	0.625	S	S	*	*			trans	-57.4	130.7	-170.6	-63.8	160.6	0	0	0	111.7	L25	I23-L25 HydrophobicContact CG2-CG 4.44Å
24	P	40	Very low	51.5	Low	107 Å²	107	114.7 Å²	114.7	70%	0.695	59%	0.587	S	S	*	*			trans	-126	129.7	142.8	14.6	8.8	0	0	0	111.7	S22 C26	S22-P24 VanDerWaalsContact O-CD 3.23Å; S22-P24 WeakPolarHBondContact O-CD 3.39Å; P24-C26 PolarHBondContact O-N 3.49Å; P24-C26 VanDerWaalsContact O-N 3.16Å
25	L	49.6	Very low	53.3	Low	136 Å²	136	111.4 Å²	111.4	71%	0.712	58%	0.584	S	S	*	*			trans	-66.7	99.9	179.4	-73.2	125.9	0	0	0	112.2	I23 R27	I23-L25 HydrophobicContact CG2-CG 4.44Å; L25-R27 HydrophobicContact CB-CG 4.35Å; L25-R27 PolarHBondContact O-N 3.45Å
26	C	45.1	Very low	55	Low	55 Å²	55	110.7 Å²	110.7	37%	0.372	58%	0.581	S	S	.	*			trans	-81.6	92	158	-175.1	0	0	0	0	109.2	P24 K28	P24-C26 PolarHBondContact O-N 3.49Å; P24-C26 VanDerWaalsContact O-N 3.16Å; C26-K28 PolarHBondContact O-N 3.2Å
27	R	49	Very low	56.9	Low	210 Å²	210	109 Å²	109	79%	0.792	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	12.6	-178.6	-75	-171.7	173.7	-176.9	-0.7	115.2	L25	L25-R27 HydrophobicContact CB-CG 4.35Å; L25-R27 PolarHBondContact O-N 3.45Å
28	K	55.4	Low	59	Low	195 Å²	195	103 Å²	103	85%	0.848	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	-3.4	-166.7	-68.8	-172.3	178.3	-178.2	0	117.6	C26	C26-K28 PolarHBondContact O-N 3.2Å
29	C	64.9	Low	60.6	Low	29 Å²	29	99.9 Å²	99.9	20%	0.196	53%	0.526	C	S	.	.			trans	-96.1	121.9	178.9	54.1	0	0	0	0	112.7	T31 R32 V33	C29-T31 PolarHBondContact O-N 3.11Å; C29-T31 VanDerWaalsContact O-N 3.16Å; C29-R32 PolarHBondContact O-N 3.43Å; C29-R32 VanDerWaalsContact O-N 3.15Å; C29-R32 VanDerWaalsContact SG-CB 3.51Å; C29-R32 VanDerWaalsContact SG-CG 3.54Å; C29-V33 WeakPolarHBondContact O-CG2 3.03Å; C29-V33 PolarHBondContact O-N 3.33Å; C29-V33 VanDerWaalsContact O-N 3.11Å
30	E	63.8	Low	62.8	Low	99 Å²	99	97.6 Å²	97.6	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-53.5	-37.7	-177.5	-70.6	-166.4	163.2	0	0	112.6	V33 L34 T129	E30-V33 PolarHBondContact O-N 3.12Å; E30-L34 VanDerWaalsContact O-CB 3.32Å; E30-L34 WeakPolarHBondContact O-CB 3.49Å; E30-L34 PolarHBondContact O-N 3.49Å; E30-T129 WeakPolarHBondContact OE1-CG2 3.36Å; E30-T129 PolarHBondContact OE2-OG1 3.22Å
31	T	68.8	Low	65.1	Low	49 Å²	49	91 Å²	91	30%	0.301	46%	0.459	S	S	.	.	H	α-helix	trans	-65.9	-40.6	-179.2	-35	0	0	0	0	113.3	C29 A35 W131	C29-T31 PolarHBondContact O-N 3.11Å; C29-T31 VanDerWaalsContact O-N 3.16Å; T31-A35 WeakPolarHBondContact O-CB 3.39Å; T31-A35 PolarHBondContact O-N 3.24Å; T31-W131 HydrophobicContact CG2-CH2 4.41Å
32	R	69.3	Low	66.7	Low	144 Å²	144	89.9 Å²	89.9	54%	0.543	45%	0.447	S	S	.	.	H	α-helix	trans	-76.8	-31.8	176.3	-70	-170.6	177	176.9	0.6	111.7	C29 A35 W36	C29-R32 PolarHBondContact O-N 3.43Å; C29-R32 VanDerWaalsContact O-N 3.15Å; C29-R32 VanDerWaalsContact SG-CB 3.51Å; C29-R32 VanDerWaalsContact SG-CG 3.54Å; R32-A35 PolarHBondContact O-N 2.7Å; R32-W36 WeakPolarHBondContact O-CB 3.49Å; R32-W36 PolarHBondContact O-N 3.22Å
33	V	75.3	Confident	68.6	Low	46 Å²	46	89.5 Å²	89.5	28%	0.279	43%	0.433	S	S	.	.	H	α-helix	trans	-63.1	-46.3	172	178.6	0	0	0	0	110.3	C29 E30 W36 K37 W124	C29-V33 WeakPolarHBondContact O-CG2 3.03Å; C29-V33 PolarHBondContact O-N 3.33Å; C29-V33 VanDerWaalsContact O-N 3.11Å; E30-V33 PolarHBondContact O-N 3.12Å; V33-W36 PolarHBondContact O-N 3.31Å; V33-K37 HydrophobicContact CG1-CG 4.25Å; V33-K37 WeakPolarHBondContact O-CB 3.36Å; V33-K37 WeakPolarHBondContact O-CG 3.33Å; V33-K37 PolarHBondContact O-N 3.28Å; V33-W124 HydrophobicContact CG1-CZ2 4.17Å
34	L	79.8	Confident	70.1	Confident	11 Å²	11	82.6 Å²	82.6	6%	0.058	40%	0.397	C	S	.	.	H	α-helix	trans	-58.8	-48.2	173.8	176.4	62.7	0	0	0	111.4	E30 W36 K37 I38 W124 W131 T132 N135 Y136	E30-L34 VanDerWaalsContact O-CB 3.32Å; E30-L34 WeakPolarHBondContact O-CB 3.49Å; E30-L34 PolarHBondContact O-N 3.49Å; L34-W36 PolarHBondContact O-N 3.04Å; L34-K37 PolarHBondContact O-N 3.44Å; L34-I38 HydrophobicContact CD1-CD1 3.71Å; L34-I38 HydrophobicContact CD1-CG1 4.13Å; L34-I38 HydrophobicContact CG-CD1 4.03Å; L34-I38 WeakPolarHBondContact O-CB 3.37Å; L34-I38 WeakPolarHBondContact O-CG1 3.5Å; L34-I38 PolarHBondContact O-N 3.14Å; L34-W124 HydrophobicContact CD1-CH2 3.9Å; L34-W131 HydrophobicContact CD2-CH2 4.26Å; L34-W131 HydrophobicContact CD2-CZ3 3.88Å; L34-T132 HydrophobicContact CD1-CG2 4.03Å; L34-N135 HydrophobicContact CD2-CB 3.84Å; L34-Y136 HydrophobicContact CD1-CD2 3.96Å; L34-Y136 HydrophobicContact CD1-CG 4.36Å
35	A	78.3	Confident	72.1	Confident	60 Å²	60	77.6 Å²	77.6	50%	0.496	36%	0.364	S	S	.	.	H	α-helix	trans	-60.5	-43.9	179.1	0	0	0	0	0	112.3	T31 R32 I38 F39	T31-A35 WeakPolarHBondContact O-CB 3.39Å; T31-A35 PolarHBondContact O-N 3.24Å; R32-A35 PolarHBondContact O-N 2.7Å; A35-I38 PolarHBondContact O-N 2.94Å; A35-F39 VanDerWaalsContact O-CB 3.31Å; A35-F39 WeakPolarHBondContact O-CB 3.43Å; A35-F39 PolarHBondContact O-N 3.5Å
36	W	79.1	Confident	73.4	Confident	157 Å²	157	75 Å²	75	60%	0.595	36%	0.356	S	S	*	.	H	α-helix	trans	-67.3	-41.5	177	-175.6	84.2	0	0	0	112.2	R32 V33 L34 I38 F39 S40	R32-W36 WeakPolarHBondContact O-CB 3.49Å; R32-W36 PolarHBondContact O-N 3.22Å; V33-W36 PolarHBondContact O-N 3.31Å; L34-W36 PolarHBondContact O-N 3.04Å; W36-I38 VanDerWaalsContact C-N 3.33Å; W36-I38 PolarHBondContact O-N 2.85Å; W36-F39 PolarHBondContact O-N 2.82Å; W36-S40 WeakPolarHBondContact O-CB 3.36Å; W36-S40 PolarHBondContact O-N 3.27Å
37	K	82.4	Confident	74.9	Confident	27 Å²	27	82.7 Å²	82.7	12%	0.117	38%	0.377	C	S	.	.	H	α-helix	trans	-63.8	-37.7	176.6	-72.3	-73.6	-179.8	179.3	0	111.8	V33 L34 T41 I121 W124	V33-K37 HydrophobicContact CG1-CG 4.25Å; V33-K37 WeakPolarHBondContact O-CB 3.36Å; V33-K37 WeakPolarHBondContact O-CG 3.33Å; V33-K37 PolarHBondContact O-N 3.28Å; L34-K37 PolarHBondContact O-N 3.44Å; K37-T41 WeakPolarHBondContact O-CB 3.42Å; K37-T41 PolarHBondContact O-N 3.33Å; K37-T41 PolarHBondContact O-OG1 3.3Å; K37-I121 HydrophobicContact CD-CG1 4.14Å; K37-W124 HydrophobicContact CB-CE3 4.33Å; K37-W124 HydrophobicContact CB-CH2 3.95Å; K37-W124 HydrophobicContact CB-CZ2 4.37Å; K37-W124 HydrophobicContact CB-CZ3 3.93Å; K37-W124 HydrophobicContact CD-CD2 4.18Å; K37-W124 HydrophobicContact CD-CE3 4.21Å; K37-W124 HydrophobicContact CG-CD2 4Å; K37-W124 HydrophobicContact CG-CE3 4.04Å; K37-W124 HydrophobicContact CG-CH2 4.07Å; K37-W124 HydrophobicContact CG-CZ2 4.03Å; K37-W124 HydrophobicContact CG-CZ3 4.08Å
38	I	84.3	Confident	76.2	Confident	24 Å²	24	73.7 Å²	73.7	12%	0.123	35%	0.345	C	S	.	.	H	α-helix	trans	-71.4	-44.4	175	-70.4	179.1	0	0	0	111.4	L34 A35 W36 S40 T41 K42 Y136 L139	L34-I38 HydrophobicContact CD1-CD1 3.71Å; L34-I38 HydrophobicContact CD1-CG1 4.13Å; L34-I38 HydrophobicContact CG-CD1 4.03Å; L34-I38 WeakPolarHBondContact O-CB 3.37Å; L34-I38 WeakPolarHBondContact O-CG1 3.5Å; L34-I38 PolarHBondContact O-N 3.14Å; A35-I38 PolarHBondContact O-N 2.94Å; W36-I38 VanDerWaalsContact C-N 3.33Å; W36-I38 PolarHBondContact O-N 2.85Å; I38-S40 VanDerWaalsContact C-N 3.29Å; I38-S40 PolarHBondContact O-N 2.96Å; I38-T41 PolarHBondContact O-N 3.34Å; I38-T41 VanDerWaalsContact O-N 3.15Å; I38-K42 WeakPolarHBondContact O-CB 3.37Å; I38-K42 PolarHBondContact O-N 3.49Å; I38-Y136 HydrophobicContact CD1-CD2 4.1Å; I38-Y136 HydrophobicContact CG1-CD2 3.52Å; I38-Y136 HydrophobicContact CG1-CE2 3.78Å; I38-L139 HydrophobicContact CD1-CB 3.69Å; I38-L139 HydrophobicContact CD1-CD1 3.17Å; I38-L139 HydrophobicContact CD1-CG 4.01Å
39	F	79.7	Confident	77.1	Confident	120 Å²	120	67.9 Å²	67.9	53%	0.526	32%	0.323	S	S	.	.	H	α-helix	trans	-55.5	-48.2	174.8	178.9	-93.5	0	0	0	110.7	A35 W36 T41 K42 E43	A35-F39 VanDerWaalsContact O-CB 3.31Å; A35-F39 WeakPolarHBondContact O-CB 3.43Å; A35-F39 PolarHBondContact O-N 3.5Å; W36-F39 PolarHBondContact O-N 2.82Å; F39-T41 PolarHBondContact O-N 3.06Å; F39-K42 PolarHBondContact O-N 3.26Å; F39-E43 HydrophobicContact CE1-CG 4.21Å; F39-E43 VanDerWaalsContact CE1-OE1 3.26Å; F39-E43 WeakPolarHBondContact CE1-OE1 3.35Å; F39-E43 HydrophobicContact CZ-CG 4.4Å; F39-E43 WeakPolarHBondContact CZ-OE1 3.31Å; F39-E43 PolarHBondContact O-N 3.48Å
40	S	81.3	Confident	77.1	Confident	14 Å²	14	71 Å²	71	10%	0.098	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-46.2	175.3	-173.8	0	0	0	0	111.9	W36 I38 K42 E43 W44	W36-S40 WeakPolarHBondContact O-CB 3.36Å; W36-S40 PolarHBondContact O-N 3.27Å; I38-S40 VanDerWaalsContact C-N 3.29Å; I38-S40 PolarHBondContact O-N 2.96Å; S40-K42 VanDerWaalsContact C-N 3.3Å; S40-K42 PolarHBondContact O-N 2.98Å; S40-E43 PolarHBondContact O-N 3.18Å; S40-W44 PolarHBondContact O-NE1 3.01Å
41	T	84.1	Confident	77.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-58.3	-42.8	176.7	-53.6	0	0	0	0	111.1	K37 I38 F39 E43 W44 F45 F56 I121 Y136 L140 M143	K37-T41 WeakPolarHBondContact O-CB 3.42Å; K37-T41 PolarHBondContact O-N 3.33Å; K37-T41 PolarHBondContact O-OG1 3.3Å; I38-T41 PolarHBondContact O-N 3.34Å; I38-T41 VanDerWaalsContact O-N 3.15Å; F39-T41 PolarHBondContact O-N 3.06Å; T41-E43 VanDerWaalsContact C-N 3.35Å; T41-E43 PolarHBondContact O-N 3.11Å; T41-W44 HydrophobicContact CG2-CH2 4.36Å; T41-W44 HydrophobicContact CG2-CZ2 4.12Å; T41-W44 PolarHBondContact O-N 3.15Å; T41-F45 HydrophobicContact CG2-CB 4.02Å; T41-F45 HydrophobicContact CG2-CG 4.46Å; T41-F45 WeakPolarHBondContact O-CA 3.43Å; T41-F45 WeakPolarHBondContact O-CB 3.36Å; T41-F45 PolarHBondContact O-N 3.02Å; T41-F56 HydrophobicContact CG2-CE1 4.15Å; T41-I121 WeakPolarHBondContact OG1-CD1 3.23Å; T41-Y136 WeakPolarHBondContact CG2-OH 3.47Å; T41-Y136 PolarHBondContact OG1-OH 3.46Å; T41-L140 HydrophobicContact CG2-CD1 4.21Å; T41-M143 HydrophobicContact CG2-CE 4.03Å
42	K	82.3	Confident	77.4	Confident	135 Å²	135	66.9 Å²	66.9	59%	0.587	32%	0.317	S	S	*	.	H	α-helix	trans	-63.7	-36.9	-178.3	-171.5	176.5	-179.9	-179.7	0	113	I38 F39 S40 W44 M143	I38-K42 WeakPolarHBondContact O-CB 3.37Å; I38-K42 PolarHBondContact O-N 3.49Å; F39-K42 PolarHBondContact O-N 3.26Å; S40-K42 VanDerWaalsContact C-N 3.3Å; S40-K42 PolarHBondContact O-N 2.98Å; K42-W44 VanDerWaalsContact C-N 3.33Å; K42-W44 PolarHBondContact O-N 3.16Å; K42-M143 HydrophobicContact CB-SD 3.79Å; K42-M143 HydrophobicContact CG-SD 3.9Å
43	E	78.7	Confident	77.7	Confident	100 Å²	100	60.7 Å²	60.7	47%	0.467	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-37.7	179.9	-74.3	-172.1	151.3	0	0	112.9	F39 S40 T41 R47	F39-E43 HydrophobicContact CE1-CG 4.21Å; F39-E43 VanDerWaalsContact CE1-OE1 3.26Å; F39-E43 WeakPolarHBondContact CE1-OE1 3.35Å; F39-E43 HydrophobicContact CZ-CG 4.4Å; F39-E43 WeakPolarHBondContact CZ-OE1 3.31Å; F39-E43 PolarHBondContact O-N 3.48Å; S40-E43 PolarHBondContact O-N 3.18Å; T41-E43 VanDerWaalsContact C-N 3.35Å; T41-E43 PolarHBondContact O-N 3.11Å; E43-R47 VanDerWaalsContact O-CD 3.31Å; E43-R47 WeakPolarHBondContact O-CD 3.35Å
44	W	81.7	Confident	77.7	Confident	16 Å²	16	60.8 Å²	60.8	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-101.8	-33.6	-176.5	62.8	-107.4	0	0	0	113.6	S40 T41 K42 C46 R47 I48 F56 V114 M118 I121	S40-W44 PolarHBondContact O-NE1 3.01Å; T41-W44 HydrophobicContact CG2-CH2 4.36Å; T41-W44 HydrophobicContact CG2-CZ2 4.12Å; T41-W44 PolarHBondContact O-N 3.15Å; K42-W44 VanDerWaalsContact C-N 3.33Å; K42-W44 PolarHBondContact O-N 3.16Å; W44-C46 PolarHBondContact O-N 3.16Å; W44-R47 PolarHBondContact O-N 2.69Å; W44-I48 HydrophobicContact CB-CD1 4.47Å; W44-I48 HydrophobicContact CD2-CD1 4.11Å; W44-I48 HydrophobicContact CE3-CD1 3.11Å; W44-I48 HydrophobicContact CE3-CG1 4.37Å; W44-I48 HydrophobicContact CZ3-CD1 3.58Å; W44-I48 WeakPolarHBondContact O-CG1 3.33Å; W44-I48 PolarHBondContact O-N 3.31Å; W44-F56 AromaticContact CH2-CD1 3.81Å; W44-F56 HydrophobicContact CH2-CD1 3.81Å; W44-F56 AromaticContact CH2-CD2 3.9Å; W44-F56 HydrophobicContact CH2-CD2 3.9Å; W44-F56 AromaticContact CH2-CE1 3.74Å; W44-F56 HydrophobicContact CH2-CE1 3.74Å; W44-F56 AromaticContact CH2-CE2 3.84Å; W44-F56 HydrophobicContact CH2-CE2 3.84Å; W44-F56 AromaticContact CH2-CG 3.88Å; W44-F56 HydrophobicContact CH2-CG 3.88Å; W44-F56 AromaticContact CH2-CZ 3.76Å; W44-F56 HydrophobicContact CH2-CZ 3.76Å; W44-F56 HydrophobicContact CZ2-CE1 4.36Å; W44-F56 HydrophobicContact CZ2-CE2 4.25Å; W44-F56 HydrophobicContact CZ2-CZ 4.06Å; W44-F56 HydrophobicContact CZ3-CD1 4.41Å; W44-F56 HydrophobicContact CZ3-CG 4.49Å; W44-V114 HydrophobicContact CE3-CG1 4.4Å; W44-M118 HydrophobicContact CE3-CE 4.37Å; W44-M118 HydrophobicContact CH2-CE 4.14Å; W44-M118 HydrophobicContact CH2-CG 3.62Å; W44-M118 HydrophobicContact CZ2-CG 4.16Å; W44-M118 HydrophobicContact CZ3-CE 3.64Å; W44-M118 HydrophobicContact CZ3-CG 4.05Å; W44-I121 HydrophobicContact CZ2-CD1 3.97Å
45	F	82.2	Confident	77.4	Confident	2 Å²	2	63 Å²	63	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-60.1	-46.6	-168.8	-176.6	-102.7	0	0	0	112	T41 R47 Q53 F56 L140 M143 L148	T41-F45 HydrophobicContact CG2-CB 4.02Å; T41-F45 HydrophobicContact CG2-CG 4.46Å; T41-F45 WeakPolarHBondContact O-CA 3.43Å; T41-F45 WeakPolarHBondContact O-CB 3.36Å; T41-F45 PolarHBondContact O-N 3.02Å; F45-R47 PolarHBondContact O-N 2.89Å; F45-Q53 HydrophobicContact CD2-CG 4.36Å; F45-Q53 HydrophobicContact CE2-CB 4.05Å; F45-Q53 HydrophobicContact CE2-CG 4.11Å; F45-Q53 HydrophobicContact CZ-CB 4.17Å; F45-Q53 HydrophobicContact CZ-CG 4.28Å; F45-Q53 WeakPolarHBondContact O-CG 3.4Å; F45-Q53 PolarHBondContact O-NE2 3.06Å; F45-F56 AromaticContact CD2-CD1 3.96Å; F45-F56 HydrophobicContact CD2-CD1 3.96Å; F45-F56 HydrophobicContact CD2-CE1 4.47Å; F45-F56 AromaticContact CE2-CD1 3.85Å; F45-F56 HydrophobicContact CE2-CD1 3.85Å; F45-L140 HydrophobicContact CD1-CD1 4.4Å; F45-L140 HydrophobicContact CD2-CD1 4.22Å; F45-L140 HydrophobicContact CE1-CD1 4.16Å; F45-L140 HydrophobicContact CE2-CD1 4Å; F45-L140 HydrophobicContact CG-CD1 4.43Å; F45-L140 HydrophobicContact CZ-CD1 3.96Å; F45-M143 HydrophobicContact CD1-CB 4.11Å; F45-M143 HydrophobicContact CE1-CB 4.27Å; F45-L148 HydrophobicContact CZ-CD1 4.38Å
46	C	76.1	Confident	77.5	Confident	82 Å²	82	60.1 Å²	60.1	55%	0.554	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-13.3	178.5	-60.1	0	0	0	0	114.1	W44	W44-C46 PolarHBondContact O-N 3.16Å
47	R	76.4	Confident	77.7	Confident	216 Å²	216	52.7 Å²	52.7	82%	0.815	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	-6.7	-175.2	-63.9	-175.2	178.7	166.3	-0.4	113.9	E43 W44 F45	E43-R47 VanDerWaalsContact O-CD 3.31Å; E43-R47 WeakPolarHBondContact O-CD 3.35Å; W44-R47 PolarHBondContact O-N 2.69Å; F45-R47 PolarHBondContact O-N 2.89Å
48	I	76.8	Confident	77.5	Confident	21 Å²	21	51.5 Å²	51.5	11%	0.108	24%	0.241	C	C	.	.	S	Bend	trans	-94.4	159.3	-177.4	-64.5	164.7	0	0	0	111.1	W44 Q53 V114 M118	W44-I48 HydrophobicContact CB-CD1 4.47Å; W44-I48 HydrophobicContact CD2-CD1 4.11Å; W44-I48 HydrophobicContact CE3-CD1 3.11Å; W44-I48 HydrophobicContact CE3-CG1 4.37Å; W44-I48 HydrophobicContact CZ3-CD1 3.58Å; W44-I48 WeakPolarHBondContact O-CG1 3.33Å; W44-I48 PolarHBondContact O-N 3.31Å; I48-Q53 HydrophobicContact CB-CG 4.49Å; I48-Q53 PolarHBondContact O-NE2 2.86Å; I48-V114 HydrophobicContact CD1-CB 4.5Å; I48-V114 HydrophobicContact CD1-CG1 3.15Å; I48-V114 HydrophobicContact CG1-CG1 3.92Å; I48-M118 HydrophobicContact CD1-CE 3.52Å; I48-M118 HydrophobicContact CG2-CE 4.36Å
49	N	73.3	Confident	77.1	Confident	73 Å²	73	50.5 Å²	50.5	39%	0.39	24%	0.236	S	C	.	.			trans	-56.8	151.8	171.6	69.8	46.4	0	0	0	113.6	I51 S52 Q53	N49-I51 PolarHBondContact O-N 3.29Å; N49-I51 PolarHBondContact OD1-N 2.89Å; N49-S52 PolarHBondContact O-N 3.15Å; N49-S52 WeakPolarHBondContact OD1-CB 3.13Å; N49-S52 PolarHBondContact OD1-N 2.94Å; N49-S52 PolarHBondContact OD1-OG 3.41Å; N49-Q53 WeakPolarHBondContact O-CG 3.38Å; N49-Q53 PolarHBondContact O-N 2.99Å
50	D	65.4	Low	77.3	Confident	94 Å²	94	44.8 Å²	44.8	50%	0.503	21%	0.211	S	C	.	.	H	α-helix	trans	-58.6	-30.5	-178	-76.5	-14.1	0	0	0	112.8	R54	D50-R54 VanDerWaalsContact O-CB 3.23Å; D50-R54 WeakPolarHBondContact O-CB 3.38Å; D50-R54 PolarHBondContact O-N 3.02Å
51	I	66.1	Low	77.4	Confident	52 Å²	52	44.1 Å²	44.1	27%	0.267	21%	0.207	S	C	.	.	H	α-helix	trans	-68.2	-47.9	-178.5	-64.9	167.4	0	0	0	110.6	N49 R54 R55 L261	N49-I51 PolarHBondContact O-N 3.29Å; N49-I51 PolarHBondContact OD1-N 2.89Å; I51-R54 PolarHBondContact O-N 3.27Å; I51-R55 WeakPolarHBondContact O-CG 2.91Å; I51-R55 PolarHBondContact O-N 3.4Å; I51-L261 HydrophobicContact CG2-CD2 3.92Å
52	S	72.8	Confident	77.1	Confident	10 Å²	10	48.9 Å²	48.9	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-73.9	-33.2	179.7	-68	0	0	0	0	111.3	N49 R54 R55 F56	N49-S52 PolarHBondContact O-N 3.15Å; N49-S52 WeakPolarHBondContact OD1-CB 3.13Å; N49-S52 PolarHBondContact OD1-N 2.94Å; N49-S52 PolarHBondContact OD1-OG 3.41Å; S52-R54 VanDerWaalsContact C-N 3.34Å; S52-R55 PolarHBondContact O-N 3.2Å; S52-F56 WeakPolarHBondContact O-CB 3.23Å; S52-F56 PolarHBondContact O-N 3.34Å
53	Q	76.8	Confident	77	Confident	15 Å²	15	43.5 Å²	43.5	7%	0.07	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-45.8	167.8	-74	178.1	-4.9	0	0	111.4	F45 I48 N49 F56 L57 L148	F45-Q53 HydrophobicContact CD2-CG 4.36Å; F45-Q53 HydrophobicContact CE2-CB 4.05Å; F45-Q53 HydrophobicContact CE2-CG 4.11Å; F45-Q53 HydrophobicContact CZ-CB 4.17Å; F45-Q53 HydrophobicContact CZ-CG 4.28Å; F45-Q53 WeakPolarHBondContact O-CG 3.4Å; F45-Q53 PolarHBondContact O-NE2 3.06Å; I48-Q53 HydrophobicContact CB-CG 4.49Å; I48-Q53 PolarHBondContact O-NE2 2.86Å; N49-Q53 WeakPolarHBondContact O-CG 3.38Å; N49-Q53 PolarHBondContact O-N 2.99Å; Q53-F56 PolarHBondContact O-N 3.46Å; Q53-L57 WeakPolarHBondContact O-CB 3.46Å; Q53-L57 PolarHBondContact O-N 3.36Å; Q53-L148 HydrophobicContact CB-CD1 4.07Å; Q53-L148 HydrophobicContact CB-CD2 4.47Å
54	R	73.5	Confident	76.9	Confident	48 Å²	48	38.9 Å²	38.9	18%	0.181	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-45.1	177.8	-176.1	176.5	174.1	-170.3	-5.5	112.1	D50 I51 S52 F56 L57 V58 L148 T151 I264 S268	D50-R54 VanDerWaalsContact O-CB 3.23Å; D50-R54 WeakPolarHBondContact O-CB 3.38Å; D50-R54 PolarHBondContact O-N 3.02Å; I51-R54 PolarHBondContact O-N 3.27Å; S52-R54 VanDerWaalsContact C-N 3.34Å; R54-F56 VanDerWaalsContact C-N 3.34Å; R54-F56 PolarHBondContact O-N 3.2Å; R54-L57 PolarHBondContact O-N 3.42Å; R54-V58 HydrophobicContact CG-CG2 4.44Å; R54-V58 VanDerWaalsContact O-CG2 3.27Å; R54-V58 WeakPolarHBondContact O-CG2 3.31Å; R54-V58 PolarHBondContact O-N 3.14Å; R54-L148 HydrophobicContact CB-CD2 3.96Å; R54-T151 HydrophobicContact CG-CG2 4.16Å; R54-I264 HydrophobicContact CG-CG2 4.27Å; R54-I264 PolarHBondContact NH2-O 3.32Å; R54-S268 PolarHBondContact NH2-OG 3.06Å
55	R	74.1	Confident	76.2	Confident	56 Å²	56	44 Å²	44	21%	0.211	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-46.4	175.3	-77.1	175.5	-178.2	-172.3	5.5	111.8	I51 S52 G59 L258 I264	I51-R55 WeakPolarHBondContact O-CG 2.91Å; I51-R55 PolarHBondContact O-N 3.4Å; S52-R55 PolarHBondContact O-N 3.2Å; R55-G59 PolarHBondContact O-N 3.36Å; R55-L258 HydrophobicContact CB-CD2 4.05Å; R55-I264 HydrophobicContact CB-CD1 4.04Å; R55-I264 HydrophobicContact CG-CD1 3.36Å
56	F	81.7	Confident	76.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-45.7	178.7	-177.2	-106.5	0	0	0	111.9	T41 W44 F45 S52 Q53 R54 G59 I60 M118 I121 L122 Y136 L140	T41-F56 HydrophobicContact CG2-CE1 4.15Å; W44-F56 AromaticContact CH2-CD1 3.81Å; W44-F56 HydrophobicContact CH2-CD1 3.81Å; W44-F56 AromaticContact CH2-CD2 3.9Å; W44-F56 HydrophobicContact CH2-CD2 3.9Å; W44-F56 AromaticContact CH2-CE1 3.74Å; W44-F56 HydrophobicContact CH2-CE1 3.74Å; W44-F56 AromaticContact CH2-CE2 3.84Å; W44-F56 HydrophobicContact CH2-CE2 3.84Å; W44-F56 AromaticContact CH2-CG 3.88Å; W44-F56 HydrophobicContact CH2-CG 3.88Å; W44-F56 AromaticContact CH2-CZ 3.76Å; W44-F56 HydrophobicContact CH2-CZ 3.76Å; W44-F56 HydrophobicContact CZ2-CE1 4.36Å; W44-F56 HydrophobicContact CZ2-CE2 4.25Å; W44-F56 HydrophobicContact CZ2-CZ 4.06Å; W44-F56 HydrophobicContact CZ3-CD1 4.41Å; W44-F56 HydrophobicContact CZ3-CG 4.49Å; F45-F56 AromaticContact CD2-CD1 3.96Å; F45-F56 HydrophobicContact CD2-CD1 3.96Å; F45-F56 HydrophobicContact CD2-CE1 4.47Å; F45-F56 AromaticContact CE2-CD1 3.85Å; F45-F56 HydrophobicContact CE2-CD1 3.85Å; S52-F56 WeakPolarHBondContact O-CB 3.23Å; S52-F56 PolarHBondContact O-N 3.34Å; Q53-F56 PolarHBondContact O-N 3.46Å; R54-F56 VanDerWaalsContact C-N 3.34Å; R54-F56 PolarHBondContact O-N 3.2Å; F56-G59 PolarHBondContact O-N 3.17Å; F56-I60 HydrophobicContact CD1-CG1 4.44Å; F56-I60 HydrophobicContact CE1-CG1 4.05Å; F56-I60 HydrophobicContact CE2-CD1 4.44Å; F56-I60 HydrophobicContact CE2-CG1 4.32Å; F56-I60 HydrophobicContact CZ-CD1 4.1Å; F56-I60 HydrophobicContact CZ-CG1 3.98Å; F56-I60 WeakPolarHBondContact O-CG1 3.42Å; F56-I60 PolarHBondContact O-N 3.38Å; F56-M118 HydrophobicContact CB-CE 4.37Å; F56-M118 HydrophobicContact CB-SD 4.1Å; F56-M118 HydrophobicContact CD2-CB 3.92Å; F56-M118 HydrophobicContact CD2-CG 3.82Å; F56-M118 HydrophobicContact CD2-SD 4.19Å; F56-M118 HydrophobicContact CE2-CB 4.24Å; F56-M118 HydrophobicContact CE2-CG 4.33Å; F56-M118 HydrophobicContact CG-CG 4.47Å; F56-M118 HydrophobicContact CG-SD 4.46Å; F56-I121 HydrophobicContact CE2-CB 4.39Å; F56-I121 HydrophobicContact CE2-CG2 4.28Å; F56-I121 HydrophobicContact CZ-CB 4.4Å; F56-I121 HydrophobicContact CZ-CG2 3.88Å; F56-L122 HydrophobicContact CD2-CD1 4.35Å; F56-L122 HydrophobicContact CD2-CG 4.29Å; F56-L122 HydrophobicContact CE2-CD2 4.4Å; F56-L122 HydrophobicContact CE2-CG 4.05Å; F56-Y136 WeakPolarHBondContact CZ-OH 3.35Å; F56-L140 HydrophobicContact CD1-CD2 4.49Å; F56-L140 HydrophobicContact CE1-CD1 4.17Å; F56-L140 HydrophobicContact CE1-CD2 4.19Å
57	L	82.6	Confident	76.2	Confident	1 Å²	1	44 Å²	44	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-46.8	177.9	-178.8	63.2	0	0	0	112	Q53 R54 G59 I60 L61 L140 L141 L148 A152	Q53-L57 WeakPolarHBondContact O-CB 3.46Å; Q53-L57 PolarHBondContact O-N 3.36Å; R54-L57 PolarHBondContact O-N 3.42Å; L57-G59 VanDerWaalsContact C-N 3.32Å; L57-G59 PolarHBondContact O-N 2.97Å; L57-I60 PolarHBondContact O-N 3.06Å; L57-L61 HydrophobicContact CD1-CD1 4.38Å; L57-L61 HydrophobicContact CG-CD1 4.21Å; L57-L61 VanDerWaalsContact O-CG 3.28Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 3.42Å; L57-L140 HydrophobicContact CD1-CD2 3.87Å; L57-L140 HydrophobicContact CD1-CG 4.24Å; L57-L141 HydrophobicContact CD1-CD2 4.47Å; L57-L148 HydrophobicContact CD2-CB 3.97Å; L57-L148 HydrophobicContact CD2-CD2 4.22Å; L57-L148 WeakPolarHBondContact CD2-O 3.23Å; L57-A152 HydrophobicContact CD2-CB 4.14Å
58	V	77.3	Confident	76.4	Confident	2 Å²	2	39 Å²	39	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-63.6	-39.5	176.6	176.1	0	0	0	0	111	R54 L61 K62 V155 V259 I264 L267	R54-V58 HydrophobicContact CG-CG2 4.44Å; R54-V58 VanDerWaalsContact O-CG2 3.27Å; R54-V58 WeakPolarHBondContact O-CG2 3.31Å; R54-V58 PolarHBondContact O-N 3.14Å; V58-L61 PolarHBondContact O-N 3.34Å; V58-K62 WeakPolarHBondContact O-CB 3.21Å; V58-K62 PolarHBondContact O-N 2.87Å; V58-V155 HydrophobicContact CG1-CG1 4.41Å; V58-V155 HydrophobicContact CG2-CG2 4.12Å; V58-V259 HydrophobicContact CG1-CG2 4.36Å; V58-I264 HydrophobicContact CB-CG1 4.47Å; V58-I264 HydrophobicContact CG1-CG1 4.25Å; V58-L267 HydrophobicContact CG1-CD1 4.29Å
59	G	77.4	Confident	76.6	Confident	3 Å²	3	38.5 Å²	38.5	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-46.1	175	0	0	0	0	0	112.9	R55 F56 L57 K62 Q63	R55-G59 PolarHBondContact O-N 3.36Å; F56-G59 PolarHBondContact O-N 3.17Å; L57-G59 VanDerWaalsContact C-N 3.32Å; L57-G59 PolarHBondContact O-N 2.97Å; G59-K62 PolarHBondContact O-N 3.47Å; G59-Q63 WeakPolarHBondContact O-CG 3.38Å; G59-Q63 PolarHBondContact O-N 3.29Å
60	I	83.6	Confident	77	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-45.2	176.1	-69.3	-70.5	0	0	0	111.2	F56 L57 K62 Q63 L122 F125 Y136 L140	F56-I60 HydrophobicContact CD1-CG1 4.44Å; F56-I60 HydrophobicContact CE1-CG1 4.05Å; F56-I60 HydrophobicContact CE2-CD1 4.44Å; F56-I60 HydrophobicContact CE2-CG1 4.32Å; F56-I60 HydrophobicContact CZ-CD1 4.1Å; F56-I60 HydrophobicContact CZ-CG1 3.98Å; F56-I60 WeakPolarHBondContact O-CG1 3.42Å; F56-I60 PolarHBondContact O-N 3.38Å; L57-I60 PolarHBondContact O-N 3.06Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.42Å; I60-Q63 PolarHBondContact O-N 2.97Å; I60-L122 HydrophobicContact CD1-CD2 3.66Å; I60-L122 HydrophobicContact CG1-CD2 3.9Å; I60-F125 HydrophobicContact CD1-CB 3.99Å; I60-F125 HydrophobicContact CD1-CD1 3.93Å; I60-F125 HydrophobicContact CD1-CD2 4.04Å; I60-F125 HydrophobicContact CD1-CE1 4.41Å; I60-F125 HydrophobicContact CD1-CE2 4.49Å; I60-F125 HydrophobicContact CD1-CG 3.72Å; I60-F125 HydrophobicContact CG2-CD1 4.48Å; I60-F125 HydrophobicContact CG2-CE1 3.94Å; I60-F125 HydrophobicContact CG2-CE2 4.1Å; I60-F125 HydrophobicContact CG2-CZ 3.73Å; I60-F125 WeakPolarHBondContact O-CE1 3.43Å; I60-Y136 HydrophobicContact CD1-CD1 4.38Å; I60-Y136 HydrophobicContact CD1-CE1 3.8Å; I60-Y136 HydrophobicContact CG1-CE1 4.32Å; I60-L140 HydrophobicContact CB-CD2 4.21Å; I60-L140 HydrophobicContact CG1-CD2 4.1Å; I60-L140 HydrophobicContact CG2-CD2 4.05Å
61	L	82.3	Confident	77.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.2	-35.4	-179.1	-67.7	174.1	0	0	0	112.7	L57 V58 Q63 L64 T137 A152 V155 I156 L159	L57-L61 HydrophobicContact CD1-CD1 4.38Å; L57-L61 HydrophobicContact CG-CD1 4.21Å; L57-L61 VanDerWaalsContact O-CG 3.28Å; L57-L61 WeakPolarHBondContact O-CG 3.45Å; L57-L61 PolarHBondContact O-N 3.42Å; V58-L61 PolarHBondContact O-N 3.34Å; L61-Q63 PolarHBondContact O-N 3.27Å; L61-L64 HydrophobicContact CD2-CD1 3.75Å; L61-L64 WeakPolarHBondContact O-CB 3.31Å; L61-L64 PolarHBondContact O-N 3.47Å; L61-T137 HydrophobicContact CD2-CG2 4.08Å; L61-A152 HydrophobicContact CD1-CB 3.66Å; L61-V155 HydrophobicContact CB-CG1 4.23Å; L61-V155 HydrophobicContact CD1-CB 4.34Å; L61-V155 HydrophobicContact CD1-CG1 4.24Å; L61-I156 HydrophobicContact CD1-CD1 4.43Å; L61-I156 HydrophobicContact CD1-CG1 4.26Å; L61-I156 HydrophobicContact CD2-CD1 3.8Å; L61-I156 HydrophobicContact CD2-CG1 3.89Å; L61-L159 HydrophobicContact CB-CD1 4.45Å; L61-L159 WeakPolarHBondContact O-CD1 3.44Å
62	K	78.2	Confident	78.5	Confident	101 Å²	101	35.7 Å²	35.7	44%	0.439	16%	0.164	S	C	.	.	H	α-helix	trans	-65.9	-24.4	175.8	-169.3	176.7	179.2	-179.2	0	112.8	V58 G59 I60 L64 N65 V259	V58-K62 WeakPolarHBondContact O-CB 3.21Å; V58-K62 PolarHBondContact O-N 2.87Å; G59-K62 PolarHBondContact O-N 3.47Å; I60-K62 VanDerWaalsContact C-N 3.35Å; I60-K62 PolarHBondContact O-N 3.42Å; K62-L64 VanDerWaalsContact C-N 3.33Å; K62-N65 PolarHBondContact O-OD1 3.15Å; K62-V259 HydrophobicContact CD-CG2 4.21Å
63	Q	80.3	Confident	79.1	Confident	22 Å²	22	35.2 Å²	35.2	10%	0.103	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	0.6	179.3	-67.9	175.4	0.3	0	0	113.7	G59 I60 L61 N65 L122 F125 K133	G59-Q63 WeakPolarHBondContact O-CG 3.38Å; G59-Q63 PolarHBondContact O-N 3.29Å; I60-Q63 PolarHBondContact O-N 2.97Å; L61-Q63 PolarHBondContact O-N 3.27Å; Q63-N65 PolarHBondContact O-N 3.44Å; Q63-L122 PolarHBondContact OE1-O 3.01Å; Q63-L122 VanDerWaalsContact OE1-O 3.06Å; Q63-F125 HydrophobicContact CB-CD1 3.92Å; Q63-F125 HydrophobicContact CB-CE1 3.99Å; Q63-K133 PolarHBondContact O-NZ 3.27Å
64	L	76.7	Confident	79.3	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	17%	0.17	C	C	.	.			trans	-77.9	70.2	168.9	-63.3	173	0	0	0	109.4	L61 K62 S66 L69 L70 F73 F125 K133 T137	L61-L64 HydrophobicContact CD2-CD1 3.75Å; L61-L64 WeakPolarHBondContact O-CB 3.31Å; L61-L64 PolarHBondContact O-N 3.47Å; K62-L64 VanDerWaalsContact C-N 3.33Å; L64-S66 PolarHBondContact O-N 3.1Å; L64-L69 HydrophobicContact CD2-CD1 4.13Å; L64-L70 HydrophobicContact CB-CD2 3.99Å; L64-L70 HydrophobicContact CD1-CD2 4.3Å; L64-F73 HydrophobicContact CD1-CD2 4.11Å; L64-F73 HydrophobicContact CD1-CE2 4.3Å; L64-F125 HydrophobicContact CD2-CE1 4.28Å; L64-F125 HydrophobicContact CD2-CZ 3.92Å; L64-K133 HydrophobicContact CD2-CB 4.15Å; L64-T137 HydrophobicContact CD1-CG2 4.31Å
65	N	67.7	Low	79.6	Confident	124 Å²	124	38.8 Å²	38.8	66%	0.663	18%	0.182	S	C	*	.			trans	-76	45.7	179.9	-60	-2.2	0	0	0	112.1	K62 Q63	K62-N65 PolarHBondContact O-OD1 3.15Å; Q63-N65 PolarHBondContact O-N 3.44Å
66	S	79.5	Confident	80	Confident	19 Å²	19	39.2 Å²	39.2	13%	0.133	19%	0.188	C	C	.	.			trans	-146.5	116.6	-179.9	174.1	0	0	0	0	110.1	L64 Y68 L69 L70	L64-S66 PolarHBondContact O-N 3.1Å; S66-Y68 PolarHBondContact O-N 2.77Å; S66-Y68 VanDerWaalsContact O-N 3.15Å; S66-L69 PolarHBondContact O-N 3Å; S66-L70 PolarHBondContact O-N 2.91Å
67	L	78.9	Confident	79.8	Confident	65 Å²	65	39.7 Å²	39.7	34%	0.34	19%	0.191	S	C	.	.	H	α-helix	trans	-55.6	-33.3	178.3	-166.5	127.3	0	0	0	112.3	H71 F160 E163 I167	L67-H71 WeakPolarHBondContact O-CB 3.48Å; L67-H71 PolarHBondContact O-N 3.48Å; L67-F160 HydrophobicContact CD2-CE2 4.3Å; L67-F160 HydrophobicContact CG-CE2 4.09Å; L67-E163 HydrophobicContact CD1-CB 4.47Å; L67-E163 PolarHBondContact N-OE2 3.27Å; L67-I167 HydrophobicContact CD1-CD1 3.65Å
68	Y	78.8	Confident	79.4	Confident	110 Å²	110	45.6 Å²	45.6	43%	0.431	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-43.2	176.1	-175.3	-93	0	0	0	112.3	S66 H71 Y72 M237	S66-Y68 PolarHBondContact O-N 2.77Å; S66-Y68 VanDerWaalsContact O-N 3.15Å; Y68-H71 PolarHBondContact O-N 3.44Å; Y68-Y72 WeakPolarHBondContact O-CB 3.36Å; Y68-Y72 PolarHBondContact O-N 2.85Å; Y68-M237 HydrophobicContact CE1-CG 4.14Å; Y68-M237 HydrophobicContact CE1-SD 4.1Å; Y68-M237 WeakPolarHBondContact OH-CG 3.32Å
69	L	81.5	Confident	78.8	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-68.9	-40.1	177.9	-69.7	177.7	0	0	0	111.4	L64 S66 Y72 F73 Q130 K133 A134	L64-L69 HydrophobicContact CD2-CD1 4.13Å; S66-L69 PolarHBondContact O-N 3Å; L69-Y72 PolarHBondContact O-N 3.36Å; L69-F73 WeakPolarHBondContact O-CD2 3.45Å; L69-F73 PolarHBondContact O-N 3.42Å; L69-Q130 HydrophobicContact CD1-CB 4.41Å; L69-K133 HydrophobicContact CD1-CB 4.26Å; L69-A134 HydrophobicContact CD2-CB 3.87Å
70	L	82.4	Confident	78.2	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-45	175.2	-67.5	-177.6	0	0	0	111.4	L64 S66 Y72 F73 Q74 I156 L159 F160 E163	L64-L70 HydrophobicContact CB-CD2 3.99Å; L64-L70 HydrophobicContact CD1-CD2 4.3Å; S66-L70 PolarHBondContact O-N 2.91Å; L70-Y72 PolarHBondContact O-N 2.94Å; L70-F73 PolarHBondContact O-N 3.14Å; L70-Q74 WeakPolarHBondContact O-CB 3.19Å; L70-Q74 PolarHBondContact O-N 3.18Å; L70-I156 HydrophobicContact CD2-CG2 4.34Å; L70-I156 WeakPolarHBondContact O-CG2 3.34Å; L70-L159 HydrophobicContact CD1-CB 4.06Å; L70-L159 HydrophobicContact CD2-CB 4.4Å; L70-F160 HydrophobicContact CB-CB 4.49Å; L70-F160 HydrophobicContact CB-CD2 4.11Å; L70-E163 WeakPolarHBondContact CD1-OE2 3.32Å
71	H	79.6	Confident	77	Confident	83 Å²	83	54.6 Å²	54.6	38%	0.384	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.1	-170.1	61.6	0	0	0	112.1	L67 Y68 F73 Q74 N75 F160	L67-H71 WeakPolarHBondContact O-CB 3.48Å; L67-H71 PolarHBondContact O-N 3.48Å; Y68-H71 PolarHBondContact O-N 3.44Å; H71-F73 PolarHBondContact O-N 3.4Å; H71-Q74 PolarHBondContact O-N 3.14Å; H71-N75 PolarHBondContact NE2-ND2 2.98Å; H71-N75 VanDerWaalsContact NE2-ND2 3.18Å; H71-N75 PolarHBondContact O-N 3.41Å; H71-N75 VanDerWaalsContact O-N 3.1Å; H71-F160 HydrophobicContact CB-CE2 3.98Å
72	Y	83.6	Confident	75.8	Confident	74 Å²	74	56.2 Å²	56.2	29%	0.29	28%	0.284	S	S	.	.	H	α-helix	trans	-57.5	-48.9	176.1	176.6	-105	0	0	0	112.1	Y68 L69 L70 N75 I76 M237	Y68-Y72 WeakPolarHBondContact O-CB 3.36Å; Y68-Y72 PolarHBondContact O-N 2.85Å; L69-Y72 PolarHBondContact O-N 3.36Å; L70-Y72 PolarHBondContact O-N 2.94Å; Y72-N75 PolarHBondContact O-N 2.89Å; Y72-I76 HydrophobicContact CD1-CD1 3.92Å; Y72-I76 HydrophobicContact CE1-CD1 3.4Å; Y72-I76 VanDerWaalsContact CE1-CD1 3.4Å; Y72-I76 HydrophobicContact CE2-CD1 4.08Å; Y72-I76 HydrophobicContact CG-CD1 4.47Å; Y72-I76 VanDerWaalsContact CZ-CD1 3.5Å; Y72-I76 WeakPolarHBondContact O-CG1 3.38Å; Y72-I76 PolarHBondContact O-N 3.06Å; Y72-M237 HydrophobicContact CD2-CE 4.36Å; Y72-M237 HydrophobicContact CE2-CE 3.97Å
73	F	83.9	Confident	74.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-73.4	-29.2	179.1	-72.5	-65.3	0	0	0	113.6	L64 L69 L70 H71 N75 I76 L77 A134 T137 L138 L141 I156	L64-F73 HydrophobicContact CD1-CD2 4.11Å; L64-F73 HydrophobicContact CD1-CE2 4.3Å; L69-F73 WeakPolarHBondContact O-CD2 3.45Å; L69-F73 PolarHBondContact O-N 3.42Å; L70-F73 PolarHBondContact O-N 3.14Å; H71-F73 PolarHBondContact O-N 3.4Å; F73-N75 VanDerWaalsContact C-N 3.33Å; F73-I76 HydrophobicContact CD1-CD1 4.26Å; F73-I76 PolarHBondContact O-N 3.48Å; F73-L77 WeakPolarHBondContact O-CB 3.21Å; F73-L77 WeakPolarHBondContact O-CG 3.4Å; F73-L77 PolarHBondContact O-N 2.88Å; F73-A134 WeakPolarHBondContact CZ-O 3.22Å; F73-T137 HydrophobicContact CD1-CG2 4.37Å; F73-T137 HydrophobicContact CD2-CG2 4.24Å; F73-T137 HydrophobicContact CE1-CG2 3.89Å; F73-T137 HydrophobicContact CE2-CG2 3.76Å; F73-T137 HydrophobicContact CZ-CG2 3.58Å; F73-L138 HydrophobicContact CE1-CB 4.36Å; F73-L138 HydrophobicContact CE1-CD1 4.47Å; F73-L141 HydrophobicContact CD1-CD1 3.82Å; F73-L141 HydrophobicContact CE1-CD1 4.03Å; F73-I156 HydrophobicContact CB-CD1 3.76Å
74	Q	82.4	Confident	72.9	Confident	57 Å²	57	65.2 Å²	65.2	27%	0.266	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-43.3	172.5	-178.6	177.1	-3.5	0	0	111.6	L70 H71 L77 Q78 I156	L70-Q74 WeakPolarHBondContact O-CB 3.19Å; L70-Q74 PolarHBondContact O-N 3.18Å; H71-Q74 PolarHBondContact O-N 3.14Å; Q74-L77 PolarHBondContact O-N 3.3Å; Q74-Q78 PolarHBondContact O-N 3.4Å; Q74-I156 HydrophobicContact CB-CG2 4.13Å
75	N	79.2	Confident	71.7	Confident	81 Å²	81	67.6 Å²	67.6	43%	0.433	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-41.6	177.7	-70.9	-19.8	0	0	0	111.6	H71 Y72 F73 L77 Q78	H71-N75 PolarHBondContact NE2-ND2 2.98Å; H71-N75 VanDerWaalsContact NE2-ND2 3.18Å; H71-N75 PolarHBondContact O-N 3.41Å; H71-N75 VanDerWaalsContact O-N 3.1Å; Y72-N75 PolarHBondContact O-N 2.89Å; F73-N75 VanDerWaalsContact C-N 3.33Å; N75-L77 PolarHBondContact O-N 3.28Å; N75-Q78 WeakPolarHBondContact O-CB 3.49Å; N75-Q78 PolarHBondContact O-N 2.86Å
76	I	82	Confident	70.9	Confident	64 Å²	64	65.8 Å²	65.8	33%	0.328	33%	0.329	S	S	.	.	H	α-helix	trans	-62	-44.6	176.5	-68.4	171.9	0	0	0	111.2	Y72 F73 Q78 T79 L138	Y72-I76 HydrophobicContact CD1-CD1 3.92Å; Y72-I76 HydrophobicContact CE1-CD1 3.4Å; Y72-I76 VanDerWaalsContact CE1-CD1 3.4Å; Y72-I76 HydrophobicContact CE2-CD1 4.08Å; Y72-I76 HydrophobicContact CG-CD1 4.47Å; Y72-I76 VanDerWaalsContact CZ-CD1 3.5Å; Y72-I76 WeakPolarHBondContact O-CG1 3.38Å; Y72-I76 PolarHBondContact O-N 3.06Å; F73-I76 HydrophobicContact CD1-CD1 4.26Å; F73-I76 PolarHBondContact O-N 3.48Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 3.4Å; I76-T79 PolarHBondContact O-OG1 3.37Å; I76-L138 HydrophobicContact CD1-CD1 4.45Å
77	L	79	Confident	69.4	Low	11 Å²	11	73.7 Å²	73.7	6%	0.058	36%	0.357	C	S	.	.	H	α-helix	trans	-83.4	-0.6	-176.2	-66.6	172.4	0	0	0	113.6	F73 Q74 N75 T79 T80 L141 L149 A152 A153 I156	F73-L77 WeakPolarHBondContact O-CB 3.21Å; F73-L77 WeakPolarHBondContact O-CG 3.4Å; F73-L77 PolarHBondContact O-N 2.88Å; Q74-L77 PolarHBondContact O-N 3.3Å; N75-L77 PolarHBondContact O-N 3.28Å; L77-T79 PolarHBondContact O-N 2.81Å; L77-T80 HydrophobicContact CD2-CG2 4Å; L77-T80 WeakPolarHBondContact O-CB 3.34Å; L77-T80 PolarHBondContact O-N 3.19Å; L77-T80 PolarHBondContact O-OG1 2.96Å; L77-L141 HydrophobicContact CD1-CD1 4.47Å; L77-L149 HydrophobicContact CD2-CD2 4.29Å; L77-A152 HydrophobicContact CD1-CB 4.24Å; L77-A153 HydrophobicContact CB-CB 4Å; L77-A153 HydrophobicContact CD1-CB 4.19Å; L77-I156 HydrophobicContact CD1-CD1 3.59Å
78	Q	72.8	Confident	67.9	Low	124 Å²	124	74 Å²	74	58%	0.579	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-57.3	-33.1	176.1	-169	178.7	12.8	0	0	112	Q74 N75 I76 T80 Q81	Q74-Q78 PolarHBondContact O-N 3.4Å; N75-Q78 WeakPolarHBondContact O-CB 3.49Å; N75-Q78 PolarHBondContact O-N 2.86Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 3.4Å; Q78-T80 VanDerWaalsContact C-N 3.26Å; Q78-T80 PolarHBondContact O-N 3.21Å; Q78-Q81 VanDerWaalsContact O-CB 3.28Å; Q78-Q81 WeakPolarHBondContact O-CB 3.31Å; Q78-Q81 PolarHBondContact O-N 3.29Å
79	T	65.8	Low	66.5	Low	107 Å²	107	73.8 Å²	73.8	66%	0.656	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-63.3	-28.3	176.9	55.7	0	0	0	0	113.4	I76 L77 Q81 G82	I76-T79 PolarHBondContact O-OG1 3.37Å; L77-T79 PolarHBondContact O-N 2.81Å; T79-Q81 PolarHBondContact O-N 3.18Å; T79-Q81 VanDerWaalsContact O-N 3.15Å; T79-G82 PolarHBondContact O-N 3.48Å
80	T	64.6	Low	64.9	Low	6 Å²	6	77.8 Å²	77.8	4%	0.037	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-69.7	-7.3	174.6	70.7	0	0	0	0	113.2	L77 Q78 F85	L77-T80 HydrophobicContact CD2-CG2 4Å; L77-T80 WeakPolarHBondContact O-CB 3.34Å; L77-T80 PolarHBondContact O-N 3.19Å; L77-T80 PolarHBondContact O-OG1 2.96Å; Q78-T80 VanDerWaalsContact C-N 3.26Å; Q78-T80 PolarHBondContact O-N 3.21Å; T80-F85 HydrophobicContact CG2-CE1 4.44Å; T80-F85 HydrophobicContact CG2-CE2 4.39Å; T80-F85 HydrophobicContact CG2-CZ 4.18Å; T80-F85 WeakPolarHBondContact O-CB 3.45Å; T80-F85 WeakPolarHBondContact O-CG 3.19Å
81	Q	58.9	Low	63.1	Low	82 Å²	82	87.8 Å²	87.8	38%	0.383	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-91.2	-3.7	173.6	-52.2	-177.1	4.3	0	0	112.8	Q78 T79	Q78-Q81 VanDerWaalsContact O-CB 3.28Å; Q78-Q81 WeakPolarHBondContact O-CB 3.31Å; Q78-Q81 PolarHBondContact O-N 3.29Å; T79-Q81 PolarHBondContact O-N 3.18Å; T79-Q81 VanDerWaalsContact O-N 3.15Å
82	G	56.6	Low	61.6	Low	33 Å²	33	86 Å²	86	34%	0.34	42%	0.417	S	S	.	.	S	Bend	trans	-71.9	172.4	177.3	0	0	0	0	0	114.4	T79 D84 F85 I86	T79-G82 PolarHBondContact O-N 3.48Å; G82-D84 VanDerWaalsContact C-N 3.31Å; G82-D84 PolarHBondContact O-N 2.91Å; G82-F85 PolarHBondContact O-N 3.4Å; G82-I86 WeakPolarHBondContact O-CG1 3.16Å
83	K	50.7	Low	59.5	Low	170 Å²	170	88.6 Å²	88.6	74%	0.739	44%	0.435	S	S	*	.	H	α-helix	trans	-57.6	-33.6	-169.1	-70.1	179.7	179.2	175.4	0	114.8	F85 I86	K83-F85 PolarHBondContact O-N 3.49Å; K83-I86 HydrophobicContact CB-CD1 4.5Å; K83-I86 HydrophobicContact CG-CD1 4.36Å; K83-I86 VanDerWaalsContact O-CB 3.23Å; K83-I86 WeakPolarHBondContact O-CB 3.32Å; K83-I86 PolarHBondContact O-N 3.35Å; K83-I86 VanDerWaalsContact O-N 3.1Å
84	D	47.2	Very low	57.6	Low	142 Å²	142	95.2 Å²	95.2	76%	0.759	47%	0.47	S	S	*	.	H	α-helix	trans	-72.8	-28	-174.9	-55.1	-36.2	0	0	0	113	G82 I86	G82-D84 VanDerWaalsContact C-N 3.31Å; G82-D84 PolarHBondContact O-N 2.91Å; D84-I86 VanDerWaalsContact C-N 3.35Å
85	F	50.8	Low	55.7	Low	54 Å²	54	97 Å²	97	24%	0.237	49%	0.489	C	S	.	.	H	α-helix	trans	-81.9	-13	172.3	-76.7	-93.9	0	0	0	113	T80 G82 K83 N88 R89 P146	T80-F85 HydrophobicContact CG2-CE1 4.44Å; T80-F85 HydrophobicContact CG2-CE2 4.39Å; T80-F85 HydrophobicContact CG2-CZ 4.18Å; T80-F85 WeakPolarHBondContact O-CB 3.45Å; T80-F85 WeakPolarHBondContact O-CG 3.19Å; G82-F85 PolarHBondContact O-N 3.4Å; K83-F85 PolarHBondContact O-N 3.49Å; F85-N88 PolarHBondContact O-N 2.92Å; F85-R89 PolarHBondContact O-N 2.92Å; F85-P146 HydrophobicContact CD1-CB 4.47Å; F85-P146 HydrophobicContact CE1-CB 3.83Å
86	I	50.4	Low	53.7	Low	86 Å²	86	101.1 Å²	101.1	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-67.2	-37.1	174.7	-57.2	-179.2	0	0	0	110.7	G82 K83 D84 R89 S90	G82-I86 WeakPolarHBondContact O-CG1 3.16Å; K83-I86 HydrophobicContact CB-CD1 4.5Å; K83-I86 HydrophobicContact CG-CD1 4.36Å; K83-I86 VanDerWaalsContact O-CB 3.23Å; K83-I86 WeakPolarHBondContact O-CB 3.32Å; K83-I86 PolarHBondContact O-N 3.35Å; K83-I86 VanDerWaalsContact O-N 3.1Å; D84-I86 VanDerWaalsContact C-N 3.35Å; I86-R89 VanDerWaalsContact O-CB 3.27Å; I86-R89 WeakPolarHBondContact O-CB 3.28Å; I86-R89 PolarHBondContact O-N 3.02Å; I86-S90 PolarHBondContact O-N 3.46Å
87	Y	49.2	Very low	51.9	Low	185 Å²	185	107.7 Å²	107.7	73%	0.725	53%	0.529	S	S	*	.	H	α-helix	trans	-71.2	-34.6	176.8	-80.8	-81.8	0	0	0	113.1	S90	Y87-S90 PolarHBondContact O-N 3.35Å; Y87-S90 PolarHBondContact O-OG 3.47Å
88	N	47	Very low	50.3	Low	70 Å²	70	113.7 Å²	113.7	37%	0.374	56%	0.557	S	S	.	*	H	α-helix	trans	-69.2	-35.2	170.6	-105	-14.9	0	0	0	111.5	F85 S90 R91 I92	F85-N88 PolarHBondContact O-N 2.92Å; N88-S90 VanDerWaalsContact C-N 3.27Å; N88-S90 PolarHBondContact O-N 2.96Å; N88-R91 PolarHBondContact O-N 3.33Å; N88-R91 VanDerWaalsContact O-N 3.11Å; N88-I92 WeakPolarHBondContact O-CG1 3.48Å; N88-I92 PolarHBondContact O-N 3.02Å
89	R	49.6	Very low	48.5	Very low	106 Å²	106	110.5 Å²	110.5	40%	0.4	56%	0.557	S	S	.	*	H	α-helix	trans	-56.8	-34.2	173.8	-96.6	174.1	172.6	155.9	-1	113.7	F85 I86 L150	F85-R89 PolarHBondContact O-N 2.92Å; I86-R89 VanDerWaalsContact O-CB 3.27Å; I86-R89 WeakPolarHBondContact O-CB 3.28Å; I86-R89 PolarHBondContact O-N 3.02Å; R89-L150 HydrophobicContact CG-CD2 3.76Å
90	S	47	Very low	47.5	Very low	95 Å²	95	115.4 Å²	115.4	66%	0.664	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-14.4	178.6	47.1	0	0	0	0	114.4	I86 Y87 N88	I86-S90 PolarHBondContact O-N 3.46Å; Y87-S90 PolarHBondContact O-N 3.35Å; Y87-S90 PolarHBondContact O-OG 3.47Å; N88-S90 VanDerWaalsContact C-N 3.27Å; N88-S90 PolarHBondContact O-N 2.96Å
91	R	45.8	Very low	46.3	Very low	214 Å²	214	120.5 Å²	120.5	81%	0.808	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-8	-179.8	-100.5	-174.8	168	-176.5	-2.7	114.2	N88 D93	N88-R91 PolarHBondContact O-N 3.33Å; N88-R91 VanDerWaalsContact O-N 3.11Å; R91-D93 PolarHBondContact O-N 3.23Å
92	I	46.9	Very low	45.4	Very low	46 Å²	46	123.2 Å²	123.2	24%	0.236	62%	0.622	C	S	.	*			trans	-83.8	95.7	176.5	-53.8	169.3	0	0	0	108	N88 L94 K147 L150	N88-I92 WeakPolarHBondContact O-CG1 3.48Å; N88-I92 PolarHBondContact O-N 3.02Å; I92-L94 VanDerWaalsContact C-N 3.35Å; I92-L94 HydrophobicContact CG2-CD1 4.27Å; I92-L94 HydrophobicContact CG2-CD2 4.04Å; I92-L94 HydrophobicContact CG2-CG 3.71Å; I92-L94 PolarHBondContact O-N 2.93Å; I92-K147 HydrophobicContact CD1-CB 4.45Å; I92-K147 HydrophobicContact CD1-CG 4.03Å; I92-K147 HydrophobicContact CG1-CD 4.36Å; I92-K147 HydrophobicContact CG1-CG 4.31Å; I92-L150 HydrophobicContact CD1-CD2 4.3Å
93	D	39.3	Very low	44.6	Very low	127 Å²	127	128.7 Å²	128.7	68%	0.679	64%	0.636	S	S	*	*			trans	-69.2	90.1	167	-103.5	-25.7	0	0	0	109.7	R91 S95	R91-D93 PolarHBondContact O-N 3.23Å; D93-S95 PolarHBondContact O-N 2.75Å
94	L	45	Very low	44.2	Very low	140 Å²	140	123.5 Å²	123.5	73%	0.733	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	3.2	171.1	-72.7	164.5	0	0	0	112.6	I92	I92-L94 VanDerWaalsContact C-N 3.35Å; I92-L94 HydrophobicContact CG2-CD1 4.27Å; I92-L94 HydrophobicContact CG2-CD2 4.04Å; I92-L94 HydrophobicContact CG2-CG 3.71Å; I92-L94 PolarHBondContact O-N 2.93Å
95	S	40.8	Very low	44.1	Very low	94 Å²	94	121.3 Å²	121.3	66%	0.657	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-15.1	-173.2	64	0	0	0	0	114	D93 K97	D93-S95 PolarHBondContact O-N 2.75Å; S95-K97 PolarHBondContact O-N 3.09Å; S95-K97 VanDerWaalsContact O-N 3.16Å
96	K	38.7	Very low	43.4	Very low	167 Å²	167	125.7 Å²	125.7	73%	0.726	64%	0.643	S	S	*	*	S	Bend	trans	-70.5	113.8	171.2	-78.8	-172.6	179.4	180	0	108.1	E98	K96-E98 PolarHBondContact O-N 3.26Å
97	K	43	Very low	43.3	Very low	203 Å²	203	126.2 Å²	126.2	88%	0.883	65%	0.646	S	S	*	*			trans	-47.6	112.1	156.8	-80	-177.1	174.9	-179.5	0	106	S95 G99	S95-K97 PolarHBondContact O-N 3.09Å; S95-K97 VanDerWaalsContact O-N 3.16Å; K97-G99 VanDerWaalsContact C-N 3.35Å; K97-G99 PolarHBondContact O-N 3.28Å
98	E	45.2	Very low	43.4	Very low	137 Å²	137	122 Å²	122	64%	0.64	63%	0.634	S	S	*	*			trans	-57.1	102.2	177	-74.1	177.2	169.9	0	0	107.1	K96	K96-E98 PolarHBondContact O-N 3.26Å
99	G	35.8	Very low	43.2	Very low	56 Å²	56	126 Å²	126	58%	0.577	65%	0.652	S	S	*	*			trans	-62	146.6	-178.8	0	0	0	0	0	109.5	K97 V101	K97-G99 VanDerWaalsContact C-N 3.35Å; K97-G99 PolarHBondContact O-N 3.28Å; G99-V101 PolarHBondContact O-N 3.39Å
100	K	45.1	Very low	43.3	Very low	210 Å²	210	126.5 Å²	126.5	91%	0.913	66%	0.662	S	S	*	*			trans	-44.8	103.6	171.6	-80.7	180	174.2	178.3	0	109.2	V102	K100-V102 PolarHBondContact O-N 2.98Å; K100-V102 VanDerWaalsContact O-N 3.13Å
101	V	39.7	Very low	43.8	Very low	113 Å²	113	124 Å²	124	69%	0.685	64%	0.641	S	S	*	*			trans	-64.8	115.2	174.1	176.8	0	0	0	0	106.6	G99 K103	G99-V101 PolarHBondContact O-N 3.39Å; V101-K103 PolarHBondContact O-N 2.98Å
102	V	38.8	Very low	44.6	Very low	140 Å²	140	121 Å²	121	85%	0.848	63%	0.634	S	S	*	*			trans	-62.7	107.5	169	175.8	0	0	0	0	106.6	K100 S104	K100-V102 PolarHBondContact O-N 2.98Å; K100-V102 VanDerWaalsContact O-N 3.13Å; V102-S104 PolarHBondContact O-N 2.98Å
103	K	40.9	Very low	45.6	Very low	147 Å²	147	122.8 Å²	122.8	64%	0.639	65%	0.647	S	S	*	*			trans	-75	116.7	-179.7	-69.3	-178.7	177.7	-176.6	0	108.9	V101	V101-K103 PolarHBondContact O-N 2.98Å
104	S	42.2	Very low	47.1	Very low	61 Å²	61	117.5 Å²	117.5	43%	0.427	62%	0.619	S	S	.	*			trans	-70.9	138.6	164.7	57.5	0	0	0	0	109.6	V102 L106 N107	V102-S104 PolarHBondContact O-N 2.98Å; S104-L106 PolarHBondContact O-N 3.07Å; S104-N107 PolarHBondContact O-N 2.86Å; S104-N107 VanDerWaalsContact O-N 3.11Å; S104-N107 PolarHBondContact OG-ND2 3.34Å; S104-N107 VanDerWaalsContact OG-ND2 3.16Å
105	S	44.6	Very low	48.5	Very low	97 Å²	97	114 Å²	114	68%	0.678	60%	0.599	S	S	*	*	H	α-helix	trans	-59.2	-28.4	-173.9	51.1	0	0	0	0	114.1	Q108	S105-Q108 PolarHBondContact O-N 2.78Å
106	L	37	Very low	50.1	Low	146 Å²	146	114.4 Å²	114.4	76%	0.764	59%	0.59	S	S	*	*	H	α-helix	trans	-69.5	-32.4	177.2	-108.3	149.2	0	0	0	113.5	S104 Q108	S104-L106 PolarHBondContact O-N 3.07Å; L106-Q108 VanDerWaalsContact C-N 3.33Å
107	N	48.1	Very low	52	Low	96 Å²	96	110.8 Å²	110.8	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-77.1	-21.5	177.2	-74.1	-19	0	0	0	112.4	S104 D111	S104-N107 PolarHBondContact O-N 2.86Å; S104-N107 VanDerWaalsContact O-N 3.11Å; S104-N107 PolarHBondContact OG-ND2 3.34Å; S104-N107 VanDerWaalsContact OG-ND2 3.16Å; N107-D111 VanDerWaalsContact O-CB 3.32Å; N107-D111 WeakPolarHBondContact O-CB 3.49Å; N107-D111 PolarHBondContact O-N 2.77Å
108	Q	49.9	Very low	53.8	Low	98 Å²	98	101.3 Å²	101.3	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-73	-32.7	-178	-127.8	173.9	2.2	0	0	113.4	S105 L106 K112	S105-Q108 PolarHBondContact O-N 2.78Å; L106-Q108 VanDerWaalsContact C-N 3.33Å; Q108-K112 PolarHBondContact O-N 3.38Å
109	M	44	Very low	55.3	Low	153 Å²	153	98.5 Å²	98.5	75%	0.754	52%	0.519	S	S	*	.	H	α-helix	trans	-75.3	-38.4	175.4	-87.2	-84.5	-178.2	0	0	111.9	T113	M109-T113 PolarHBondContact O-OG1 2.67Å
110	L	50.8	Low	57.5	Low	117 Å²	117	100.5 Å²	100.5	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-68.3	-40.3	174.9	-137.8	83.2	0	0	0	111.2	T113 V114	L110-T113 PolarHBondContact O-OG1 2.8Å; L110-V114 VanDerWaalsContact O-CB 3.28Å; L110-V114 WeakPolarHBondContact O-CB 3.36Å; L110-V114 WeakPolarHBondContact O-CG2 3.45Å; L110-V114 PolarHBondContact O-N 3.12Å; L110-V114 VanDerWaalsContact O-N 3.12Å
111	D	57.9	Low	59.3	Low	43 Å²	43	90.7 Å²	90.7	23%	0.23	47%	0.471	C	S	.	.	H	α-helix	trans	-65.4	-38.2	178.8	-90.4	-20	0	0	0	112.9	N107 V114 E115	N107-D111 VanDerWaalsContact O-CB 3.32Å; N107-D111 WeakPolarHBondContact O-CB 3.49Å; N107-D111 PolarHBondContact O-N 2.77Å; D111-V114 PolarHBondContact O-N 3.35Å; D111-E115 VanDerWaalsContact O-CB 3.28Å; D111-E115 WeakPolarHBondContact O-CB 3.44Å; D111-E115 VanDerWaalsContact O-CG 3.31Å; D111-E115 WeakPolarHBondContact O-CG 3.34Å; D111-E115 PolarHBondContact O-N 2.98Å
112	K	63.3	Low	61.3	Low	151 Å²	151	85.3 Å²	85.3	66%	0.657	44%	0.438	S	S	*	.	H	α-helix	trans	-66.5	-41.2	179.4	-77.5	-176.8	179.4	-177.4	0	113.2	Q108 V114 Q116	Q108-K112 PolarHBondContact O-N 3.38Å; K112-V114 VanDerWaalsContact C-N 3.32Å; K112-Q116 WeakPolarHBondContact O-CB 3.39Å; K112-Q116 PolarHBondContact O-N 3.44Å; K112-Q116 VanDerWaalsContact O-N 3.14Å
113	T	68.4	Low	63.3	Low	83 Å²	83	85 Å²	85	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-69.8	-34	177.7	53.4	0	0	0	0	111.6	M109 L110 K117	M109-T113 PolarHBondContact O-OG1 2.67Å; L110-T113 PolarHBondContact O-OG1 2.8Å; T113-K117 WeakPolarHBondContact O-CG 3.35Å; T113-K117 PolarHBondContact O-N 2.86Å
114	V	70.5	Confident	65.5	Low	15 Å²	15	80.4 Å²	80.4	9%	0.091	40%	0.402	C	S	.	.	H	α-helix	trans	-75.8	-41.6	177.3	166.8	0	0	0	0	112.3	W44 I48 L110 D111 K112 Q116 K117 M118	W44-V114 HydrophobicContact CE3-CG1 4.4Å; I48-V114 HydrophobicContact CD1-CB 4.5Å; I48-V114 HydrophobicContact CD1-CG1 3.15Å; I48-V114 HydrophobicContact CG1-CG1 3.92Å; L110-V114 VanDerWaalsContact O-CB 3.28Å; L110-V114 WeakPolarHBondContact O-CB 3.36Å; L110-V114 WeakPolarHBondContact O-CG2 3.45Å; L110-V114 PolarHBondContact O-N 3.12Å; L110-V114 VanDerWaalsContact O-N 3.12Å; D111-V114 PolarHBondContact O-N 3.35Å; K112-V114 VanDerWaalsContact C-N 3.32Å; V114-Q116 VanDerWaalsContact C-N 3.27Å; V114-Q116 PolarHBondContact O-N 2.9Å; V114-K117 CarbonylContact O-C 3.57Å; V114-K117 WeakPolarHBondContact O-CB 3.31Å; V114-K117 PolarHBondContact O-N 3.36Å; V114-K117 VanDerWaalsContact O-N 3.14Å; V114-M118 HydrophobicContact CG1-CE 4Å; V114-M118 WeakPolarHBondContact O-CG 3.28Å; V114-M118 PolarHBondContact O-N 2.87Å
115	E	73.1	Confident	67.5	Low	66 Å²	66	77.5 Å²	77.5	31%	0.308	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-38.1	173.4	-81.1	-176.6	174.3	0	0	111.4	D111 M118 K119	D111-E115 VanDerWaalsContact O-CB 3.28Å; D111-E115 WeakPolarHBondContact O-CB 3.44Å; D111-E115 VanDerWaalsContact O-CG 3.31Å; D111-E115 WeakPolarHBondContact O-CG 3.34Å; D111-E115 PolarHBondContact O-N 2.98Å; E115-M118 WeakPolarHBondContact O-CB 3.45Å; E115-M118 PolarHBondContact O-N 3.42Å; E115-K119 WeakPolarHBondContact O-CG 3.23Å; E115-K119 PolarHBondContact O-N 3.45Å
116	Q	76	Confident	69.1	Low	104 Å²	104	74.6 Å²	74.6	49%	0.486	36%	0.363	S	S	.	.	H	α-helix	trans	-62.8	-45	173.3	-170.5	63	17	0	0	111.2	K112 V114 M118 K119 E120	K112-Q116 WeakPolarHBondContact O-CB 3.39Å; K112-Q116 PolarHBondContact O-N 3.44Å; K112-Q116 VanDerWaalsContact O-N 3.14Å; V114-Q116 VanDerWaalsContact C-N 3.27Å; V114-Q116 PolarHBondContact O-N 2.9Å; Q116-M118 VanDerWaalsContact C-N 3.34Å; Q116-M118 PolarHBondContact O-N 3.4Å; Q116-K119 PolarHBondContact O-N 2.91Å; Q116-E120 WeakPolarHBondContact O-CG 3.49Å; Q116-E120 PolarHBondContact O-N 3.47Å
117	K	76.6	Confident	71.1	Confident	91 Å²	91	73.1 Å²	73.1	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-38.5	173.1	-73.4	179.6	178.5	-177.7	0	112.5	T113 V114 E120 I121	T113-K117 WeakPolarHBondContact O-CG 3.35Å; T113-K117 PolarHBondContact O-N 2.86Å; V114-K117 CarbonylContact O-C 3.57Å; V114-K117 WeakPolarHBondContact O-CB 3.31Å; V114-K117 PolarHBondContact O-N 3.36Å; V114-K117 VanDerWaalsContact O-N 3.14Å; K117-E120 PolarHBondContact O-N 3.15Å; K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.45Å; K117-I121 PolarHBondContact O-N 3.31Å
118	M	80.8	Confident	72.6	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.015	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-47.6	174.9	-71.7	-172.2	-176.2	0	0	111.1	W44 I48 F56 V114 E115 Q116 I121 L122	W44-M118 HydrophobicContact CE3-CE 4.37Å; W44-M118 HydrophobicContact CH2-CE 4.14Å; W44-M118 HydrophobicContact CH2-CG 3.62Å; W44-M118 HydrophobicContact CZ2-CG 4.16Å; W44-M118 HydrophobicContact CZ3-CE 3.64Å; W44-M118 HydrophobicContact CZ3-CG 4.05Å; I48-M118 HydrophobicContact CD1-CE 3.52Å; I48-M118 HydrophobicContact CG2-CE 4.36Å; F56-M118 HydrophobicContact CB-CE 4.37Å; F56-M118 HydrophobicContact CB-SD 4.1Å; F56-M118 HydrophobicContact CD2-CB 3.92Å; F56-M118 HydrophobicContact CD2-CG 3.82Å; F56-M118 HydrophobicContact CD2-SD 4.19Å; F56-M118 HydrophobicContact CE2-CB 4.24Å; F56-M118 HydrophobicContact CE2-CG 4.33Å; F56-M118 HydrophobicContact CG-CG 4.47Å; F56-M118 HydrophobicContact CG-SD 4.46Å; V114-M118 HydrophobicContact CG1-CE 4Å; V114-M118 WeakPolarHBondContact O-CG 3.28Å; V114-M118 PolarHBondContact O-N 2.87Å; E115-M118 WeakPolarHBondContact O-CB 3.45Å; E115-M118 PolarHBondContact O-N 3.42Å; Q116-M118 VanDerWaalsContact C-N 3.34Å; Q116-M118 PolarHBondContact O-N 3.4Å; M118-I121 PolarHBondContact O-N 3.45Å; M118-L122 WeakPolarHBondContact O-CB 3.34Å; M118-L122 VanDerWaalsContact O-CG 3.31Å; M118-L122 WeakPolarHBondContact O-CG 3.37Å; M118-L122 PolarHBondContact O-N 3.38Å
119	K	78.4	Confident	74.2	Confident	79 Å²	79	67.6 Å²	67.6	34%	0.343	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-42.7	178	-71.2	179.6	-176.6	-176.6	0	111.8	E115 Q116 I121 L122 Y123 L258	E115-K119 WeakPolarHBondContact O-CG 3.23Å; E115-K119 PolarHBondContact O-N 3.45Å; Q116-K119 PolarHBondContact O-N 2.91Å; K119-I121 VanDerWaalsContact C-N 3.32Å; K119-I121 PolarHBondContact O-N 3.28Å; K119-L122 PolarHBondContact O-N 3.49Å; K119-Y123 WeakPolarHBondContact O-CB 3.42Å; K119-Y123 PolarHBondContact O-N 3.5Å; K119-L258 HydrophobicContact CG-CD1 4.1Å
120	E	81.4	Confident	75.7	Confident	97 Å²	97	65.5 Å²	65.5	45%	0.453	32%	0.322	S	S	.	.	H	α-helix	trans	-60.6	-39.7	175.7	-75.5	174.5	-167.5	0	0	112.6	Q116 K117 W124	Q116-E120 WeakPolarHBondContact O-CG 3.49Å; Q116-E120 PolarHBondContact O-N 3.47Å; K117-E120 PolarHBondContact O-N 3.15Å; E120-W124 WeakPolarHBondContact O-CB 3.41Å; E120-W124 PolarHBondContact O-N 3.28Å
121	I	82.9	Confident	77	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-73.5	-40.7	177.4	-66.1	-176.3	0	0	0	111.2	K37 T41 W44 F56 K117 M118 K119 Y123 W124 F125 Y136	K37-I121 HydrophobicContact CD-CG1 4.14Å; T41-I121 WeakPolarHBondContact OG1-CD1 3.23Å; W44-I121 HydrophobicContact CZ2-CD1 3.97Å; F56-I121 HydrophobicContact CE2-CB 4.39Å; F56-I121 HydrophobicContact CE2-CG2 4.28Å; F56-I121 HydrophobicContact CZ-CB 4.4Å; F56-I121 HydrophobicContact CZ-CG2 3.88Å; K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.45Å; K117-I121 PolarHBondContact O-N 3.31Å; M118-I121 PolarHBondContact O-N 3.45Å; K119-I121 VanDerWaalsContact C-N 3.32Å; K119-I121 PolarHBondContact O-N 3.28Å; I121-Y123 VanDerWaalsContact C-N 3.34Å; I121-Y123 PolarHBondContact O-N 3.25Å; I121-W124 HydrophobicContact CG2-CE3 4.27Å; I121-W124 PolarHBondContact O-N 2.99Å; I121-F125 VanDerWaalsContact O-CB 3.23Å; I121-F125 WeakPolarHBondContact O-CB 3.44Å; I121-F125 PolarHBondContact O-N 3.37Å; I121-Y136 HydrophobicContact CG2-CE1 4.46Å; I121-Y136 HydrophobicContact CG2-CE2 4.4Å; I121-Y136 WeakPolarHBondContact CG2-OH 3.38Å
122	L	81.7	Confident	78.1	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-40.6	175.1	-74.7	166.8	0	0	0	111.7	F56 I60 Q63 M118 K119 F125 A126 L257	F56-L122 HydrophobicContact CD2-CD1 4.35Å; F56-L122 HydrophobicContact CD2-CG 4.29Å; F56-L122 HydrophobicContact CE2-CD2 4.4Å; F56-L122 HydrophobicContact CE2-CG 4.05Å; I60-L122 HydrophobicContact CD1-CD2 3.66Å; I60-L122 HydrophobicContact CG1-CD2 3.9Å; Q63-L122 PolarHBondContact OE1-O 3.01Å; Q63-L122 VanDerWaalsContact OE1-O 3.06Å; M118-L122 WeakPolarHBondContact O-CB 3.34Å; M118-L122 VanDerWaalsContact O-CG 3.31Å; M118-L122 WeakPolarHBondContact O-CG 3.37Å; M118-L122 PolarHBondContact O-N 3.38Å; K119-L122 PolarHBondContact O-N 3.49Å; L122-F125 PolarHBondContact O-N 3.21Å; L122-A126 WeakPolarHBondContact O-CB 3.15Å; L122-A126 PolarHBondContact O-N 2.76Å; L122-L257 HydrophobicContact CB-CB 4.41Å; L122-L257 HydrophobicContact CB-CD2 4.38Å; L122-L257 HydrophobicContact CD1-CB 4.43Å
123	Y	81.6	Confident	79.1	Confident	134 Å²	134	55.3 Å²	55.3	53%	0.525	27%	0.269	S	S	.	.	H	α-helix	trans	-64.8	-44.2	175.4	-178	-98.5	0	0	0	111.9	K119 I121 N127 L257	K119-Y123 WeakPolarHBondContact O-CB 3.42Å; K119-Y123 PolarHBondContact O-N 3.5Å; I121-Y123 VanDerWaalsContact C-N 3.34Å; I121-Y123 PolarHBondContact O-N 3.25Å; Y123-N127 PolarHBondContact O-N 2.98Å; Y123-N127 PolarHBondContact O-ND2 3.08Å; Y123-L257 HydrophobicContact CD2-CD1 4.45Å
124	W	86.2	Confident	79.8	Confident	50 Å²	50	52.3 Å²	52.3	19%	0.189	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-44.4	174.2	167.5	76	0	0	0	112.2	V33 L34 K37 E120 I121 N127 S128 T132 Y136	V33-W124 HydrophobicContact CG1-CZ2 4.17Å; L34-W124 HydrophobicContact CD1-CH2 3.9Å; K37-W124 HydrophobicContact CB-CE3 4.33Å; K37-W124 HydrophobicContact CB-CH2 3.95Å; K37-W124 HydrophobicContact CB-CZ2 4.37Å; K37-W124 HydrophobicContact CB-CZ3 3.93Å; K37-W124 HydrophobicContact CD-CD2 4.18Å; K37-W124 HydrophobicContact CD-CE3 4.21Å; K37-W124 HydrophobicContact CG-CD2 4Å; K37-W124 HydrophobicContact CG-CE3 4.04Å; K37-W124 HydrophobicContact CG-CH2 4.07Å; K37-W124 HydrophobicContact CG-CZ2 4.03Å; K37-W124 HydrophobicContact CG-CZ3 4.08Å; E120-W124 WeakPolarHBondContact O-CB 3.41Å; E120-W124 PolarHBondContact O-N 3.28Å; I121-W124 HydrophobicContact CG2-CE3 4.27Å; I121-W124 PolarHBondContact O-N 2.99Å; W124-N127 PolarHBondContact O-N 3.32Å; W124-S128 PolarHBondContact O-N 2.96Å; W124-T132 HydrophobicContact CH2-CG2 3.62Å; W124-T132 HydrophobicContact CZ2-CG2 3.58Å; W124-Y136 HydrophobicContact CH2-CD2 4.11Å; W124-Y136 AromaticContact CZ3-CD2 3.79Å; W124-Y136 HydrophobicContact CZ3-CD2 3.79Å; W124-Y136 HydrophobicContact CZ3-CE2 4.07Å; W124-Y136 HydrophobicContact CZ3-CG 4.22Å
125	F	84.4	Confident	80.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-43.2	-178.6	-175.8	-91.7	0	0	0	111.1	I60 Q63 L64 I121 L122 N127 S128 K133 Y136 T137	I60-F125 HydrophobicContact CD1-CB 3.99Å; I60-F125 HydrophobicContact CD1-CD1 3.93Å; I60-F125 HydrophobicContact CD1-CD2 4.04Å; I60-F125 HydrophobicContact CD1-CE1 4.41Å; I60-F125 HydrophobicContact CD1-CE2 4.49Å; I60-F125 HydrophobicContact CD1-CG 3.72Å; I60-F125 HydrophobicContact CG2-CD1 4.48Å; I60-F125 HydrophobicContact CG2-CE1 3.94Å; I60-F125 HydrophobicContact CG2-CE2 4.1Å; I60-F125 HydrophobicContact CG2-CZ 3.73Å; I60-F125 WeakPolarHBondContact O-CE1 3.43Å; Q63-F125 HydrophobicContact CB-CD1 3.92Å; Q63-F125 HydrophobicContact CB-CE1 3.99Å; L64-F125 HydrophobicContact CD2-CE1 4.28Å; L64-F125 HydrophobicContact CD2-CZ 3.92Å; I121-F125 VanDerWaalsContact O-CB 3.23Å; I121-F125 WeakPolarHBondContact O-CB 3.44Å; I121-F125 PolarHBondContact O-N 3.37Å; L122-F125 PolarHBondContact O-N 3.21Å; F125-N127 VanDerWaalsContact C-N 3.27Å; F125-N127 PolarHBondContact O-N 3.41Å; F125-S128 WeakPolarHBondContact O-CB 3.28Å; F125-S128 PolarHBondContact O-N 3.4Å; F125-S128 VanDerWaalsContact O-N 3.14Å; F125-S128 PolarHBondContact O-OG 3.26Å; F125-K133 HydrophobicContact CD1-CG 4.47Å; F125-K133 HydrophobicContact CD2-CG 4.48Å; F125-K133 HydrophobicContact CE1-CB 4.41Å; F125-K133 HydrophobicContact CE1-CD 4.27Å; F125-K133 HydrophobicContact CE1-CG 4.02Å; F125-K133 HydrophobicContact CE2-CB 4.01Å; F125-K133 HydrophobicContact CE2-CG 4.03Å; F125-K133 HydrophobicContact CZ-CB 3.74Å; F125-K133 HydrophobicContact CZ-CD 4.43Å; F125-K133 HydrophobicContact CZ-CG 3.78Å; F125-K133 WeakPolarHBondContact O-CE 3.36Å; F125-Y136 AromaticContact CD2-CD1 3.52Å; F125-Y136 HydrophobicContact CD2-CD1 3.52Å; F125-Y136 HydrophobicContact CD2-CE1 4.2Å; F125-Y136 AromaticContact CD2-CG 4Å; F125-Y136 HydrophobicContact CD2-CG 4Å; F125-Y136 AromaticContact CE2-CD1 3.54Å; F125-Y136 HydrophobicContact CE2-CD1 3.54Å; F125-Y136 HydrophobicContact CE2-CE1 4.48Å; F125-Y136 HydrophobicContact CE2-CG 4.07Å; F125-T137 WeakPolarHBondContact CZ-OG1 3.42Å
126	A	78.4	Confident	80.9	Confident	36 Å²	36	50.7 Å²	50.7	30%	0.298	25%	0.245	S	C	.	.	H	α-helix	trans	-54.1	-43.3	176.7	0	0	0	0	0	112.4	L122 K133	L122-A126 WeakPolarHBondContact O-CB 3.15Å; L122-A126 PolarHBondContact O-N 2.76Å; A126-K133 WeakPolarHBondContact O-CE 3.47Å; A126-K133 PolarHBondContact O-NZ 3.42Å
127	N	78.1	Confident	81.4	Confident	115 Å²	115	45.8 Å²	45.8	62%	0.615	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	6.1	-177.1	-67.2	-31.2	0	0	0	114.4	Y123 W124 F125	Y123-N127 PolarHBondContact O-N 2.98Å; Y123-N127 PolarHBondContact O-ND2 3.08Å; W124-N127 PolarHBondContact O-N 3.32Å; F125-N127 VanDerWaalsContact C-N 3.27Å; F125-N127 PolarHBondContact O-N 3.41Å
128	S	80.9	Confident	81.8	Confident	21 Å²	21	43.7 Å²	43.7	15%	0.147	22%	0.215	C	C	.	.	S	Bend	trans	-89.6	159.7	-176.5	71.4	0	0	0	0	113.8	W124 F125 K133	W124-S128 PolarHBondContact O-N 2.96Å; F125-S128 WeakPolarHBondContact O-CB 3.28Å; F125-S128 PolarHBondContact O-N 3.4Å; F125-S128 VanDerWaalsContact O-N 3.14Å; F125-S128 PolarHBondContact O-OG 3.26Å; S128-K133 WeakPolarHBondContact O-CE 3.4Å; S128-K133 WeakPolarHBondContact OG-CG 3.26Å
129	T	81.8	Confident	82	Confident	56 Å²	56	46.4 Å²	46.4	34%	0.344	23%	0.229	S	C	.	.			trans	-62.2	152.3	175.6	56.4	0	0	0	0	111.7	E30 W131 T132 K133	E30-T129 WeakPolarHBondContact OE1-CG2 3.36Å; E30-T129 PolarHBondContact OE2-OG1 3.22Å; T129-W131 PolarHBondContact O-N 3.45Å; T129-T132 WeakPolarHBondContact O-CA 3.32Å; T129-T132 WeakPolarHBondContact O-CB 3.47Å; T129-T132 PolarHBondContact O-N 3.31Å; T129-T132 PolarHBondContact OG1-N 3.1Å; T129-T132 PolarHBondContact OG1-OG1 3.32Å; T129-K133 PolarHBondContact O-N 3.33Å
130	Q	76	Confident	82.4	Confident	110 Å²	110	42.7 Å²	42.7	51%	0.514	21%	0.214	S	C	.	.	H	α-helix	trans	-57.4	-33.3	178.2	-70.7	-171.4	-9.2	0	0	112.7	L69 K133 A134	L69-Q130 HydrophobicContact CD1-CB 4.41Å; Q130-K133 PolarHBondContact O-N 3.47Å; Q130-A134 PolarHBondContact O-N 3.48Å
131	W	79.4	Confident	82.5	Confident	68 Å²	68	38.7 Å²	38.7	26%	0.258	20%	0.195	S	C	.	.	H	α-helix	trans	-61	-45.3	173	-175.9	89.3	0	0	0	112.1	T31 L34 T129 A134 N135 F241	T31-W131 HydrophobicContact CG2-CH2 4.41Å; L34-W131 HydrophobicContact CD2-CH2 4.26Å; L34-W131 HydrophobicContact CD2-CZ3 3.88Å; T129-W131 PolarHBondContact O-N 3.45Å; W131-A134 PolarHBondContact O-N 3.25Å; W131-N135 VanDerWaalsContact CD2-ND2 3.28Å; W131-N135 WeakPolarHBondContact CZ2-ND2 3.25Å; W131-N135 PolarHBondContact NE1-ND2 2.89Å; W131-N135 PolarHBondContact O-N 3.38Å; W131-N135 VanDerWaalsContact O-N 3.1Å; W131-N135 PolarHBondContact O-ND2 3.19Å; W131-N135 VanDerWaalsContact O-ND2 3.15Å; W131-F241 HydrophobicContact CB-CD1 4.35Å; W131-F241 HydrophobicContact CB-CE1 3.74Å; W131-F241 HydrophobicContact CB-CZ 4.18Å; W131-F241 HydrophobicContact CG-CE1 4.43Å
132	T	80.6	Confident	82.6	Confident	4 Å²	4	44.2 Å²	44.2	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-65.6	-41.4	177	-57.4	0	0	0	0	111	L34 W124 T129 N135 Y136	L34-T132 HydrophobicContact CD1-CG2 4.03Å; W124-T132 HydrophobicContact CH2-CG2 3.62Å; W124-T132 HydrophobicContact CZ2-CG2 3.58Å; T129-T132 WeakPolarHBondContact O-CA 3.32Å; T129-T132 WeakPolarHBondContact O-CB 3.47Å; T129-T132 PolarHBondContact O-N 3.31Å; T129-T132 PolarHBondContact OG1-N 3.1Å; T129-T132 PolarHBondContact OG1-OG1 3.32Å; T132-N135 PolarHBondContact O-N 3.3Å; T132-Y136 WeakPolarHBondContact O-CB 3.31Å; T132-Y136 PolarHBondContact O-N 2.97Å
133	K	84	Confident	82.5	Confident	25 Å²	25	46 Å²	46	11%	0.109	23%	0.23	C	C	.	.	H	α-helix	trans	-59.4	-49.4	175.8	-68	-175.2	177.9	-177	0	111.8	Q63 L64 L69 F125 A126 S128 T129 Q130 T137	Q63-K133 PolarHBondContact O-NZ 3.27Å; L64-K133 HydrophobicContact CD2-CB 4.15Å; L69-K133 HydrophobicContact CD1-CB 4.26Å; F125-K133 HydrophobicContact CD1-CG 4.47Å; F125-K133 HydrophobicContact CD2-CG 4.48Å; F125-K133 HydrophobicContact CE1-CB 4.41Å; F125-K133 HydrophobicContact CE1-CD 4.27Å; F125-K133 HydrophobicContact CE1-CG 4.02Å; F125-K133 HydrophobicContact CE2-CB 4.01Å; F125-K133 HydrophobicContact CE2-CG 4.03Å; F125-K133 HydrophobicContact CZ-CB 3.74Å; F125-K133 HydrophobicContact CZ-CD 4.43Å; F125-K133 HydrophobicContact CZ-CG 3.78Å; F125-K133 WeakPolarHBondContact O-CE 3.36Å; A126-K133 WeakPolarHBondContact O-CE 3.47Å; A126-K133 PolarHBondContact O-NZ 3.42Å; S128-K133 WeakPolarHBondContact O-CE 3.4Å; S128-K133 WeakPolarHBondContact OG-CG 3.26Å; T129-K133 PolarHBondContact O-N 3.33Å; Q130-K133 PolarHBondContact O-N 3.47Å; K133-T137 WeakPolarHBondContact O-CB 3.43Å; K133-T137 PolarHBondContact O-N 3.4Å; K133-T137 PolarHBondContact O-OG1 3.46Å
134	A	82.3	Confident	82.6	Confident	19 Å²	19	40.3 Å²	40.3	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-48.8	179.2	0	0	0	0	0	112.4	L69 F73 Q130 W131 L138	L69-A134 HydrophobicContact CD2-CB 3.87Å; F73-A134 WeakPolarHBondContact CZ-O 3.22Å; Q130-A134 PolarHBondContact O-N 3.48Å; W131-A134 PolarHBondContact O-N 3.25Å; A134-L138 WeakPolarHBondContact O-CB 3.29Å; A134-L138 PolarHBondContact O-N 3.38Å
135	N	81.9	Confident	82.2	Confident	47 Å²	47	40.4 Å²	40.4	25%	0.251	21%	0.213	S	C	.	.	H	α-helix	trans	-70.2	-39.4	-177.2	-72.5	-42.3	0	0	0	112.7	L34 W131 T132 L138 L139	L34-N135 HydrophobicContact CD2-CB 3.84Å; W131-N135 VanDerWaalsContact CD2-ND2 3.28Å; W131-N135 WeakPolarHBondContact CZ2-ND2 3.25Å; W131-N135 PolarHBondContact NE1-ND2 2.89Å; W131-N135 PolarHBondContact O-N 3.38Å; W131-N135 VanDerWaalsContact O-N 3.1Å; W131-N135 PolarHBondContact O-ND2 3.19Å; W131-N135 VanDerWaalsContact O-ND2 3.15Å; T132-N135 PolarHBondContact O-N 3.3Å; N135-L138 PolarHBondContact O-N 2.86Å; N135-L139 WeakPolarHBondContact O-CB 3.43Å; N135-L139 WeakPolarHBondContact O-CD1 3.32Å; N135-L139 WeakPolarHBondContact O-CG 3.45Å; N135-L139 PolarHBondContact O-N 3.44Å
136	Y	86.3	Confident	81.7	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-46.1	176.1	-176.6	-89.6	0	0	0	111.4	L34 I38 T41 F56 I60 I121 W124 F125 T132 L138 L139 L140	L34-Y136 HydrophobicContact CD1-CD2 3.96Å; L34-Y136 HydrophobicContact CD1-CG 4.36Å; I38-Y136 HydrophobicContact CD1-CD2 4.1Å; I38-Y136 HydrophobicContact CG1-CD2 3.52Å; I38-Y136 HydrophobicContact CG1-CE2 3.78Å; T41-Y136 WeakPolarHBondContact CG2-OH 3.47Å; T41-Y136 PolarHBondContact OG1-OH 3.46Å; F56-Y136 WeakPolarHBondContact CZ-OH 3.35Å; I60-Y136 HydrophobicContact CD1-CD1 4.38Å; I60-Y136 HydrophobicContact CD1-CE1 3.8Å; I60-Y136 HydrophobicContact CG1-CE1 4.32Å; I121-Y136 HydrophobicContact CG2-CE1 4.46Å; I121-Y136 HydrophobicContact CG2-CE2 4.4Å; I121-Y136 WeakPolarHBondContact CG2-OH 3.38Å; W124-Y136 HydrophobicContact CH2-CD2 4.11Å; W124-Y136 AromaticContact CZ3-CD2 3.79Å; W124-Y136 HydrophobicContact CZ3-CD2 3.79Å; W124-Y136 HydrophobicContact CZ3-CE2 4.07Å; W124-Y136 HydrophobicContact CZ3-CG 4.22Å; F125-Y136 AromaticContact CD2-CD1 3.52Å; F125-Y136 HydrophobicContact CD2-CD1 3.52Å; F125-Y136 HydrophobicContact CD2-CE1 4.2Å; F125-Y136 AromaticContact CD2-CG 4Å; F125-Y136 HydrophobicContact CD2-CG 4Å; F125-Y136 AromaticContact CE2-CD1 3.54Å; F125-Y136 HydrophobicContact CE2-CD1 3.54Å; F125-Y136 HydrophobicContact CE2-CE1 4.48Å; F125-Y136 HydrophobicContact CE2-CG 4.07Å; T132-Y136 WeakPolarHBondContact O-CB 3.31Å; T132-Y136 PolarHBondContact O-N 2.97Å; Y136-L138 VanDerWaalsContact C-N 3.35Å; Y136-L138 PolarHBondContact O-N 3.35Å; Y136-L139 PolarHBondContact O-N 2.96Å; Y136-L140 HydrophobicContact CE1-CD2 4.31Å; Y136-L140 WeakPolarHBondContact O-CB 3.27Å; Y136-L140 PolarHBondContact O-N 2.93Å
137	T	86.4	Confident	81.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-40.4	177.1	-59.3	0	0	0	0	111.7	L61 L64 F73 F125 K133 L139 L140 L141	L61-T137 HydrophobicContact CD2-CG2 4.08Å; L64-T137 HydrophobicContact CD1-CG2 4.31Å; F73-T137 HydrophobicContact CD1-CG2 4.37Å; F73-T137 HydrophobicContact CD2-CG2 4.24Å; F73-T137 HydrophobicContact CE1-CG2 3.89Å; F73-T137 HydrophobicContact CE2-CG2 3.76Å; F73-T137 HydrophobicContact CZ-CG2 3.58Å; F125-T137 WeakPolarHBondContact CZ-OG1 3.42Å; K133-T137 WeakPolarHBondContact O-CB 3.43Å; K133-T137 PolarHBondContact O-N 3.4Å; K133-T137 PolarHBondContact O-OG1 3.46Å; T137-L139 PolarHBondContact O-N 3.47Å; T137-L140 PolarHBondContact O-N 2.96Å; T137-L141 HydrophobicContact CG2-CD1 4.24Å; T137-L141 HydrophobicContact CG2-CG 4.45Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.35Å; T137-L141 PolarHBondContact O-N 3.47Å
138	L	84.8	Confident	81.3	Confident	47 Å²	47	41.5 Å²	41.5	25%	0.246	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-45.3	177	-174.5	68.8	0	0	0	111.9	F73 I76 A134 N135 Y136 L141 Q142	F73-L138 HydrophobicContact CE1-CB 4.36Å; F73-L138 HydrophobicContact CE1-CD1 4.47Å; I76-L138 HydrophobicContact CD1-CD1 4.45Å; A134-L138 WeakPolarHBondContact O-CB 3.29Å; A134-L138 PolarHBondContact O-N 3.38Å; N135-L138 PolarHBondContact O-N 2.86Å; Y136-L138 VanDerWaalsContact C-N 3.35Å; Y136-L138 PolarHBondContact O-N 3.35Å; L138-L141 PolarHBondContact O-N 3.45Å; L138-Q142 WeakPolarHBondContact O-CG 3.4Å; L138-Q142 PolarHBondContact O-N 2.94Å
139	L	84.3	Confident	81.3	Confident	60 Å²	60	42.1 Å²	42.1	31%	0.314	21%	0.214	S	C	.	.	H	α-helix	trans	-71.4	-30.6	179.2	-71.4	164.3	0	0	0	111.9	I38 N135 Y136 T137 Q142	I38-L139 HydrophobicContact CD1-CB 3.69Å; I38-L139 HydrophobicContact CD1-CD1 3.17Å; I38-L139 HydrophobicContact CD1-CG 4.01Å; N135-L139 WeakPolarHBondContact O-CB 3.43Å; N135-L139 WeakPolarHBondContact O-CD1 3.32Å; N135-L139 WeakPolarHBondContact O-CG 3.45Å; N135-L139 PolarHBondContact O-N 3.44Å; Y136-L139 PolarHBondContact O-N 2.96Å; T137-L139 PolarHBondContact O-N 3.47Å; L139-Q142 PolarHBondContact O-N 3.33Å
140	L	85.9	Confident	80.9	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-66	-43.5	171.1	-176.5	63.5	0	0	0	112	T41 F45 F56 L57 I60 Y136 T137 Q142 M143 C144	T41-L140 HydrophobicContact CG2-CD1 4.21Å; F45-L140 HydrophobicContact CD1-CD1 4.4Å; F45-L140 HydrophobicContact CD2-CD1 4.22Å; F45-L140 HydrophobicContact CE1-CD1 4.16Å; F45-L140 HydrophobicContact CE2-CD1 4Å; F45-L140 HydrophobicContact CG-CD1 4.43Å; F45-L140 HydrophobicContact CZ-CD1 3.96Å; F56-L140 HydrophobicContact CD1-CD2 4.49Å; F56-L140 HydrophobicContact CE1-CD1 4.17Å; F56-L140 HydrophobicContact CE1-CD2 4.19Å; L57-L140 HydrophobicContact CD1-CD2 3.87Å; L57-L140 HydrophobicContact CD1-CG 4.24Å; I60-L140 HydrophobicContact CB-CD2 4.21Å; I60-L140 HydrophobicContact CG1-CD2 4.1Å; I60-L140 HydrophobicContact CG2-CD2 4.05Å; Y136-L140 HydrophobicContact CE1-CD2 4.31Å; Y136-L140 WeakPolarHBondContact O-CB 3.27Å; Y136-L140 PolarHBondContact O-N 2.93Å; T137-L140 PolarHBondContact O-N 2.96Å; L140-Q142 VanDerWaalsContact C-N 3.26Å; L140-Q142 PolarHBondContact O-N 2.76Å; L140-M143 HydrophobicContact CB-CE 4.48Å; L140-M143 HydrophobicContact CD1-CE 3.87Å; L140-M143 PolarHBondContact O-N 3.28Å; L140-C144 PolarHBondContact O-N 3.37Å; L140-C144 PolarHBondContact O-SG 3.32Å
141	L	85.4	Confident	80.7	Confident	12 Å²	12	36.1 Å²	36.1	6%	0.063	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-34.2	176.6	-70.2	171.5	0	0	0	111.7	L57 F73 L77 T137 L138 M143 C144 L149 A152	L57-L141 HydrophobicContact CD1-CD2 4.47Å; F73-L141 HydrophobicContact CD1-CD1 3.82Å; F73-L141 HydrophobicContact CE1-CD1 4.03Å; L77-L141 HydrophobicContact CD1-CD1 4.47Å; T137-L141 HydrophobicContact CG2-CD1 4.24Å; T137-L141 HydrophobicContact CG2-CG 4.45Å; T137-L141 VanDerWaalsContact O-CG 3.29Å; T137-L141 WeakPolarHBondContact O-CG 3.35Å; T137-L141 PolarHBondContact O-N 3.47Å; L138-L141 PolarHBondContact O-N 3.45Å; L141-M143 PolarHBondContact O-N 2.93Å; L141-C144 WeakPolarHBondContact O-CB 3.48Å; L141-C144 PolarHBondContact O-N 3.38Å; L141-C144 VanDerWaalsContact O-N 3.11Å; L141-L149 HydrophobicContact CB-CD2 3.99Å; L141-L149 HydrophobicContact CD2-CD2 3.75Å; L141-L149 HydrophobicContact CG-CD2 4.45Å; L141-L149 WeakPolarHBondContact O-CD2 3.49Å; L141-A152 HydrophobicContact CD2-CB 3.84Å
142	Q	83.6	Confident	80.7	Confident	121 Å²	121	32.9 Å²	32.9	57%	0.565	17%	0.172	S	C	*	.	H	α-helix	trans	-64	-25.1	173.9	-70.5	178.8	2.4	0	0	113.6	L138 L139 L140	L138-Q142 WeakPolarHBondContact O-CG 3.4Å; L138-Q142 PolarHBondContact O-N 2.94Å; L139-Q142 PolarHBondContact O-N 3.33Å; L140-Q142 VanDerWaalsContact C-N 3.26Å; L140-Q142 PolarHBondContact O-N 2.76Å
143	M	80	Confident	80.5	Confident	39 Å²	39	33.1 Å²	33.1	19%	0.192	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.8	176.6	-61.5	-175.1	-72	0	0	112.9	T41 K42 F45 L140 L141	T41-M143 HydrophobicContact CG2-CE 4.03Å; K42-M143 HydrophobicContact CB-SD 3.79Å; K42-M143 HydrophobicContact CG-SD 3.9Å; F45-M143 HydrophobicContact CD1-CB 4.11Å; F45-M143 HydrophobicContact CE1-CB 4.27Å; L140-M143 HydrophobicContact CB-CE 4.48Å; L140-M143 HydrophobicContact CD1-CE 3.87Å; L140-M143 PolarHBondContact O-N 3.28Å; L141-M143 PolarHBondContact O-N 2.93Å
144	C	82.8	Confident	79.9	Confident	13 Å²	13	34.5 Å²	34.5	9%	0.088	18%	0.183	C	C	.	.			trans	-83	139.7	-174.7	-70.8	0	0	0	0	112.3	L140 L141 L148 L149	L140-C144 PolarHBondContact O-N 3.37Å; L140-C144 PolarHBondContact O-SG 3.32Å; L141-C144 WeakPolarHBondContact O-CB 3.48Å; L141-C144 PolarHBondContact O-N 3.38Å; L141-C144 VanDerWaalsContact O-N 3.11Å; C144-L148 HydrophobicContact CB-CB 3.85Å; C144-L149 HydrophobicContact CB-CD2 3.86Å; C144-L149 HydrophobicContact CB-CG 3.82Å
145	N	78.5	Confident	79.6	Confident	52 Å²	52	33.7 Å²	33.7	28%	0.278	18%	0.176	S	C	.	.			trans	-69.2	164.4	168.7	71.7	27.5	0	0	0	111	K147 L148 L149	N145-K147 PolarHBondContact O-N 3.49Å; N145-K147 VanDerWaalsContact O-N 3.09Å; N145-K147 WeakPolarHBondContact OD1-CB 3.33Å; N145-K147 PolarHBondContact OD1-N 2.97Å; N145-K147 VanDerWaalsContact OD1-N 3.09Å; N145-L148 PolarHBondContact O-N 3.04Å; N145-L148 VanDerWaalsContact O-N 3.11Å; N145-L148 WeakPolarHBondContact OD1-CB 3.29Å; N145-L148 WeakPolarHBondContact OD1-CG 3.19Å; N145-L148 PolarHBondContact OD1-N 3.15Å; N145-L149 PolarHBondContact O-N 3.03Å
146	P	73.4	Confident	79.4	Confident	61 Å²	61	31.5 Å²	31.5	40%	0.396	16%	0.164	S	C	.	.	H	α-helix	trans	-55.3	-29.8	179.7	-29.7	36.8	0	0	0	114.8	F85 L150	F85-P146 HydrophobicContact CD1-CB 4.47Å; F85-P146 HydrophobicContact CE1-CB 3.83Å; P146-L150 PolarHBondContact O-N 3.38Å
147	K	72	Confident	78.8	Confident	104 Å²	104	37.8 Å²	37.8	45%	0.452	19%	0.188	S	C	.	.	H	α-helix	trans	-73.2	-40.5	179	-59	-178.2	-178.4	174.7	0	111.8	I92 N145 L150 T151	I92-K147 HydrophobicContact CD1-CB 4.45Å; I92-K147 HydrophobicContact CD1-CG 4.03Å; I92-K147 HydrophobicContact CG1-CD 4.36Å; I92-K147 HydrophobicContact CG1-CG 4.31Å; N145-K147 PolarHBondContact O-N 3.49Å; N145-K147 VanDerWaalsContact O-N 3.09Å; N145-K147 WeakPolarHBondContact OD1-CB 3.33Å; N145-K147 PolarHBondContact OD1-N 2.97Å; N145-K147 VanDerWaalsContact OD1-N 3.09Å; K147-L150 PolarHBondContact O-N 3.44Å; K147-T151 PolarHBondContact O-N 2.78Å; K147-T151 PolarHBondContact O-OG1 2.96Å
148	L	76.1	Confident	78.2	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.052	21%	0.205	C	C	.	.	H	α-helix	trans	-70	-39.9	176.4	-73	173.6	0	0	0	111.4	F45 Q53 R54 L57 C144 N145 L150 T151 A152	F45-L148 HydrophobicContact CZ-CD1 4.38Å; Q53-L148 HydrophobicContact CB-CD1 4.07Å; Q53-L148 HydrophobicContact CB-CD2 4.47Å; R54-L148 HydrophobicContact CB-CD2 3.96Å; L57-L148 HydrophobicContact CD2-CB 3.97Å; L57-L148 HydrophobicContact CD2-CD2 4.22Å; L57-L148 WeakPolarHBondContact CD2-O 3.23Å; C144-L148 HydrophobicContact CB-CB 3.85Å; N145-L148 PolarHBondContact O-N 3.04Å; N145-L148 VanDerWaalsContact O-N 3.11Å; N145-L148 WeakPolarHBondContact OD1-CB 3.29Å; N145-L148 WeakPolarHBondContact OD1-CG 3.19Å; N145-L148 PolarHBondContact OD1-N 3.15Å; L148-L150 VanDerWaalsContact C-N 3.33Å; L148-L150 PolarHBondContact O-N 3.2Å; L148-T151 WeakPolarHBondContact O-CB 3Å; L148-T151 PolarHBondContact O-N 3.4Å; L148-T151 VanDerWaalsContact O-N 3.15Å; L148-A152 PolarHBondContact O-N 3.33Å
149	L	80.9	Confident	77.6	Confident	34 Å²	34	39.4 Å²	39.4	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-41.5	173.4	-73.8	175.4	0	0	0	112.3	L77 L141 C144 N145 A152 A153	L77-L149 HydrophobicContact CD2-CD2 4.29Å; L141-L149 HydrophobicContact CB-CD2 3.99Å; L141-L149 HydrophobicContact CD2-CD2 3.75Å; L141-L149 HydrophobicContact CG-CD2 4.45Å; L141-L149 WeakPolarHBondContact O-CD2 3.49Å; C144-L149 HydrophobicContact CB-CD2 3.86Å; C144-L149 HydrophobicContact CB-CG 3.82Å; N145-L149 PolarHBondContact O-N 3.03Å; L149-A152 PolarHBondContact O-N 3.36Å; L149-A153 PolarHBondContact O-N 3.41Å
150	L	73.4	Confident	77.2	Confident	17 Å²	17	38 Å²	38	9%	0.089	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-40.1	174.3	-177.7	67.3	0	0	0	111.9	R89 I92 P146 K147 L148 A153 N154	R89-L150 HydrophobicContact CG-CD2 3.76Å; I92-L150 HydrophobicContact CD1-CD2 4.3Å; P146-L150 PolarHBondContact O-N 3.38Å; K147-L150 PolarHBondContact O-N 3.44Å; L148-L150 VanDerWaalsContact C-N 3.33Å; L148-L150 PolarHBondContact O-N 3.2Å; L150-A153 PolarHBondContact O-N 3.22Å; L150-N154 PolarHBondContact O-N 3.19Å; L150-N154 VanDerWaalsContact O-N 3.09Å
151	T	72.3	Confident	76.5	Confident	23 Å²	23	41.6 Å²	41.6	14%	0.141	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-43.8	176.2	-55.4	0	0	0	0	110.7	R54 K147 L148 A153 N154 V155	R54-T151 HydrophobicContact CG-CG2 4.16Å; K147-T151 PolarHBondContact O-N 2.78Å; K147-T151 PolarHBondContact O-OG1 2.96Å; L148-T151 WeakPolarHBondContact O-CB 3Å; L148-T151 PolarHBondContact O-N 3.4Å; L148-T151 VanDerWaalsContact O-N 3.15Å; T151-A153 PolarHBondContact O-N 2.82Å; T151-N154 PolarHBondContact O-N 3.46Å; T151-V155 HydrophobicContact CG2-CG2 4.34Å; T151-V155 VanDerWaalsContact O-CG2 3.25Å; T151-V155 WeakPolarHBondContact O-CG2 3.32Å; T151-V155 PolarHBondContact O-N 3.4Å
152	A	79.3	Confident	75.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.8	-45.7	174.7	0	0	0	0	0	112.1	L57 L61 L77 L141 L148 L149 N154 V155 I156	L57-A152 HydrophobicContact CD2-CB 4.14Å; L61-A152 HydrophobicContact CD1-CB 3.66Å; L77-A152 HydrophobicContact CD1-CB 4.24Å; L141-A152 HydrophobicContact CD2-CB 3.84Å; L148-A152 PolarHBondContact O-N 3.33Å; L149-A152 PolarHBondContact O-N 3.36Å; A152-N154 VanDerWaalsContact C-N 3.33Å; A152-N154 PolarHBondContact O-N 2.96Å; A152-V155 PolarHBondContact O-N 3.47Å; A152-I156 WeakPolarHBondContact O-CB 3.42Å; A152-I156 WeakPolarHBondContact O-CD1 3.34Å; A152-I156 VanDerWaalsContact O-CG1 3.32Å; A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 2.8Å
153	A	77.8	Confident	75	Confident	9 Å²	9	44.9 Å²	44.9	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-41.3	178.8	0	0	0	0	0	112.5	L77 L149 L150 T151 R157	L77-A153 HydrophobicContact CB-CB 4Å; L77-A153 HydrophobicContact CD1-CB 4.19Å; L149-A153 PolarHBondContact O-N 3.41Å; L150-A153 PolarHBondContact O-N 3.22Å; T151-A153 PolarHBondContact O-N 2.82Å; A153-R157 WeakPolarHBondContact O-CB 3.31Å; A153-R157 PolarHBondContact O-N 2.96Å
154	N	71.4	Confident	74.5	Confident	53 Å²	53	47.7 Å²	47.7	28%	0.283	23%	0.23	S	C	.	.	H	α-helix	trans	-67.2	-46.1	176.7	-71	-19	0	0	0	111.6	L150 T151 A152 R157 V158	L150-N154 PolarHBondContact O-N 3.19Å; L150-N154 VanDerWaalsContact O-N 3.09Å; T151-N154 PolarHBondContact O-N 3.46Å; A152-N154 VanDerWaalsContact C-N 3.33Å; A152-N154 PolarHBondContact O-N 2.96Å; N154-R157 PolarHBondContact O-N 3.37Å; N154-V158 WeakPolarHBondContact O-CG2 3.42Å; N154-V158 PolarHBondContact O-N 3.05Å
155	V	74.3	Confident	73.5	Confident	2 Å²	2	51.8 Å²	51.8	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-64.2	-44.6	-178.8	171.2	0	0	0	0	111.1	V58 L61 T151 A152 R157 V158 L159 L267	V58-V155 HydrophobicContact CG1-CG1 4.41Å; V58-V155 HydrophobicContact CG2-CG2 4.12Å; L61-V155 HydrophobicContact CB-CG1 4.23Å; L61-V155 HydrophobicContact CD1-CB 4.34Å; L61-V155 HydrophobicContact CD1-CG1 4.24Å; T151-V155 HydrophobicContact CG2-CG2 4.34Å; T151-V155 VanDerWaalsContact O-CG2 3.25Å; T151-V155 WeakPolarHBondContact O-CG2 3.32Å; T151-V155 PolarHBondContact O-N 3.4Å; A152-V155 PolarHBondContact O-N 3.47Å; V155-R157 VanDerWaalsContact C-N 3.29Å; V155-R157 PolarHBondContact O-N 2.78Å; V155-V158 PolarHBondContact O-N 3.43Å; V155-L159 HydrophobicContact CG1-CD1 3.8Å; V155-L159 HydrophobicContact CG1-CG 4.24Å; V155-L159 WeakPolarHBondContact O-CB 3.33Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.38Å; V155-L159 PolarHBondContact O-N 3.32Å; V155-L267 HydrophobicContact CG2-CB 4.44Å
156	I	78.9	Confident	72.5	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-42	175.7	-72.1	159.9	0	0	0	110.8	L61 L70 F73 Q74 L77 A152 V158 L159 F160	L61-I156 HydrophobicContact CD1-CD1 4.43Å; L61-I156 HydrophobicContact CD1-CG1 4.26Å; L61-I156 HydrophobicContact CD2-CD1 3.8Å; L61-I156 HydrophobicContact CD2-CG1 3.89Å; L70-I156 HydrophobicContact CD2-CG2 4.34Å; L70-I156 WeakPolarHBondContact O-CG2 3.34Å; F73-I156 HydrophobicContact CB-CD1 3.76Å; Q74-I156 HydrophobicContact CB-CG2 4.13Å; L77-I156 HydrophobicContact CD1-CD1 3.59Å; A152-I156 WeakPolarHBondContact O-CB 3.42Å; A152-I156 WeakPolarHBondContact O-CD1 3.34Å; A152-I156 VanDerWaalsContact O-CG1 3.32Å; A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 2.8Å; I156-V158 PolarHBondContact O-N 3.09Å; I156-L159 PolarHBondContact O-N 3.35Å; I156-F160 WeakPolarHBondContact O-CB 3.43Å; I156-F160 PolarHBondContact O-N 3Å
157	R	74.2	Confident	71.7	Confident	134 Å²	134	56.3 Å²	56.3	51%	0.506	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-42.1	177.5	-175.1	-179.8	177.5	175.4	0.5	112.3	A153 N154 V155 L161	A153-R157 WeakPolarHBondContact O-CB 3.31Å; A153-R157 PolarHBondContact O-N 2.96Å; N154-R157 PolarHBondContact O-N 3.37Å; V155-R157 VanDerWaalsContact C-N 3.29Å; V155-R157 PolarHBondContact O-N 2.78Å; R157-L161 HydrophobicContact CG-CD1 4.27Å; R157-L161 WeakPolarHBondContact O-CG 3.23Å; R157-L161 PolarHBondContact O-N 2.89Å
158	V	73.3	Confident	70.6	Confident	58 Å²	58	54.6 Å²	54.6	35%	0.352	27%	0.272	S	S	.	.	H	α-helix	trans	-67.1	-43.1	177.6	175	0	0	0	0	110.8	N154 V155 I156 L161 R162 L267	N154-V158 WeakPolarHBondContact O-CG2 3.42Å; N154-V158 PolarHBondContact O-N 3.05Å; V155-V158 PolarHBondContact O-N 3.43Å; I156-V158 PolarHBondContact O-N 3.09Å; V158-L161 PolarHBondContact O-N 3.06Å; V158-R162 WeakPolarHBondContact O-CB 3.4Å; V158-R162 PolarHBondContact O-N 3.15Å; V158-L267 HydrophobicContact CB-CD2 4.36Å; V158-L267 HydrophobicContact CG1-CD2 3.58Å
159	L	72.7	Confident	68.9	Low	23 Å²	23	56.3 Å²	56.3	12%	0.12	29%	0.292	C	S	.	.	H	α-helix	trans	-64.5	-42.6	176.6	-69.2	174.6	0	0	0	111.7	L61 L70 V155 I156 R162 E163	L61-L159 HydrophobicContact CB-CD1 4.45Å; L61-L159 WeakPolarHBondContact O-CD1 3.44Å; L70-L159 HydrophobicContact CD1-CB 4.06Å; L70-L159 HydrophobicContact CD2-CB 4.4Å; V155-L159 HydrophobicContact CG1-CD1 3.8Å; V155-L159 HydrophobicContact CG1-CG 4.24Å; V155-L159 WeakPolarHBondContact O-CB 3.33Å; V155-L159 VanDerWaalsContact O-CG 3.31Å; V155-L159 WeakPolarHBondContact O-CG 3.38Å; V155-L159 PolarHBondContact O-N 3.32Å; I156-L159 PolarHBondContact O-N 3.35Å; L159-R162 PolarHBondContact O-N 3.24Å; L159-E163 WeakPolarHBondContact O-CB 3.39Å; L159-E163 PolarHBondContact O-N 3.43Å
160	F	75.5	Confident	66.7	Low	30 Å²	30	62.2 Å²	62.2	13%	0.132	32%	0.323	C	S	.	.	H	α-helix	trans	-59.1	-49.6	176.3	-177.6	-92.6	0	0	0	111.4	L67 L70 H71 I156 R162 E163 E164	L67-F160 HydrophobicContact CD2-CE2 4.3Å; L67-F160 HydrophobicContact CG-CE2 4.09Å; L70-F160 HydrophobicContact CB-CB 4.49Å; L70-F160 HydrophobicContact CB-CD2 4.11Å; H71-F160 HydrophobicContact CB-CE2 3.98Å; I156-F160 WeakPolarHBondContact O-CB 3.43Å; I156-F160 PolarHBondContact O-N 3Å; F160-R162 VanDerWaalsContact C-N 3.29Å; F160-R162 PolarHBondContact O-N 3.47Å; F160-E163 PolarHBondContact O-N 3.37Å; F160-E164 VanDerWaalsContact O-CB 3.31Å; F160-E164 WeakPolarHBondContact O-CB 3.41Å; F160-E164 PolarHBondContact O-N 3.47Å
161	L	70.4	Confident	64.8	Low	78 Å²	78	68.2 Å²	68.2	41%	0.408	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-36.2	176.1	-74.2	167.5	0	0	0	112.4	R157 V158 N165	R157-L161 HydrophobicContact CG-CD1 4.27Å; R157-L161 WeakPolarHBondContact O-CG 3.23Å; R157-L161 PolarHBondContact O-N 2.89Å; V158-L161 PolarHBondContact O-N 3.06Å; L161-N165 WeakPolarHBondContact O-CB 3.43Å; L161-N165 PolarHBondContact O-N 2.63Å; L161-N165 PolarHBondContact O-ND2 3.01Å
162	R	68.9	Low	62.8	Low	152 Å²	152	74.8 Å²	74.8	57%	0.574	38%	0.384	S	S	*	.	H	α-helix	trans	-68.9	-40.7	178	-164.2	-179.6	-153.2	167.9	7.4	111.8	V158 L159 F160 N166	V158-R162 WeakPolarHBondContact O-CB 3.4Å; V158-R162 PolarHBondContact O-N 3.15Å; L159-R162 PolarHBondContact O-N 3.24Å; F160-R162 VanDerWaalsContact C-N 3.29Å; F160-R162 PolarHBondContact O-N 3.47Å; R162-N166 VanDerWaalsContact O-CG 3.3Å; R162-N166 PolarHBondContact O-N 3.19Å
163	E	69.1	Low	60.2	Low	50 Å²	50	82.5 Å²	82.5	23%	0.234	43%	0.425	C	S	.	.	H	α-helix	trans	-73.7	-37	179.7	-147.2	170.6	-147.5	0	0	111.3	L67 L70 L159 F160 N166 I167	L67-E163 HydrophobicContact CD1-CB 4.47Å; L67-E163 PolarHBondContact N-OE2 3.27Å; L70-E163 WeakPolarHBondContact CD1-OE2 3.32Å; L159-E163 WeakPolarHBondContact O-CB 3.39Å; L159-E163 PolarHBondContact O-N 3.43Å; F160-E163 PolarHBondContact O-N 3.37Å; E163-N166 PolarHBondContact O-N 3.19Å; E163-I167 WeakPolarHBondContact O-CG1 3.48Å; E163-I167 PolarHBondContact O-N 3.49Å; E163-I167 VanDerWaalsContact O-N 3.12Å
164	E	68.9	Low	57.8	Low	97 Å²	97	89.1 Å²	89.1	45%	0.453	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-44.3	170.6	-169.4	174.4	-159.4	0	0	111.4	F160 I167 S168	F160-E164 VanDerWaalsContact O-CB 3.31Å; F160-E164 WeakPolarHBondContact O-CB 3.41Å; F160-E164 PolarHBondContact O-N 3.47Å; E164-I167 PolarHBondContact O-N 3.44Å; E164-S168 PolarHBondContact O-N 2.85Å; E164-S168 VanDerWaalsContact O-N 3.11Å
165	N	61.9	Low	55.6	Low	100 Å²	100	92.8 Å²	92.8	54%	0.535	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-37.6	175.9	-72.3	-15.7	0	0	0	112.7	L161 I167 S168 G169	L161-N165 WeakPolarHBondContact O-CB 3.43Å; L161-N165 PolarHBondContact O-N 2.63Å; L161-N165 PolarHBondContact O-ND2 3.01Å; N165-I167 VanDerWaalsContact C-N 3.31Å; N165-I167 PolarHBondContact O-N 3.38Å; N165-S168 WeakPolarHBondContact CA-OG 3.44Å; N165-S168 PolarHBondContact O-N 3Å; N165-S168 PolarHBondContact O-OG 2.8Å; N165-G169 PolarHBondContact O-N 3.11Å
166	N	58.5	Low	53.3	Low	107 Å²	107	100.2 Å²	100.2	57%	0.572	52%	0.522	S	S	*	.	H	α-helix	trans	-65.8	-32.1	176.4	-76.8	-10.1	0	0	0	112.7	R162 E163 G169 L170	R162-N166 VanDerWaalsContact O-CG 3.3Å; R162-N166 PolarHBondContact O-N 3.19Å; E163-N166 PolarHBondContact O-N 3.19Å; N166-G169 PolarHBondContact O-N 3.33Å; N166-L170 PolarHBondContact O-N 3.13Å
167	I	55.7	Low	50.7	Low	100 Å²	100	106.4 Å²	106.4	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-71.2	-37.3	173.2	-66.4	165.5	0	0	0	110.6	L67 E163 E164 N165 G169	L67-I167 HydrophobicContact CD1-CD1 3.65Å; E163-I167 WeakPolarHBondContact O-CG1 3.48Å; E163-I167 PolarHBondContact O-N 3.49Å; E163-I167 VanDerWaalsContact O-N 3.12Å; E164-I167 PolarHBondContact O-N 3.44Å; N165-I167 VanDerWaalsContact C-N 3.31Å; N165-I167 PolarHBondContact O-N 3.38Å; I167-G169 VanDerWaalsContact C-N 3.28Å; I167-G169 PolarHBondContact O-N 3.17Å
168	S	49.3	Very low	48.3	Very low	69 Å²	69	105 Å²	105	48%	0.483	57%	0.57	S	S	.	*	H	α-helix	trans	-68.8	-25.4	173.7	71.7	0	0	0	0	113.6	E164 N165	E164-S168 PolarHBondContact O-N 2.85Å; E164-S168 VanDerWaalsContact O-N 3.11Å; N165-S168 WeakPolarHBondContact CA-OG 3.44Å; N165-S168 PolarHBondContact O-N 3Å; N165-S168 PolarHBondContact O-OG 2.8Å
169	G	39.4	Very low	45.7	Very low	46 Å²	46	112 Å²	112	47%	0.474	60%	0.596	S	S	.	*	H	α-helix	trans	-80.7	-13.4	178.6	0	0	0	0	0	115.5	N165 N166 I167 N171	N165-G169 PolarHBondContact O-N 3.11Å; N166-G169 PolarHBondContact O-N 3.33Å; I167-G169 VanDerWaalsContact C-N 3.28Å; I167-G169 PolarHBondContact O-N 3.17Å; G169-N171 VanDerWaalsContact C-N 3.26Å
170	L	35.7	Very low	43.3	Very low	157 Å²	157	115.8 Å²	115.8	82%	0.822	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-3.3	172.8	-126.5	91.8	0	0	0	113.3	N166	N166-L170 PolarHBondContact O-N 3.13Å
171	N	32.7	Very low	41.2	Very low	143 Å²	143	119.8 Å²	119.8	77%	0.765	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	31.8	-178.5	-83.7	-19.2	0	0	0	112.9	G169	G169-N171 VanDerWaalsContact C-N 3.26Å
172	Q	30.3	Very low	38.9	Very low	162 Å²	162	123.5 Å²	123.5	76%	0.757	67%	0.668	S	S	*	*			trans	-129.8	67.3	177.5	-80.1	178.5	-31.5	0	0	112.2
173	D	25.6	Very low	36.7	Very low	161 Å²	161	123.7 Å²	123.7	86%	0.861	67%	0.673	S	S	*	*			trans	-90.4	95.2	142.6	-91.5	-26.3	0	0	0	107.1
174	I	26.8	Very low	34.5	Very low	149 Å²	149	127.2 Å²	127.2	76%	0.764	69%	0.694	S	S	*	*	S	Bend	trans	171.9	107.2	136.3	-82.9	156.5	0	0	0	107.1
175	T	26.3	Very low	32.4	Very low	130 Å²	130	130.5 Å²	130.5	80%	0.798	71%	0.709	S	S	*	*			trans	67.6	90.5	160.8	55.6	0	0	0	0	118.8
176	D	24.3	Very low	30.5	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	72%	0.717	S	S	*	*			trans	-43.7	135.1	138.3	-82.6	-42.6	0	0	0	111.4
177	V	26.1	Very low	28.8	Very low	132 Å²	132	130.3 Å²	130.3	80%	0.8	72%	0.724	S	S	*	*				-153.3	119.3	108.8	173.1	0	0	0	0	108.3	F179	V177-F179 HydrophobicContact CG1-CD2 4.46Å; V177-F179 HydrophobicContact CG1-CE2 4.42Å
178	C	22.2	Very low	27.2	Very low	105 Å²	105	135.2 Å²	135.2	71%	0.709	74%	0.741	S	S	*	*			trans	-57.3	144.6	171.2	-145.3	0	0	0	0	112.1
179	F	20.5	Very low	25.9	Very low	204 Å²	204	137.8 Å²	137.8	90%	0.895	76%	0.759	S	S	*	*			trans	-158.7	129.9	133.8	-91.9	-66.3	0	0	0	111.9	V177	V177-F179 HydrophobicContact CG1-CD2 4.46Å; V177-F179 HydrophobicContact CG1-CE2 4.42Å
180	S	20.6	Very low	25.1	Very low	102 Å²	102	139.8 Å²	139.8	71%	0.713	77%	0.771	S	S	*	*			trans	-81.5	179.1	163.9	70	0	0	0	0	109.3
181	P	33.1	Very low	24.5	Very low	114 Å²	114	138.3 Å²	138.3	74%	0.74	77%	0.769	S	S	*	*			trans	-96.2	149.8	-134.7	38.9	-34.3	0	0	0	114.3
182	E	21.3	Very low	24.1	Very low	157 Å²	157	136.1 Å²	136.1	73%	0.734	77%	0.765	S	S	*	*				-174.1	140.2	129.7	-107.3	-173.9	-151.6	0	0	113.2
183	K	23.4	Very low	23.7	Very low	155 Å²	155	136.1 Å²	136.1	67%	0.674	77%	0.765	S	S	*	*			trans	67.5	121.9	148.6	-74.7	175.3	-174.1	142.3	0	122.2
184	D	21.7	Very low	23.5	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	76%	0.764	S	S	*	*			trans	87.2	121.6	132.3	-65.1	-22.1	0	0	0	121.1
185	H	24.4	Very low	23.3	Very low	165 Å²	165	136.3 Å²	136.3	76%	0.764	76%	0.761	S	S	*	*			trans	70.6	103.7	150.4	-64.7	-53.9	0	0	0	120.6
186	S	22	Very low	23.1	Very low	103 Å²	103	141.9 Å²	141.9	72%	0.72	77%	0.767	S	S	*	*				33.7	126	128.2	65.2	0	0	0	0	117.5
187	S	23.1	Very low	23.1	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	76%	0.758	S	S	*	*				176.5	152.7	60.1	51.9	0	0	0	0	111.1
188	K	22.7	Very low	23	Very low	202 Å²	202	138 Å²	138	88%	0.878	76%	0.76	S	S	*	*			trans	62.6	108.4	153.1	-69.1	174.8	-179.3	179.5	0	118.9
189	S	22.2	Very low	23.1	Very low	123 Å²	123	142.7 Å²	142.7	86%	0.86	77%	0.769	S	S	*	*				-150	109.1	127.8	56.2	0	0	0	0	111.2
190	A	23	Very low	23.2	Very low	88 Å²	88	139.4 Å²	139.4	73%	0.727	77%	0.765	S	S	*	*			trans	-79.8	148.9	139.9	0	0	0	0	0	104.9
191	T	23.3	Very low	23.4	Very low	127 Å²	127	143.8 Å²	143.8	78%	0.779	77%	0.774	S	S	*	*			cis	-170.2	147.2	23.6	-10.3	0	0	0	0	102.3
192	S	22.8	Very low	22.9	Very low	97 Å²	97	146.9 Å²	146.9	68%	0.678	78%	0.779	S	S	*	*				-174.6	121.8	64.3	45.8	0	0	0	0	107.8
193	Q	22.3	Very low	22.9	Very low	161 Å²	161	146 Å²	146	75%	0.752	78%	0.784	S	S	*	*				61.7	107.6	109.2	-69.4	-179.4	-18.1	0	0	116.6
194	V	22.2	Very low	22.9	Very low	140 Å²	140	144.1 Å²	144.1	85%	0.848	79%	0.79	S	S	*	*				-140.9	127.9	128.6	179.9	0	0	0	0	108.5
195	Y	21.3	Very low	22.9	Very low	175 Å²	175	145.1 Å²	145.1	69%	0.686	80%	0.795	S	S	*	*			trans	-90.2	147.4	-176	-112.2	-97.7	0	0	0	111.2	T197	Y195-T197 HydrophobicContact CD1-CG2 3.65Å; Y195-T197 HydrophobicContact CE1-CG2 3.94Å
196	W	23.8	Very low	22.9	Very low	247 Å²	247	143 Å²	143	94%	0.936	80%	0.796	S	S	*	*			trans	-129	106.6	148.5	-76.8	111.4	0	0	0	109.7
197	T	23.2	Very low	22.8	Very low	105 Å²	105	145.1 Å²	145.1	64%	0.644	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-81.5	129.8	171	44.7	0	0	0	0	111	Y195	Y195-T197 HydrophobicContact CD1-CG2 3.65Å; Y195-T197 HydrophobicContact CE1-CG2 3.94Å
198	A	23.8	Very low	22.8	Very low	103 Å²	103	145.4 Å²	145.4	85%	0.851	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-96.2	120.8	160.8	0	0	0	0	0	109.4
199	K	23.9	Very low	22.8	Very low	203 Å²	203	145.4 Å²	145.4	88%	0.883	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-76	132.4	176.5	-86.9	175.1	172	174.1	0	111
200	T	23.8	Very low	22.8	Very low	134 Å²	134	144.3 Å²	144.3	82%	0.822	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-99.2	129.3	153.7	41	0	0	0	0	108.5
201	Q	24	Very low	22.9	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82	125.8	174.7	-78.2	178.7	-21.3	0	0	110
202	H	22.7	Very low	22.7	Very low	180 Å²	180	148.3 Å²	148.3	83%	0.833	80%	0.804	S	S	*	*			trans	-114.7	127.6	154.1	-96.5	-76.5	0	0	0	108.3
203	T	22.3	Very low	22.7	Very low	138 Å²	138	150 Å²	150	85%	0.847	81%	0.805	S	S	*	*			trans	-59.8	128.4	171.4	-10.7	0	0	0	0	110.7
204	S	21.6	Very low	22.7	Very low	115 Å²	115	150.1 Å²	150.1	80%	0.804	81%	0.806	S	S	*	*			trans	-160	119.8	141.6	47.1	0	0	0	0	109.2
205	L	22.5	Very low	22.7	Very low	146 Å²	146	150.5 Å²	150.5	76%	0.764	80%	0.798	S	S	*	*			trans	-71.2	149.6	163.9	-93.3	131.9	0	0	0	108.8	L207	L205-L207 HydrophobicContact CD2-CD1 4.35Å
206	P	23.5	Very low	22.8	Very low	122 Å²	122	151.5 Å²	151.5	79%	0.792	81%	0.807	S	S	*	*				-142.5	154.2	97.9	32.1	-14.6	0	0	0	116.4
207	L	20.6	Very low	22.7	Very low	147 Å²	147	147.2 Å²	147.2	77%	0.77	80%	0.801	S	S	*	*			trans	-40.8	137.1	159.3	-92.4	65.9	0	0	0	114.8	L205	L205-L207 HydrophobicContact CD2-CD1 4.35Å
208	S	22.6	Very low	22.6	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	81%	0.807	S	S	*	*				146.7	110.2	105.9	60.3	0	0	0	0	113.2
209	K	23.2	Very low	22.6	Very low	201 Å²	201	145.8 Å²	145.8	87%	0.874	81%	0.807	S	S	*	*				167.9	107	120.7	-93.6	-178	177.9	-178.9	0	110.6
210	A	22.3	Very low	22.4	Very low	101 Å²	101	141.3 Å²	141.3	84%	0.835	81%	0.808	S	S	*	*			trans	44.5	149.9	139.9	0	0	0	0	0	123.1
211	P	24.8	Very low	22.5	Very low	118 Å²	118	140.5 Å²	140.5	77%	0.766	81%	0.808	S	S	*	*			trans	-114.8	165.8	-153	39.9	-26	0	0	0	113.5
212	E	20.4	Very low	22.6	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	80%	0.804	S	S	*	*			trans	-141	122	140.7	-75.5	-166.9	159.1	0	0	109.1
213	N	22	Very low	22.8	Very low	133 Å²	133	136.1 Å²	136.1	71%	0.711	80%	0.804	S	S	*	*			trans	50.4	136.2	140.5	-60.6	-6.7	0	0	0	119.4
214	E	22.9	Very low	22.8	Very low	164 Å²	164	138.2 Å²	138.2	77%	0.766	80%	0.804	S	S	*	*			cis	-167.5	147.5	12.7	-118.6	168.5	-170	0	0	108.4
215	H	21.3	Very low	23.2	Very low	148 Å²	148	140.6 Å²	140.6	69%	0.685	80%	0.802	S	S	*	*			trans	2.5	133.5	158.6	-70.2	-87.7	0	0	0	120.9
216	F	23	Very low	23.5	Very low	196 Å²	196	138.3 Å²	138.3	86%	0.86	80%	0.796	S	S	*	*				-168.3	141.5	91.4	-101.1	-77.8	0	0	0	113.1
217	L	22.6	Very low	23.7	Very low	156 Å²	156	142 Å²	142	82%	0.817	79%	0.794	S	S	*	*			trans	-63.5	158.7	177.9	-64	123.5	0	0	0	112.1
218	G	21.2	Very low	24	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	79%	0.794	S	S	*	*			cis	166	153.6	5.5	0	0	0	0	0	108.7
219	A	22.7	Very low	24.4	Very low	105 Å²	105	145.1 Å²	145.1	87%	0.868	79%	0.788	S	S	*	*			trans	-177.4	120.3	152.1	0	0	0	0	0	109
220	A	21.5	Very low	24.7	Very low	108 Å²	108	139.1 Å²	139.1	89%	0.893	77%	0.772	S	S	*	*			trans	-80.1	138	174.9	0	0	0	0	0	111.1
221	S	24.8	Very low	25.2	Very low	118 Å²	118	139 Å²	139	83%	0.825	76%	0.757	S	S	*	*			trans	-155	129.5	153.5	63.6	0	0	0	0	111.5
222	N	25.8	Very low	25.5	Very low	155 Å²	155	142 Å²	142	83%	0.829	75%	0.753	S	S	*	*			trans	-54.9	159.7	-178	-70.9	-31.2	0	0	0	115.3
223	P	26.8	Very low	25.9	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	73%	0.733	S	S	*	*			trans	-85.9	115.1	178	33.1	-28.6	0	0	0	111.5
224	E	23.4	Very low	26.4	Very low	183 Å²	183	133.3 Å²	133.3	86%	0.855	72%	0.716	S	S	*	*			trans	-125.1	116.9	161	-80.7	-160.6	164.8	0	0	111.5
225	E	29.6	Very low	27.1	Very low	165 Å²	165	128.8 Å²	128.8	77%	0.771	70%	0.702	S	S	*	*			trans	-27.7	170.7	167.6	-91.4	-163.1	169.6	0	0	122.8	W227	E225-W227 PolarHBondContact O-N 3.05Å
226	P	28.5	Very low	27.6	Very low	97 Å²	97	127.4 Å²	127.4	63%	0.63	70%	0.696	S	S	*	*	S	Bend	trans	-82.6	14.7	-143	-5.5	24.3	0	0	0	117.7	R228	P226-R228 VanDerWaalsContact C-N 3.26Å; P226-R228 PolarHBondContact O-N 3.04Å
227	W	26.8	Very low	28	Very low	199 Å²	199	120 Å²	120	75%	0.754	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-4.1	-170.4	-65.9	97.7	0	0	0	114.9	E225	E225-W227 PolarHBondContact O-N 3.05Å
228	R	28.4	Very low	28.6	Very low	201 Å²	201	118.3 Å²	118.3	76%	0.758	66%	0.656	S	S	*	*	H	α-helix	trans	-74.9	-22.6	-179.9	-77.8	-176.1	-172.8	-101.2	-0.7	114.6	P226 R232	P226-R228 VanDerWaalsContact C-N 3.26Å; P226-R228 PolarHBondContact O-N 3.04Å; R228-R232 PolarHBondContact O-N 3.29Å
229	N	30.6	Very low	29.3	Very low	119 Å²	119	125.4 Å²	125.4	64%	0.636	66%	0.66	S	S	*	*	H	α-helix	trans	-72.2	-34.9	-177.4	-74.5	-11.2	0	0	0	112.8	L231 R232	N229-L231 PolarHBondContact O-N 3.11Å; N229-R232 PolarHBondContact O-N 3.22Å
230	S	29.8	Very low	29.9	Very low	75 Å²	75	127.4 Å²	127.4	52%	0.524	66%	0.655	S	S	.	*	H	α-helix	trans	-70.6	-30.2	178.4	-51.9	0	0	0	0	113.1	I234	S230-I234 WeakPolarHBondContact O-CG1 3.28Å
231	L	32.3	Very low	30.5	Very low	100 Å²	100	127.6 Å²	127.6	52%	0.524	64%	0.636	S	S	.	*	H	α-helix	trans	-78.2	-26	178.1	-74.2	164.2	0	0	0	112.6	N229 I234 S235	N229-L231 PolarHBondContact O-N 3.11Å; L231-I234 HydrophobicContact CD2-CD1 4.44Å; L231-I234 PolarHBondContact O-N 3.42Å; L231-S235 PolarHBondContact O-N 3.22Å
232	R	31.1	Very low	30.9	Very low	181 Å²	181	127.4 Å²	127.4	68%	0.683	64%	0.635	S	S	*	*	H	α-helix	trans	-67.2	-44.4	174.4	-128	179.4	-176.9	179.9	-0.6	111.6	R228 N229 I234 S235 E236	R228-R232 PolarHBondContact O-N 3.29Å; N229-R232 PolarHBondContact O-N 3.22Å; R232-I234 VanDerWaalsContact C-N 3.26Å; R232-I234 PolarHBondContact O-N 2.75Å; R232-S235 PolarHBondContact O-N 3.23Å; R232-S235 VanDerWaalsContact O-N 3.09Å; R232-S235 PolarHBondContact O-OG 3.11Å; R232-E236 PolarHBondContact O-N 3.17Å; R232-E236 VanDerWaalsContact O-N 3.14Å
233	C	29.7	Very low	30.9	Very low	63 Å²	63	123.2 Å²	123.2	43%	0.426	63%	0.628	S	S	.	*	H	α-helix	trans	-58.1	-34.5	172.9	-81.1	0	0	0	0	113.4	M237	C233-M237 PolarHBondContact O-N 2.85Å
234	I	32.3	Very low	30.9	Very low	67 Å²	67	127.6 Å²	127.6	34%	0.344	64%	0.635	S	S	.	*	H	α-helix	trans	-72.2	-32.8	178.3	-64.2	167.7	0	0	0	111.4	S230 L231 R232 M237	S230-I234 WeakPolarHBondContact O-CG1 3.28Å; L231-I234 HydrophobicContact CD2-CD1 4.44Å; L231-I234 PolarHBondContact O-N 3.42Å; R232-I234 VanDerWaalsContact C-N 3.26Å; R232-I234 PolarHBondContact O-N 2.75Å; I234-M237 HydrophobicContact CG1-CE 4.08Å
235	S	37	Very low	31.1	Very low	68 Å²	68	123.2 Å²	123.2	48%	0.476	63%	0.629	S	S	.	*	H	α-helix	trans	-74.2	-34	177.2	74	0	0	0	0	113.3	L231 R232 N238	L231-S235 PolarHBondContact O-N 3.22Å; R232-S235 PolarHBondContact O-N 3.23Å; R232-S235 VanDerWaalsContact O-N 3.09Å; R232-S235 PolarHBondContact O-OG 3.11Å; S235-N238 PolarHBondContact O-N 3.16Å
236	E	31.4	Very low	30.8	Very low	120 Å²	120	122.5 Å²	122.5	56%	0.561	63%	0.631	S	S	*	*	H	α-helix	trans	-71.4	-34.7	174.6	-77.5	175.8	160	0	0	112	R232 N238 R239	R232-E236 PolarHBondContact O-N 3.17Å; R232-E236 VanDerWaalsContact O-N 3.14Å; E236-N238 VanDerWaalsContact C-N 3.31Å; E236-N238 PolarHBondContact O-N 3.45Å; E236-R239 PolarHBondContact O-N 3.09Å
237	M	32	Very low	30.8	Very low	40 Å²	40	124.8 Å²	124.8	20%	0.197	64%	0.636	C	S	.	*	H	α-helix	trans	-56.6	-42.2	172.1	-86.4	-170.3	-85	0	0	112.4	Y68 Y72 C233 I234 R239 L240 F241	Y68-M237 HydrophobicContact CE1-CG 4.14Å; Y68-M237 HydrophobicContact CE1-SD 4.1Å; Y68-M237 WeakPolarHBondContact OH-CG 3.32Å; Y72-M237 HydrophobicContact CD2-CE 4.36Å; Y72-M237 HydrophobicContact CE2-CE 3.97Å; C233-M237 PolarHBondContact O-N 2.85Å; I234-M237 HydrophobicContact CG1-CE 4.08Å; M237-R239 VanDerWaalsContact C-N 3.3Å; M237-R239 PolarHBondContact O-N 3.15Å; M237-L240 PolarHBondContact O-N 3.21Å; M237-F241 HydrophobicContact CB-CE2 4.4Å; M237-F241 WeakPolarHBondContact O-CD2 3.47Å; M237-F241 VanDerWaalsContact O-CE2 3.23Å; M237-F241 WeakPolarHBondContact O-CE2 3.13Å
238	N	35.7	Very low	30.7	Very low	121 Å²	121	120.8 Å²	120.8	65%	0.647	63%	0.634	S	S	*	*	H	α-helix	trans	-72.5	-19.6	-178.3	-70.5	-27.8	0	0	0	114	S235 E236	S235-N238 PolarHBondContact O-N 3.16Å; E236-N238 VanDerWaalsContact C-N 3.31Å; E236-N238 PolarHBondContact O-N 3.45Å
239	R	35.6	Very low	30.6	Very low	222 Å²	222	120.6 Å²	120.6	84%	0.838	64%	0.639	S	S	*	*	H	α-helix	trans	-80.5	-24.3	179.3	-113.5	-174.7	178	-165.5	-0.6	113.4	E236 M237	E236-R239 PolarHBondContact O-N 3.09Å; M237-R239 VanDerWaalsContact C-N 3.3Å; M237-R239 PolarHBondContact O-N 3.15Å
240	L	34.1	Very low	30.7	Very low	147 Å²	147	121 Å²	121	77%	0.77	65%	0.648	S	S	*	*	H	α-helix	trans	-90.5	-10.6	-176	-71.3	166.3	0	0	0	113.9	M237 S242	M237-L240 PolarHBondContact O-N 3.21Å; L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.49Å
241	F	34.6	Very low	30.5	Very low	113 Å²	113	120.5 Å²	120.5	50%	0.496	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.1	15	178.4	-71	-64.8	0	0	0	115.2	W131 M237	W131-F241 HydrophobicContact CB-CD1 4.35Å; W131-F241 HydrophobicContact CB-CE1 3.74Å; W131-F241 HydrophobicContact CB-CZ 4.18Å; W131-F241 HydrophobicContact CG-CE1 4.43Å; M237-F241 HydrophobicContact CB-CE2 4.4Å; M237-F241 WeakPolarHBondContact O-CD2 3.47Å; M237-F241 VanDerWaalsContact O-CE2 3.23Å; M237-F241 WeakPolarHBondContact O-CE2 3.13Å
242	S	33.1	Very low	30.3	Very low	113 Å²	113	127 Å²	127	79%	0.79	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	4.2	-178.8	-173.5	0	0	0	0	115.1	L240	L240-S242 VanDerWaalsContact C-N 3.28Å; L240-S242 PolarHBondContact O-N 3.49Å
243	G	26.6	Very low	30.3	Very low	68 Å²	68	125.4 Å²	125.4	70%	0.701	68%	0.679	S	S	*	*	S	Bend	trans	-99	126.9	-179.6	0	0	0	0	0	112.6
244	K	26.5	Very low	30.4	Very low	218 Å²	218	126.6 Å²	126.6	95%	0.948	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-61.5	148.6	175.8	-80.7	176.8	174.1	177.1	0	112.4
245	A	27.4	Very low	30.6	Very low	90 Å²	90	128.2 Å²	128.2	74%	0.744	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-82.7	155.5	-177.6	0	0	0	0	0	114.1
246	D	23.8	Very low	30.9	Very low	151 Å²	151	132.6 Å²	132.6	81%	0.807	72%	0.72	S	S	*	*			trans	-145.9	111.9	150.9	-82.6	-39.7	0	0	0	106.8
247	I	27.9	Very low	31.7	Very low	144 Å²	144	128.8 Å²	128.8	74%	0.738	70%	0.703	S	S	*	*				59.4	130.2	89.1	-66.7	177.8	0	0	0	112
248	T	25.7	Very low	32.5	Very low	115 Å²	115	129 Å²	129	71%	0.706	71%	0.705	S	S	*	*			cis	-167.1	161	-5.1	31.6	0	0	0	0	105.5
249	K	26.4	Very low	33.3	Very low	198 Å²	198	124 Å²	124	86%	0.861	68%	0.678	S	S	*	*				170.7	168.9	98.7	-107.1	-166.4	-177.9	177.5	0	111.5
250	P	31.8	Very low	34.1	Very low	127 Å²	127	118.8 Å²	118.8	83%	0.825	67%	0.667	S	S	*	*				-125.3	177.7	-121.3	41.8	-26.2	0	0	0	115.3
251	G	25.3	Very low	34.8	Very low	65 Å²	65	115 Å²	115	67%	0.67	65%	0.648	S	S	*	*			trans	134.3	79.4	154.8	0	0	0	0	0	114.5
252	Y	28.9	Very low	35.3	Very low	237 Å²	237	115 Å²	115	93%	0.929	65%	0.653	S	S	*	*			trans	-142.7	120.6	159.7	-99	-80.5	0	0	0	110
253	D	30.6	Very low	36.1	Very low	147 Å²	147	113.5 Å²	113.5	79%	0.786	64%	0.636	S	S	*	*			trans	-59.3	141.6	-179.7	-89.7	-42.5	0	0	0	112.4	C255	D253-C255 VanDerWaalsContact C-N 3.28Å; D253-C255 PolarHBondContact O-N 3.22Å; D253-C255 VanDerWaalsContact O-N 3.1Å
254	P	32.5	Very low	37.2	Very low	87 Å²	87	110.6 Å²	110.6	57%	0.565	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	8.2	-163.4	-10.6	29.3	0	0	0	115.6
255	C	35.7	Very low	38.2	Very low	102 Å²	102	108.3 Å²	108.3	69%	0.689	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-9.1	-165.7	-73.2	0	0	0	0	116.7	D253	D253-C255 VanDerWaalsContact C-N 3.28Å; D253-C255 PolarHBondContact O-N 3.22Å; D253-C255 VanDerWaalsContact O-N 3.1Å
256	N	43.4	Very low	39.2	Very low	159 Å²	159	110 Å²	110	85%	0.85	59%	0.586	S	S	*	*			trans	-115.2	52.3	-179.7	-83.2	-8.8	0	0	0	113.5
257	L	48	Very low	40.2	Very low	41 Å²	41	103.7 Å²	103.7	22%	0.215	55%	0.553	C	S	.	*			trans	-84.9	-15.6	-178.7	-81	158.3	0	0	0	114.8	L122 Y123	L122-L257 HydrophobicContact CB-CB 4.41Å; L122-L257 HydrophobicContact CB-CD2 4.38Å; L122-L257 HydrophobicContact CD1-CB 4.43Å; Y123-L257 HydrophobicContact CD2-CD1 4.45Å
258	L	48.4	Very low	40.9	Very low	45 Å²	45	98.4 Å²	98.4	24%	0.236	53%	0.528	C	S	.	.	S	Bend	trans	-92.6	119.9	174.8	-96.1	148.5	0	0	0	109.2	R55 K119	R55-L258 HydrophobicContact CB-CD2 4.05Å; K119-L258 HydrophobicContact CG-CD1 4.1Å
259	V	53.7	Low	41.9	Very low	14 Å²	14	95.9 Å²	95.9	9%	0.085	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-64.8	132.7	179.2	-173.9	0	0	0	0	109.4	V58 K62 D263 I264	V58-V259 HydrophobicContact CG1-CG2 4.36Å; K62-V259 HydrophobicContact CD-CG2 4.21Å; V259-D263 HydrophobicContact CG1-CB 3.57Å; V259-I264 HydrophobicContact CB-CD1 4.28Å; V259-I264 HydrophobicContact CB-CG1 4.16Å; V259-I264 HydrophobicContact CG1-CD1 4.39Å; V259-I264 HydrophobicContact CG1-CG1 3.77Å
260	D	51.2	Low	42.9	Very low	113 Å²	113	90 Å²	90	60%	0.604	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-64.8	152	179.8	-137.8	-22.2	0	0	0	111	D262 D263 I264	D260-D262 PolarHBondContact O-N 3.01Å; D260-D263 PolarHBondContact O-N 3.32Å; D260-I264 PolarHBondContact O-N 2.94Å
261	L	50	Low	43.5	Very low	69 Å²	69	90.8 Å²	90.8	36%	0.361	50%	0.502	S	S	.	.	H	α-helix	trans	-59.5	-34.4	-175.5	-93.7	164	0	0	0	113	I51 I264 R265	I51-L261 HydrophobicContact CG2-CD2 3.92Å; L261-I264 PolarHBondContact O-N 3.16Å; L261-R265 PolarHBondContact O-N 3.07Å
262	D	44.8	Very low	44.4	Very low	113 Å²	113	92 Å²	92	60%	0.604	50%	0.5	S	S	*	.	H	α-helix	trans	-73.7	-37.8	-176.8	-69.7	-37.4	0	0	0	111.4	D260 I264 R265 D266	D260-D262 PolarHBondContact O-N 3.01Å; D262-I264 VanDerWaalsContact C-N 3.29Å; D262-I264 PolarHBondContact O-N 2.82Å; D262-R265 VanDerWaalsContact O-CB 3.29Å; D262-R265 WeakPolarHBondContact O-CB 3.34Å; D262-R265 PolarHBondContact O-N 3.15Å; D262-R265 VanDerWaalsContact O-N 3.08Å; D262-D266 PolarHBondContact O-N 3.09Å
263	D	49.9	Very low	45.3	Very low	81 Å²	81	90.2 Å²	90.2	43%	0.433	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-33.6	173	-79.4	-13	0	0	0	112.7	V259 D260 R265 L267	V259-D263 HydrophobicContact CG1-CB 3.57Å; D260-D263 PolarHBondContact O-N 3.32Å; D263-R265 VanDerWaalsContact C-N 3.29Å; D263-L267 WeakPolarHBondContact O-CG 3.4Å; D263-L267 PolarHBondContact O-N 3.18Å
264	I	49.8	Very low	46.2	Very low	7 Å²	7	92.9 Å²	92.9	4%	0.036	50%	0.497	C	S	.	.	H	α-helix	trans	-69.9	-30	176.7	-68.7	169.7	0	0	0	111.3	R54 R55 V58 V259 D260 L261 D262 S268	R54-I264 HydrophobicContact CG-CG2 4.27Å; R54-I264 PolarHBondContact NH2-O 3.32Å; R55-I264 HydrophobicContact CB-CD1 4.04Å; R55-I264 HydrophobicContact CG-CD1 3.36Å; V58-I264 HydrophobicContact CB-CG1 4.47Å; V58-I264 HydrophobicContact CG1-CG1 4.25Å; V259-I264 HydrophobicContact CB-CD1 4.28Å; V259-I264 HydrophobicContact CB-CG1 4.16Å; V259-I264 HydrophobicContact CG1-CD1 4.39Å; V259-I264 HydrophobicContact CG1-CG1 3.77Å; D260-I264 PolarHBondContact O-N 2.94Å; L261-I264 PolarHBondContact O-N 3.16Å; D262-I264 VanDerWaalsContact C-N 3.29Å; D262-I264 PolarHBondContact O-N 2.82Å; I264-S268 VanDerWaalsContact O-CB 3.22Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3.42Å; I264-S268 PolarHBondContact O-OG 3.04Å
265	R	47	Very low	47.6	Very low	170 Å²	170	96.5 Å²	96.5	64%	0.642	50%	0.5	S	S	*	.	H	α-helix	trans	-68.5	-50.7	177.6	-165	174.9	177.4	-173.9	-3.8	109.6	L261 D262 D263 L267 S268 S269	L261-R265 PolarHBondContact O-N 3.07Å; D262-R265 VanDerWaalsContact O-CB 3.29Å; D262-R265 WeakPolarHBondContact O-CB 3.34Å; D262-R265 PolarHBondContact O-N 3.15Å; D262-R265 VanDerWaalsContact O-N 3.08Å; D263-R265 VanDerWaalsContact C-N 3.29Å; R265-L267 PolarHBondContact O-N 3.22Å; R265-S268 PolarHBondContact O-N 3.24Å; R265-S268 PolarHBondContact O-OG 2.81Å; R265-S269 WeakPolarHBondContact O-CB 3.31Å; R265-S269 PolarHBondContact O-N 3.09Å; R265-S269 PolarHBondContact O-OG 3.3Å
266	D	47.8	Very low	49.5	Very low	124 Å²	124	93.9 Å²	93.9	66%	0.663	48%	0.479	S	S	*	.	H	α-helix	trans	-63.6	-38.9	-178.2	-72.8	-14.1	0	0	0	113.2	D262 S268	D262-D266 PolarHBondContact O-N 3.09Å; D266-S268 PolarHBondContact O-N 2.77Å
267	L	45.6	Very low	51.2	Low	20 Å²	20	91.1 Å²	91.1	11%	0.105	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.9	174.6	-71.6	168.5	0	0	0	113.6	V58 V155 V158 D263 R265	V58-L267 HydrophobicContact CG1-CD1 4.29Å; V155-L267 HydrophobicContact CG2-CB 4.44Å; V158-L267 HydrophobicContact CB-CD2 4.36Å; V158-L267 HydrophobicContact CG1-CD2 3.58Å; D263-L267 WeakPolarHBondContact O-CG 3.4Å; D263-L267 PolarHBondContact O-N 3.18Å; R265-L267 PolarHBondContact O-N 3.22Å
268	S	42	Very low	52.8	Low	33 Å²	33	89.2 Å²	89.2	23%	0.231	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-17.4	-175.9	72.9	0	0	0	0	115.1	R54 I264 R265 D266	R54-S268 PolarHBondContact NH2-OG 3.06Å; I264-S268 VanDerWaalsContact O-CB 3.22Å; I264-S268 WeakPolarHBondContact O-CB 3.43Å; I264-S268 PolarHBondContact O-N 3.42Å; I264-S268 PolarHBondContact O-OG 3.04Å; R265-S268 PolarHBondContact O-N 3.24Å; R265-S268 PolarHBondContact O-OG 2.81Å; D266-S268 PolarHBondContact O-N 2.77Å
269	S	47.8	Very low	54.2	Low	61 Å²	61	93.6 Å²	93.6	43%	0.427	46%	0.463	S	S	.	.			trans	-108.7	50.2	-167.3	65.9	0	0	0	0	113.7	R265 F271	R265-S269 WeakPolarHBondContact O-CB 3.31Å; R265-S269 PolarHBondContact O-N 3.09Å; R265-S269 PolarHBondContact O-OG 3.3Å; S269-F271 PolarHBondContact O-N 3.37Å
270	G	46.7	Very low	55.2	Low	76 Å²	76	100.6 Å²	100.6	78%	0.784	49%	0.489	S	S	*	.			trans	-69.8	63.5	169.9	0	0	0	0	0	113.3
271	F	44.7	Very low	56.6	Low	143 Å²	143	98.1 Å²	98.1	63%	0.627	48%	0.475	S	S	*	.			trans	-135.3	119.5	-179.4	-92.3	-75.3	0	0	0	114.7	S269 R275	S269-F271 PolarHBondContact O-N 3.37Å; F271-R275 VanDerWaalsContact CE1-CZ 3.43Å
272	S	44	Very low	58.2	Low	89 Å²	89	97.9 Å²	97.9	62%	0.622	48%	0.478	S	S	*	.			trans	-66.6	140	156.2	151.5	0	0	0	0	110.1	Y274	S272-Y274 PolarHBondContact O-N 2.96Å; S272-Y274 PolarHBondContact OG-N 3.47Å; S272-Y274 PolarHBondContact OG-O 3.49Å
273	K	47.6	Very low	60	Low	201 Å²	201	97.5 Å²	97.5	87%	0.874	48%	0.475	S	S	*	.	S	Bend	trans	-63	-16.2	179.9	-81.7	179.6	176.4	175.2	0	114.6
274	Y	49.7	Very low	61.7	Low	202 Å²	202	99.8 Å²	99.8	79%	0.792	48%	0.483	S	S	*	.	S	Bend	trans	-124.6	136.1	-179.6	-57	-78.3	0	0	0	111	S272	S272-Y274 PolarHBondContact O-N 2.96Å; S272-Y274 PolarHBondContact OG-N 3.47Å; S272-Y274 PolarHBondContact OG-O 3.49Å
275	R	62.2	Low	63.5	Low	163 Å²	163	103 Å²	103	62%	0.615	50%	0.5	S	S	*	.			trans	-107.6	135.4	178.2	-68.1	-166.6	-178.3	-158.7	8.2	111	F271 F277 Y280	F271-R275 VanDerWaalsContact CE1-CZ 3.43Å; R275-F277 PolarHBondContact O-N 3.46Å; R275-F277 VanDerWaalsContact O-N 3.07Å; R275-Y280 HydrophobicContact CB-CD2 4.37Å; R275-Y280 HydrophobicContact CB-CE2 4.2Å
276	D	74.5	Confident	65.5	Low	47 Å²	47	95 Å²	95	25%	0.251	47%	0.47	S	S	.	.			trans	-74.9	91.8	173.8	-178.1	-4.3	0	0	0	110.9	I278 R279 Y280 W308	D276-I278 VanDerWaalsContact C-N 3.29Å; D276-I278 PolarHBondContact O-N 2.83Å; D276-I278 PolarHBondContact OD1-N 3.4Å; D276-R279 HydrophobicContact CB-CB 4.27Å; D276-R279 PolarHBondContact O-N 3.07Å; D276-R279 PolarHBondContact OD1-N 3.22Å; D276-Y280 WeakPolarHBondContact O-CD2 3.19Å; D276-Y280 PolarHBondContact O-N 2.78Å; D276-W308 PolarHBondContact OD1-NE1 3.44Å; D276-W308 PolarHBondContact OD2-NE1 3.02Å
277	F	80.5	Confident	67.6	Low	102 Å²	102	90.9 Å²	90.9	45%	0.447	45%	0.446	S	S	.	.	H	α-helix	trans	-62.6	-31.8	-176	71.4	-85.3	0	0	0	113.5	R275 R279 Y280 L281 I289 W308	R275-F277 PolarHBondContact O-N 3.46Å; R275-F277 VanDerWaalsContact O-N 3.07Å; F277-R279 PolarHBondContact O-N 3.01Å; F277-Y280 PolarHBondContact O-N 3.26Å; F277-L281 HydrophobicContact CD2-CD1 3.84Å; F277-L281 WeakPolarHBondContact O-CB 3.26Å; F277-L281 VanDerWaalsContact O-CG 3.28Å; F277-L281 WeakPolarHBondContact O-CG 3.45Å; F277-L281 PolarHBondContact O-N 3.46Å; F277-I289 HydrophobicContact CD2-CD1 4.46Å; F277-I289 HydrophobicContact CE2-CD1 4.08Å; F277-I289 HydrophobicContact CE2-CG2 4.28Å; F277-W308 HydrophobicContact CE1-CH2 4.31Å; F277-W308 HydrophobicContact CE1-CZ2 4.3Å; F277-W308 HydrophobicContact CZ-CH2 4.24Å
278	I	82	Confident	69.6	Low	0 Å²	0	97.2 Å²	97.2	0%	0	47%	0.469	C	S	.	.	H	α-helix	trans	-64.5	-33.3	179	-71.3	-60.8	0	0	0	111.1	D276 S286 I289 L290 W308	D276-I278 VanDerWaalsContact C-N 3.29Å; D276-I278 PolarHBondContact O-N 2.83Å; D276-I278 PolarHBondContact OD1-N 3.4Å; I278-S286 PolarHBondContact O-OG 3.07Å; I278-I289 HydrophobicContact CD1-CB 4.37Å; I278-I289 HydrophobicContact CD1-CD1 4.49Å; I278-I289 HydrophobicContact CD1-CG2 4.32Å; I278-L290 HydrophobicContact CD1-CG 4.33Å; I278-W308 HydrophobicContact CB-CD2 4.32Å; I278-W308 HydrophobicContact CB-CH2 4.34Å; I278-W308 HydrophobicContact CB-CZ2 3.63Å; I278-W308 HydrophobicContact CG1-CD2 4.33Å; I278-W308 HydrophobicContact CG1-CH2 3.49Å; I278-W308 VanDerWaalsContact CG1-CH2 3.49Å; I278-W308 HydrophobicContact CG1-CZ2 3.24Å; I278-W308 HydrophobicContact CG1-CZ3 4.13Å; I278-W308 HydrophobicContact CG2-CD2 4.23Å; I278-W308 HydrophobicContact CG2-CG 4.39Å; I278-W308 HydrophobicContact CG2-CZ2 4.41Å
279	R	75.9	Confident	71.9	Confident	138 Å²	138	98.1 Å²	98.1	52%	0.521	47%	0.471	S	S	.	.	H	α-helix	trans	-78.5	-25.9	177.4	-169.2	178.1	-89.9	-158.1	-4.5	113.3	D276 F277	D276-R279 HydrophobicContact CB-CB 4.27Å; D276-R279 PolarHBondContact O-N 3.07Å; D276-R279 PolarHBondContact OD1-N 3.22Å; F277-R279 PolarHBondContact O-N 3.01Å
280	Y	75.1	Confident	74	Confident	160 Å²	160	95.3 Å²	95.3	63%	0.627	45%	0.451	S	S	*	.	H	α-helix	trans	-94.2	-15.1	-180	-68.6	-65.7	0	0	0	114.2	R275 D276 F277	R275-Y280 HydrophobicContact CB-CD2 4.37Å; R275-Y280 HydrophobicContact CB-CE2 4.2Å; D276-Y280 WeakPolarHBondContact O-CD2 3.19Å; D276-Y280 PolarHBondContact O-N 2.78Å; F277-Y280 PolarHBondContact O-N 3.26Å
281	L	81.1	Confident	76	Confident	61 Å²	61	98.1 Å²	98.1	32%	0.319	44%	0.438	S	S	.	.	S	Bend	trans	-82.1	151.5	175.4	-77.4	172.5	0	0	0	111.9	F277 L285 S286 I289	F277-L281 HydrophobicContact CD2-CD1 3.84Å; F277-L281 WeakPolarHBondContact O-CB 3.26Å; F277-L281 VanDerWaalsContact O-CG 3.28Å; F277-L281 WeakPolarHBondContact O-CG 3.45Å; F277-L281 PolarHBondContact O-N 3.46Å; L281-L285 HydrophobicContact CD2-CD1 4.25Å; L281-S286 VanDerWaalsContact CB-OG 3.31Å; L281-S286 WeakPolarHBondContact CB-OG 3.02Å; L281-I289 HydrophobicContact CD1-CD1 3.63Å
282	P	82.9	Confident	78.1	Confident	65 Å²	65	97.5 Å²	97.5	42%	0.422	44%	0.439	S	S	.	.			trans	-53.1	139.8	165.7	-25.7	34	0	0	0	112.1	H284 L285 S286	P282-H284 WeakPolarHBondContact CB-CE1 3.3Å; P282-H284 PolarHBondContact O-N 3.34Å; P282-L285 HydrophobicContact CG-CD1 4.39Å; P282-L285 PolarHBondContact O-N 3.19Å; P282-S286 PolarHBondContact O-N 3.21Å; P282-S286 VanDerWaalsContact O-N 3.07Å; P282-S286 PolarHBondContact O-OG 2.98Å
283	I	82.8	Confident	80.2	Confident	104 Å²	104	96.2 Å²	96.2	53%	0.533	43%	0.425	S	S	.	.	H	α-helix	trans	-50.3	-39.4	-173.6	-64.9	170.5	0	0	0	112.7	S286 K287 M311	I283-S286 PolarHBondContact O-N 3.34Å; I283-K287 HydrophobicContact CG2-CD 4.35Å; I283-K287 HydrophobicContact CG2-CG 4.37Å; I283-K287 WeakPolarHBondContact O-CB 3.5Å; I283-K287 WeakPolarHBondContact O-CG 3.27Å; I283-K287 PolarHBondContact O-N 3.47Å; I283-M311 HydrophobicContact CG2-CE 3.98Å; I283-M311 HydrophobicContact CG2-SD 4.12Å; I283-M311 WeakPolarHBondContact O-CE 3.23Å
284	H	85.2	Confident	82.1	Confident	129 Å²	129	90.6 Å²	90.6	60%	0.597	40%	0.404	S	S	*	.	H	α-helix	trans	-66	-39.8	-179.9	58.2	-89.3	0	0	0	112.9	P282 Y288	P282-H284 WeakPolarHBondContact CB-CE1 3.3Å; P282-H284 PolarHBondContact O-N 3.34Å; H284-Y288 WeakPolarHBondContact O-CB 3.23Å; H284-Y288 PolarHBondContact O-N 3.46Å
285	L	87.8	Confident	83.8	Confident	76 Å²	76	90.9 Å²	90.9	40%	0.398	40%	0.404	S	S	.	.	H	α-helix	trans	-70.3	-42.4	175.9	-68	178.8	0	0	0	110.8	L281 P282 K287 Y288 I289	L281-L285 HydrophobicContact CD2-CD1 4.25Å; P282-L285 HydrophobicContact CG-CD1 4.39Å; P282-L285 PolarHBondContact O-N 3.19Å; L285-K287 VanDerWaalsContact C-N 3.33Å; L285-K287 PolarHBondContact O-N 3.28Å; L285-Y288 WeakPolarHBondContact O-CB 3.41Å; L285-Y288 PolarHBondContact O-N 3.31Å; L285-Y288 VanDerWaalsContact O-N 3.17Å; L285-I289 WeakPolarHBondContact O-CG1 3.11Å; L285-I289 PolarHBondContact O-N 3.28Å
286	S	90.4	Very high	85.1	Confident	1 Å²	1	88.6 Å²	88.6	1%	0.007	40%	0.4	C	S	.	.	H	α-helix	trans	-59.5	-44.3	175.5	-61.3	0	0	0	0	111.7	I278 L281 P282 I283 L290 M311	I278-S286 PolarHBondContact O-OG 3.07Å; L281-S286 VanDerWaalsContact CB-OG 3.31Å; L281-S286 WeakPolarHBondContact CB-OG 3.02Å; P282-S286 PolarHBondContact O-N 3.21Å; P282-S286 VanDerWaalsContact O-N 3.07Å; P282-S286 PolarHBondContact O-OG 2.98Å; I283-S286 PolarHBondContact O-N 3.34Å; S286-L290 WeakPolarHBondContact O-CB 3.44Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.1Å; S286-L290 PolarHBondContact O-N 3.33Å; S286-L290 VanDerWaalsContact O-N 3.08Å; S286-M311 VanDerWaalsContact CB-CE 3.46Å
287	K	90.4	Very high	85.8	Confident	38 Å²	38	88.7 Å²	88.7	17%	0.165	40%	0.403	C	S	.	.	H	α-helix	trans	-63.1	-42	173.1	-77.1	-172.8	172.9	-161.3	0	112.6	I283 L285 L290 R291 M311 V315 D318	I283-K287 HydrophobicContact CG2-CD 4.35Å; I283-K287 HydrophobicContact CG2-CG 4.37Å; I283-K287 WeakPolarHBondContact O-CB 3.5Å; I283-K287 WeakPolarHBondContact O-CG 3.27Å; I283-K287 PolarHBondContact O-N 3.47Å; L285-K287 VanDerWaalsContact C-N 3.33Å; L285-K287 PolarHBondContact O-N 3.28Å; K287-L290 PolarHBondContact O-N 3.2Å; K287-R291 VanDerWaalsContact O-CB 3.29Å; K287-R291 WeakPolarHBondContact O-CB 3.36Å; K287-R291 PolarHBondContact O-N 3.48Å; K287-M311 HydrophobicContact CB-CE 4.43Å; K287-M311 HydrophobicContact CG-CE 3.57Å; K287-V315 HydrophobicContact CB-CG2 4.02Å; K287-V315 HydrophobicContact CG-CG2 3.96Å; K287-D318 IonicContact NZ-OD2 3.93Å; K287-D318 PolarHBondContact NZ-OD2 3.28Å
288	Y	89.2	Confident	86.2	Confident	152 Å²	152	84 Å²	84	60%	0.596	38%	0.382	S	S	*	.	H	α-helix	trans	-61	-45.2	179.2	-178.1	-95.9	0	0	0	111.6	H284 L285 R291 M292	H284-Y288 WeakPolarHBondContact O-CB 3.23Å; H284-Y288 PolarHBondContact O-N 3.46Å; L285-Y288 WeakPolarHBondContact O-CB 3.41Å; L285-Y288 PolarHBondContact O-N 3.31Å; L285-Y288 VanDerWaalsContact O-N 3.17Å; Y288-R291 PolarHBondContact O-N 3.11Å; Y288-M292 HydrophobicContact CD1-CE 4.28Å; Y288-M292 HydrophobicContact CE1-CE 4.06Å; Y288-M292 HydrophobicContact CE1-SD 4.08Å; Y288-M292 PolarHBondContact O-N 2.66Å
289	I	90.1	Very high	86.5	Confident	53 Å²	53	87.7 Å²	87.7	27%	0.272	40%	0.402	S	S	.	.	H	α-helix	trans	-62.2	-48.7	176.6	-64.7	164.9	0	0	0	110.6	F277 I278 L281 L285 R291 M292	F277-I289 HydrophobicContact CD2-CD1 4.46Å; F277-I289 HydrophobicContact CE2-CD1 4.08Å; F277-I289 HydrophobicContact CE2-CG2 4.28Å; I278-I289 HydrophobicContact CD1-CB 4.37Å; I278-I289 HydrophobicContact CD1-CD1 4.49Å; I278-I289 HydrophobicContact CD1-CG2 4.32Å; L281-I289 HydrophobicContact CD1-CD1 3.63Å; L285-I289 WeakPolarHBondContact O-CG1 3.11Å; L285-I289 PolarHBondContact O-N 3.28Å; I289-R291 PolarHBondContact O-N 3.44Å; I289-M292 PolarHBondContact O-N 3.1Å; I289-M292 VanDerWaalsContact O-N 3.16Å
290	L	90.3	Very high	87	Confident	1 Å²	1	86.7 Å²	86.7	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-63.9	-29.3	179.1	-71.4	174.6	0	0	0	112.9	I278 S286 K287 M292 L293 L298 C301 W308 M311 V315	I278-L290 HydrophobicContact CD1-CG 4.33Å; S286-L290 WeakPolarHBondContact O-CB 3.44Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.1Å; S286-L290 PolarHBondContact O-N 3.33Å; S286-L290 VanDerWaalsContact O-N 3.08Å; K287-L290 PolarHBondContact O-N 3.2Å; L290-M292 VanDerWaalsContact C-N 3.28Å; L290-M292 PolarHBondContact O-N 2.98Å; L290-L293 HydrophobicContact CD2-CD1 3.93Å; L290-L293 WeakPolarHBondContact O-CB 3.49Å; L290-L293 PolarHBondContact O-N 3.29Å; L290-L298 HydrophobicContact CB-CD1 4.04Å; L290-L298 HydrophobicContact CD2-CD1 4.29Å; L290-C301 HydrophobicContact CD2-CB 4.37Å; L290-W308 HydrophobicContact CD2-CE3 4.16Å; L290-W308 HydrophobicContact CD2-CZ3 3.98Å; L290-M311 HydrophobicContact CD1-CB 3.64Å; L290-V315 HydrophobicContact CB-CG2 4.04Å
291	R	89.4	Confident	87.6	Confident	136 Å²	136	79.6 Å²	79.6	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-68.3	-24.2	176.5	-179.9	177.5	168.4	176.3	-0.9	113.1	K287 Y288 I289 L293 V315 L319	K287-R291 VanDerWaalsContact O-CB 3.29Å; K287-R291 WeakPolarHBondContact O-CB 3.36Å; K287-R291 PolarHBondContact O-N 3.48Å; Y288-R291 PolarHBondContact O-N 3.11Å; I289-R291 PolarHBondContact O-N 3.44Å; R291-L293 PolarHBondContact O-N 3.21Å; R291-V315 HydrophobicContact CB-CG1 4.11Å; R291-L319 HydrophobicContact CG-CD2 4.26Å
292	M	88.5	Confident	87.8	Confident	129 Å²	129	78.2 Å²	78.2	64%	0.635	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-9.7	176.9	-64.3	-168.1	-74.1	0	0	113.2	Y288 I289 L290	Y288-M292 HydrophobicContact CD1-CE 4.28Å; Y288-M292 HydrophobicContact CE1-CE 4.06Å; Y288-M292 HydrophobicContact CE1-SD 4.08Å; Y288-M292 PolarHBondContact O-N 2.66Å; I289-M292 PolarHBondContact O-N 3.1Å; I289-M292 VanDerWaalsContact O-N 3.16Å; L290-M292 VanDerWaalsContact C-N 3.28Å; L290-M292 PolarHBondContact O-N 2.98Å
293	L	87.7	Confident	87.9	Confident	63 Å²	63	80 Å²	80	33%	0.33	39%	0.387	S	S	.	.	S	Bend	trans	-86.2	150.1	-179.2	-57.8	174.6	0	0	0	111.5	L290 R291 T297	L290-L293 HydrophobicContact CD2-CD1 3.93Å; L290-L293 WeakPolarHBondContact O-CB 3.49Å; L290-L293 PolarHBondContact O-N 3.29Å; R291-L293 PolarHBondContact O-N 3.21Å; L293-T297 HydrophobicContact CD1-CG2 4.36Å; L293-T297 HydrophobicContact CD2-CG2 4.35Å
294	D	88.3	Confident	88	Confident	83 Å²	83	79.4 Å²	79.4	44%	0.444	39%	0.387	S	S	.	.			trans	-70	161.3	172.4	69	-64.1	0	0	0	111.6	H296 T297 L298	D294-H296 PolarHBondContact O-N 3.21Å; D294-H296 VanDerWaalsContact OD2-CB 3.27Å; D294-H296 WeakPolarHBondContact OD2-CB 3.44Å; D294-H296 PolarHBondContact OD2-N 3.23Å; D294-H296 VanDerWaalsContact OD2-N 3.14Å; D294-T297 PolarHBondContact O-N 2.89Å; D294-T297 WeakPolarHBondContact OD1-CB 3.45Å; D294-T297 PolarHBondContact OD1-OG1 3.03Å; D294-T297 PolarHBondContact OD2-N 3.28Å; D294-T297 VanDerWaalsContact OD2-N 3.1Å; D294-T297 PolarHBondContact OD2-OG1 3.26Å; D294-L298 WeakPolarHBondContact O-CB 3.37Å; D294-L298 PolarHBondContact O-N 3.23Å
295	R	85.2	Confident	88	Confident	207 Å²	207	74.8 Å²	74.8	78%	0.781	37%	0.37	S	S	*	.	H	α-helix	trans	-60.9	-30.8	-175.2	-164.8	174	177.4	174.1	-1.6	112.6	N299	R295-N299 PolarHBondContact O-N 3.07Å; R295-N299 PolarHBondContact O-ND2 3.44Å
296	H	88.8	Confident	87.7	Confident	115 Å²	115	79.6 Å²	79.6	53%	0.532	39%	0.39	S	S	.	.	H	α-helix	trans	-75.1	-44.9	179.5	-176	74.1	0	0	0	111.1	D294 N299 K300	D294-H296 PolarHBondContact O-N 3.21Å; D294-H296 VanDerWaalsContact OD2-CB 3.27Å; D294-H296 WeakPolarHBondContact OD2-CB 3.44Å; D294-H296 PolarHBondContact OD2-N 3.23Å; D294-H296 VanDerWaalsContact OD2-N 3.14Å; H296-N299 WeakPolarHBondContact O-CB 3.49Å; H296-N299 PolarHBondContact O-N 3.3Å; H296-K300 WeakPolarHBondContact NE2-CE 3.49Å; H296-K300 PolarHBondContact NE2-NZ 3.04Å; H296-K300 PolarHBondContact O-N 2.85Å
297	T	90.2	Very high	87.3	Confident	50 Å²	50	82.4 Å²	82.4	31%	0.307	40%	0.403	S	S	.	.	H	α-helix	trans	-66.5	-37.5	175.1	-53.9	0	0	0	0	112.1	L293 D294 N299 K300 C301	L293-T297 HydrophobicContact CD1-CG2 4.36Å; L293-T297 HydrophobicContact CD2-CG2 4.35Å; D294-T297 PolarHBondContact O-N 2.89Å; D294-T297 WeakPolarHBondContact OD1-CB 3.45Å; D294-T297 PolarHBondContact OD1-OG1 3.03Å; D294-T297 PolarHBondContact OD2-N 3.28Å; D294-T297 VanDerWaalsContact OD2-N 3.1Å; D294-T297 PolarHBondContact OD2-OG1 3.26Å; T297-N299 PolarHBondContact O-N 3.49Å; T297-K300 CarbonylContact O-C 3.52Å; T297-K300 WeakPolarHBondContact O-CA 3.28Å; T297-K300 WeakPolarHBondContact O-CB 3.4Å; T297-K300 PolarHBondContact O-N 3.02Å; T297-C301 PolarHBondContact O-N 3.42Å; T297-C301 PolarHBondContact O-SG 3.25Å
298	L	88.8	Confident	87.4	Confident	3 Å²	3	82 Å²	82	2%	0.016	40%	0.4	C	S	.	.	H	α-helix	trans	-63	-30.8	175	-168.7	66.2	0	0	0	112.6	L290 D294 C301 A302 A312 V315 K316	L290-L298 HydrophobicContact CB-CD1 4.04Å; L290-L298 HydrophobicContact CD2-CD1 4.29Å; D294-L298 WeakPolarHBondContact O-CB 3.37Å; D294-L298 PolarHBondContact O-N 3.23Å; L298-C301 WeakPolarHBondContact O-CB 3.31Å; L298-A302 PolarHBondContact O-N 2.98Å; L298-A312 HydrophobicContact CD1-CB 3.83Å; L298-A312 HydrophobicContact CG-CB 4.13Å; L298-V315 HydrophobicContact CD2-CB 4.45Å; L298-V315 HydrophobicContact CD2-CG1 4.03Å; L298-K316 HydrophobicContact CD2-CG 3.62Å; L298-K316 HydrophobicContact CG-CG 4.47Å
299	N	87.8	Confident	87.3	Confident	78 Å²	78	76.2 Å²	76.2	42%	0.417	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-39.6	171.6	-71.7	-22.7	0	0	0	111.8	R295 H296 T297 C301 A302 K316	R295-N299 PolarHBondContact O-N 3.07Å; R295-N299 PolarHBondContact O-ND2 3.44Å; H296-N299 WeakPolarHBondContact O-CB 3.49Å; H296-N299 PolarHBondContact O-N 3.3Å; T297-N299 PolarHBondContact O-N 3.49Å; N299-C301 VanDerWaalsContact C-N 3.35Å; N299-A302 WeakPolarHBondContact O-CB 3.27Å; N299-A302 PolarHBondContact O-N 3.46Å; N299-K316 WeakPolarHBondContact OD1-CE 3.31Å; N299-K316 PolarHBondContact OD1-NZ 3.45Å
300	K	88	Confident	87.2	Confident	116 Å²	116	76.7 Å²	76.7	50%	0.504	40%	0.396	S	S	.	.	H	α-helix	trans	-67.5	-34.8	174.2	-66.2	179.3	179.7	170.2	0	112.3	H296 T297 A302 S303	H296-K300 WeakPolarHBondContact NE2-CE 3.49Å; H296-K300 PolarHBondContact NE2-NZ 3.04Å; H296-K300 PolarHBondContact O-N 2.85Å; T297-K300 CarbonylContact O-C 3.52Å; T297-K300 WeakPolarHBondContact O-CA 3.28Å; T297-K300 WeakPolarHBondContact O-CB 3.4Å; T297-K300 PolarHBondContact O-N 3.02Å; K300-A302 PolarHBondContact O-N 2.78Å; K300-S303 PolarHBondContact O-N 2.94Å; K300-S303 PolarHBondContact O-OG 2.81Å
301	C	86.3	Confident	87.1	Confident	12 Å²	12	77.1 Å²	77.1	8%	0.081	40%	0.398	C	S	.	.	H	α-helix	trans	-58	-32.7	172.7	-72.4	0	0	0	0	112.1	L290 T297 L298 N299 S303 V304 W308	L290-C301 HydrophobicContact CD2-CB 4.37Å; T297-C301 PolarHBondContact O-N 3.42Å; T297-C301 PolarHBondContact O-SG 3.25Å; L298-C301 WeakPolarHBondContact O-CB 3.31Å; N299-C301 VanDerWaalsContact C-N 3.35Å; C301-S303 PolarHBondContact O-N 3.43Å; C301-V304 WeakPolarHBondContact O-CB 3.39Å; C301-V304 PolarHBondContact O-N 3.25Å; C301-W308 HydrophobicContact CB-CE3 3.78Å; C301-W308 HydrophobicContact CB-CZ3 4.13Å; C301-W308 VanDerWaalsContact O-CB 3.26Å; C301-W308 WeakPolarHBondContact O-CB 3.48Å
302	A	85.6	Confident	87.2	Confident	32 Å²	32	70.6 Å²	70.6	26%	0.264	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-17.4	178	0	0	0	0	0	113.9	L298 N299 K300 A309 A312	L298-A302 PolarHBondContact O-N 2.98Å; N299-A302 WeakPolarHBondContact O-CB 3.27Å; N299-A302 PolarHBondContact O-N 3.46Å; K300-A302 PolarHBondContact O-N 2.78Å; A302-A309 HydrophobicContact CB-CB 4.3Å; A302-A309 WeakPolarHBondContact O-CB 3.49Å; A302-A312 HydrophobicContact CB-CB 4.3Å
303	S	84.4	Confident	87.3	Confident	103 Å²	103	69.1 Å²	69.1	72%	0.72	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-1	174.9	58.4	0	0	0	0	113.9	K300 C301	K300-S303 PolarHBondContact O-N 2.94Å; K300-S303 PolarHBondContact O-OG 2.81Å; C301-S303 PolarHBondContact O-N 3.43Å
304	V	85.2	Confident	87.4	Confident	90 Å²	90	70.1 Å²	70.1	55%	0.545	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-46.8	-177.7	178.3	0	0	0	0	111.7	C301 W308	C301-V304 WeakPolarHBondContact O-CB 3.39Å; C301-V304 PolarHBondContact O-N 3.25Å; V304-W308 HydrophobicContact CB-CB 4.22Å; V304-W308 HydrophobicContact CB-CD2 4.18Å; V304-W308 HydrophobicContact CB-CE3 4.41Å; V304-W308 HydrophobicContact CB-CG 4.12Å; V304-W308 HydrophobicContact CG1-CD2 4.16Å; V304-W308 HydrophobicContact CG1-CG 4.21Å; V304-W308 HydrophobicContact CG2-CE3 4.38Å
305	S	84.7	Confident	87.6	Confident	33 Å²	33	66.3 Å²	66.3	23%	0.231	35%	0.348	C	S	.	.			trans	-163.5	164.8	175.6	72	0	0	0	0	111	H307 W308 A309	S305-H307 PolarHBondContact O-N 3.1Å; S305-H307 PolarHBondContact OG-N 2.71Å; S305-W308 PolarHBondContact O-N 3.24Å; S305-W308 VanDerWaalsContact O-N 3.15Å; S305-W308 PolarHBondContact OG-N 3.18Å; S305-A309 WeakPolarHBondContact O-CB 3Å; S305-A309 PolarHBondContact O-N 3.14Å
306	Q	82.8	Confident	87.8	Confident	177 Å²	177	59 Å²	59	83%	0.827	32%	0.321	S	S	*	.	H	α-helix	trans	-57.9	-33.3	176.1	-166.8	179.3	10.9	0	0	113	A310	Q306-A310 PolarHBondContact O-N 3.47Å; Q306-A310 VanDerWaalsContact O-N 3.09Å
307	H	82.8	Confident	87.7	Confident	60 Å²	60	58.7 Å²	58.7	28%	0.278	32%	0.322	S	S	.	.	H	α-helix	trans	-71.3	-44.5	177.2	-177.3	77.1	0	0	0	111.5	S305 A309 A310 M311	S305-H307 PolarHBondContact O-N 3.1Å; S305-H307 PolarHBondContact OG-N 2.71Å; H307-A309 VanDerWaalsContact C-N 3.31Å; H307-A309 PolarHBondContact O-N 2.55Å; H307-A310 PolarHBondContact O-N 3.46Å; H307-M311 VanDerWaalsContact O-CG 3.3Å; H307-M311 WeakPolarHBondContact O-CG 3.46Å; H307-M311 PolarHBondContact O-N 2.91Å
308	W	91.1	Very high	87.6	Confident	29 Å²	29	60 Å²	60	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-37.2	174.6	-79.9	61.1	0	0	0	112	D276 F277 I278 L290 C301 V304 S305 M311 A312	D276-W308 PolarHBondContact OD1-NE1 3.44Å; D276-W308 PolarHBondContact OD2-NE1 3.02Å; F277-W308 HydrophobicContact CE1-CH2 4.31Å; F277-W308 HydrophobicContact CE1-CZ2 4.3Å; F277-W308 HydrophobicContact CZ-CH2 4.24Å; I278-W308 HydrophobicContact CB-CD2 4.32Å; I278-W308 HydrophobicContact CB-CH2 4.34Å; I278-W308 HydrophobicContact CB-CZ2 3.63Å; I278-W308 HydrophobicContact CG1-CD2 4.33Å; I278-W308 HydrophobicContact CG1-CH2 3.49Å; I278-W308 VanDerWaalsContact CG1-CH2 3.49Å; I278-W308 HydrophobicContact CG1-CZ2 3.24Å; I278-W308 HydrophobicContact CG1-CZ3 4.13Å; I278-W308 HydrophobicContact CG2-CD2 4.23Å; I278-W308 HydrophobicContact CG2-CG 4.39Å; I278-W308 HydrophobicContact CG2-CZ2 4.41Å; L290-W308 HydrophobicContact CD2-CE3 4.16Å; L290-W308 HydrophobicContact CD2-CZ3 3.98Å; C301-W308 HydrophobicContact CB-CE3 3.78Å; C301-W308 HydrophobicContact CB-CZ3 4.13Å; C301-W308 VanDerWaalsContact O-CB 3.26Å; C301-W308 WeakPolarHBondContact O-CB 3.48Å; V304-W308 HydrophobicContact CB-CB 4.22Å; V304-W308 HydrophobicContact CB-CD2 4.18Å; V304-W308 HydrophobicContact CB-CE3 4.41Å; V304-W308 HydrophobicContact CB-CG 4.12Å; V304-W308 HydrophobicContact CG1-CD2 4.16Å; V304-W308 HydrophobicContact CG1-CG 4.21Å; V304-W308 HydrophobicContact CG2-CE3 4.38Å; S305-W308 PolarHBondContact O-N 3.24Å; S305-W308 VanDerWaalsContact O-N 3.15Å; S305-W308 PolarHBondContact OG-N 3.18Å; W308-M311 PolarHBondContact O-N 3.29Å; W308-A312 WeakPolarHBondContact O-CB 3.32Å; W308-A312 PolarHBondContact O-N 3.07Å
309	A	87.2	Confident	87.5	Confident	31 Å²	31	63.3 Å²	63.3	26%	0.256	34%	0.344	S	S	.	.	H	α-helix	trans	-60.3	-48.5	174.8	0	0	0	0	0	112.1	A302 S305 H307 M311 A312 Q313	A302-A309 HydrophobicContact CB-CB 4.3Å; A302-A309 WeakPolarHBondContact O-CB 3.49Å; S305-A309 WeakPolarHBondContact O-CB 3Å; S305-A309 PolarHBondContact O-N 3.14Å; H307-A309 VanDerWaalsContact C-N 3.31Å; H307-A309 PolarHBondContact O-N 2.55Å; A309-M311 PolarHBondContact O-N 3.35Å; A309-A312 PolarHBondContact O-N 2.96Å; A309-Q313 VanDerWaalsContact O-CB 3.31Å; A309-Q313 WeakPolarHBondContact O-CB 3.4Å; A309-Q313 PolarHBondContact O-N 3.37Å
310	A	87.9	Confident	87.5	Confident	63 Å²	63	63.5 Å²	63.5	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-45.1	177.3	0	0	0	0	0	111.7	Q306 H307 Q313 Q314	Q306-A310 PolarHBondContact O-N 3.47Å; Q306-A310 VanDerWaalsContact O-N 3.09Å; H307-A310 PolarHBondContact O-N 3.46Å; A310-Q313 PolarHBondContact O-N 3.43Å; A310-Q314 PolarHBondContact O-N 3.17Å
311	M	89.4	Confident	87.4	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.044	35%	0.346	C	S	.	.	H	α-helix	trans	-66.6	-45.6	179.6	-69.8	-65.8	-68	0	0	112.4	I283 S286 K287 L290 H307 W308 A309 Q313 Q314 V315	I283-M311 HydrophobicContact CG2-CE 3.98Å; I283-M311 HydrophobicContact CG2-SD 4.12Å; I283-M311 WeakPolarHBondContact O-CE 3.23Å; S286-M311 VanDerWaalsContact CB-CE 3.46Å; K287-M311 HydrophobicContact CB-CE 4.43Å; K287-M311 HydrophobicContact CG-CE 3.57Å; L290-M311 HydrophobicContact CD1-CB 3.64Å; H307-M311 VanDerWaalsContact O-CG 3.3Å; H307-M311 WeakPolarHBondContact O-CG 3.46Å; H307-M311 PolarHBondContact O-N 2.91Å; W308-M311 PolarHBondContact O-N 3.29Å; A309-M311 PolarHBondContact O-N 3.35Å; M311-Q313 VanDerWaalsContact C-N 3.31Å; M311-Q313 PolarHBondContact O-N 3.29Å; M311-Q314 PolarHBondContact O-N 2.94Å; M311-V315 WeakPolarHBondContact O-CG2 3.32Å; M311-V315 PolarHBondContact O-N 3.29Å
312	A	91	Very high	87.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-62.5	-39.4	177.4	0	0	0	0	0	111.6	L298 A302 W308 A309 V315 K316	L298-A312 HydrophobicContact CD1-CB 3.83Å; L298-A312 HydrophobicContact CG-CB 4.13Å; A302-A312 HydrophobicContact CB-CB 4.3Å; W308-A312 WeakPolarHBondContact O-CB 3.32Å; W308-A312 PolarHBondContact O-N 3.07Å; A309-A312 PolarHBondContact O-N 2.96Å; A312-V315 PolarHBondContact O-N 2.88Å; A312-K316 WeakPolarHBondContact O-CG 3.35Å; A312-K316 PolarHBondContact O-N 3.31Å
313	Q	89.4	Confident	87.2	Confident	97 Å²	97	64.3 Å²	64.3	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-42	176.1	-170.7	68.4	-4.8	0	0	111.6	A309 A310 M311 V315 K316 M317	A309-Q313 VanDerWaalsContact O-CB 3.31Å; A309-Q313 WeakPolarHBondContact O-CB 3.4Å; A309-Q313 PolarHBondContact O-N 3.37Å; A310-Q313 PolarHBondContact O-N 3.43Å; M311-Q313 VanDerWaalsContact C-N 3.31Å; M311-Q313 PolarHBondContact O-N 3.29Å; Q313-V315 PolarHBondContact O-N 3.16Å; Q313-K316 WeakPolarHBondContact O-CB 3.31Å; Q313-K316 PolarHBondContact O-N 2.99Å; Q313-M317 HydrophobicContact CG-CE 3.88Å; Q313-M317 WeakPolarHBondContact O-CG 3.48Å; Q313-M317 PolarHBondContact O-N 2.94Å
314	Q	90.4	Very high	87.2	Confident	84 Å²	84	65.5 Å²	65.5	39%	0.393	36%	0.359	S	S	.	.	H	α-helix	trans	-64.2	-40.6	177.3	-156.8	174.9	10.2	0	0	111.9	A310 M311 K316 M317 D318	A310-Q314 PolarHBondContact O-N 3.17Å; M311-Q314 PolarHBondContact O-N 2.94Å; Q314-K316 VanDerWaalsContact C-N 3.34Å; Q314-K316 PolarHBondContact O-N 3.44Å; Q314-M317 PolarHBondContact O-N 3.04Å; Q314-D318 VanDerWaalsContact O-CG 3.24Å; Q314-D318 PolarHBondContact O-N 3.07Å
315	V	92.1	Very high	87	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.024	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-38	174.3	172.7	0	0	0	0	111.8	K287 L290 R291 L298 M311 A312 Q313 D318 L319	K287-V315 HydrophobicContact CB-CG2 4.02Å; K287-V315 HydrophobicContact CG-CG2 3.96Å; L290-V315 HydrophobicContact CB-CG2 4.04Å; R291-V315 HydrophobicContact CB-CG1 4.11Å; L298-V315 HydrophobicContact CD2-CB 4.45Å; L298-V315 HydrophobicContact CD2-CG1 4.03Å; M311-V315 WeakPolarHBondContact O-CG2 3.32Å; M311-V315 PolarHBondContact O-N 3.29Å; A312-V315 PolarHBondContact O-N 2.88Å; Q313-V315 PolarHBondContact O-N 3.16Å; V315-D318 PolarHBondContact O-N 2.94Å; V315-L319 HydrophobicContact CG1-CD1 4.1Å; V315-L319 HydrophobicContact CG1-CG 4.43Å; V315-L319 WeakPolarHBondContact O-CB 3.41Å; V315-L319 WeakPolarHBondContact O-CG 3.29Å; V315-L319 PolarHBondContact O-N 3.38Å
316	K	89.4	Confident	86.7	Confident	52 Å²	52	68.4 Å²	68.4	23%	0.226	37%	0.365	C	S	.	.	H	α-helix	trans	-63	-42.7	174.6	-72.1	174.2	-163.4	171.1	0	112.3	L298 N299 A312 Q313 Q314 L319 S320	L298-K316 HydrophobicContact CD2-CG 3.62Å; L298-K316 HydrophobicContact CG-CG 4.47Å; N299-K316 WeakPolarHBondContact OD1-CE 3.31Å; N299-K316 PolarHBondContact OD1-NZ 3.45Å; A312-K316 WeakPolarHBondContact O-CG 3.35Å; A312-K316 PolarHBondContact O-N 3.31Å; Q313-K316 WeakPolarHBondContact O-CB 3.31Å; Q313-K316 PolarHBondContact O-N 2.99Å; Q314-K316 VanDerWaalsContact C-N 3.34Å; Q314-K316 PolarHBondContact O-N 3.44Å; K316-L319 PolarHBondContact O-N 2.88Å; K316-S320 PolarHBondContact O-N 3.08Å
317	M	87.4	Confident	86.5	Confident	109 Å²	109	65.6 Å²	65.6	54%	0.537	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-47.7	174.9	-65.2	-176	-166.6	0	0	110.5	Q313 Q314 L319 S320 A321	Q313-M317 HydrophobicContact CG-CE 3.88Å; Q313-M317 WeakPolarHBondContact O-CG 3.48Å; Q313-M317 PolarHBondContact O-N 2.94Å; Q314-M317 PolarHBondContact O-N 3.04Å; M317-L319 VanDerWaalsContact C-N 3.33Å; M317-L319 PolarHBondContact O-N 3.44Å; M317-S320 PolarHBondContact O-N 3.47Å; M317-S320 VanDerWaalsContact O-N 3.14Å; M317-S320 PolarHBondContact O-OG 3.34Å; M317-A321 PolarHBondContact O-N 2.95Å
318	D	87.9	Confident	85.9	Confident	78 Å²	78	67.7 Å²	67.7	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-58.4	-43.4	178.8	-68.2	-15.8	0	0	0	111.3	K287 Q314 V315 A321 H322	K287-D318 IonicContact NZ-OD2 3.93Å; K287-D318 PolarHBondContact NZ-OD2 3.28Å; Q314-D318 VanDerWaalsContact O-CG 3.24Å; Q314-D318 PolarHBondContact O-N 3.07Å; V315-D318 PolarHBondContact O-N 2.94Å; D318-A321 PolarHBondContact O-N 2.94Å; D318-H322 WeakPolarHBondContact O-CB 3.36Å; D318-H322 PolarHBondContact O-N 2.98Å
319	L	87.3	Confident	84.9	Confident	73 Å²	73	68.9 Å²	68.9	38%	0.382	37%	0.374	S	S	.	.	H	α-helix	trans	-64	-41	175.9	-75.3	170.2	0	0	0	112.9	R291 V315 K316 M317 H322 G323	R291-L319 HydrophobicContact CG-CD2 4.26Å; V315-L319 HydrophobicContact CG1-CD1 4.1Å; V315-L319 HydrophobicContact CG1-CG 4.43Å; V315-L319 WeakPolarHBondContact O-CB 3.41Å; V315-L319 WeakPolarHBondContact O-CG 3.29Å; V315-L319 PolarHBondContact O-N 3.38Å; K316-L319 PolarHBondContact O-N 2.88Å; M317-L319 VanDerWaalsContact C-N 3.33Å; M317-L319 PolarHBondContact O-N 3.44Å; L319-H322 PolarHBondContact O-N 2.99Å; L319-G323 PolarHBondContact O-N 3.14Å
320	S	87.5	Confident	84.1	Confident	81 Å²	81	71.1 Å²	71.1	57%	0.566	39%	0.385	S	S	*	.	H	α-helix	trans	-65.9	-41.4	178.3	71	0	0	0	0	112.3	K316 M317 H322 G323 F324	K316-S320 PolarHBondContact O-N 3.08Å; M317-S320 PolarHBondContact O-N 3.47Å; M317-S320 VanDerWaalsContact O-N 3.14Å; M317-S320 PolarHBondContact O-OG 3.34Å; S320-H322 VanDerWaalsContact C-N 3.35Å; S320-G323 PolarHBondContact O-N 3.36Å; S320-F324 PolarHBondContact O-N 3.44Å
321	A	85.4	Confident	83	Confident	48 Å²	48	74.7 Å²	74.7	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-41.9	174.6	0	0	0	0	0	111.1	M317 D318 G323 F324 I325	M317-A321 PolarHBondContact O-N 2.95Å; D318-A321 PolarHBondContact O-N 2.94Å; A321-G323 PolarHBondContact O-N 2.97Å; A321-F324 PolarHBondContact O-N 3.41Å; A321-I325 VanDerWaalsContact O-CG1 3.31Å; A321-I325 WeakPolarHBondContact O-CG1 3.49Å; A321-I325 PolarHBondContact O-N 3.48Å
322	H	84.3	Confident	81.8	Confident	98 Å²	98	75.8 Å²	75.8	45%	0.454	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-42.8	176.1	-153.2	71.8	0	0	0	111.9	D318 L319 S320 I325 Q326	D318-H322 WeakPolarHBondContact O-CB 3.36Å; D318-H322 PolarHBondContact O-N 2.98Å; L319-H322 PolarHBondContact O-N 2.99Å; S320-H322 VanDerWaalsContact C-N 3.35Å; H322-I325 PolarHBondContact O-N 3.26Å; H322-Q326 WeakPolarHBondContact O-CB 3.48Å; H322-Q326 PolarHBondContact O-N 3.09Å
323	G	84.3	Confident	80.3	Confident	32 Å²	32	80 Å²	80	33%	0.33	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-42	174.6	0	0	0	0	0	113.1	L319 S320 A321 Q326 N327	L319-G323 PolarHBondContact O-N 3.14Å; S320-G323 PolarHBondContact O-N 3.36Å; A321-G323 PolarHBondContact O-N 2.97Å; G323-Q326 PolarHBondContact O-N 3.42Å; G323-N327 WeakPolarHBondContact O-CB 3.28Å; G323-N327 VanDerWaalsContact O-CG 3.23Å; G323-N327 PolarHBondContact O-N 3.34Å; G323-N327 PolarHBondContact O-ND2 3.39Å
324	F	84.2	Confident	78.9	Confident	127 Å²	127	78.8 Å²	78.8	56%	0.557	43%	0.428	S	S	*	.	H	α-helix	trans	-61.3	-47.4	174.8	176.4	-96	0	0	0	112.2	S320 A321 Q326 N327 Q328	S320-F324 PolarHBondContact O-N 3.44Å; A321-F324 PolarHBondContact O-N 3.41Å; F324-Q326 VanDerWaalsContact C-N 3.34Å; F324-Q326 PolarHBondContact O-N 3.47Å; F324-N327 PolarHBondContact O-N 2.96Å; F324-Q328 HydrophobicContact CE1-CG 4.21Å; F324-Q328 HydrophobicContact CZ-CG 4.26Å; F324-Q328 PolarHBondContact O-N 2.97Å
325	I	79.8	Confident	77.5	Confident	90 Å²	90	77.1 Å²	77.1	46%	0.462	43%	0.426	S	S	.	.	H	α-helix	trans	-61.1	-45.3	177.2	-68.5	167	0	0	0	110.2	A321 H322 N327 Q328 I329	A321-I325 VanDerWaalsContact O-CG1 3.31Å; A321-I325 WeakPolarHBondContact O-CG1 3.49Å; A321-I325 PolarHBondContact O-N 3.48Å; H322-I325 PolarHBondContact O-N 3.26Å; I325-N327 VanDerWaalsContact C-N 3.34Å; I325-N327 PolarHBondContact O-N 2.85Å; I325-Q328 PolarHBondContact O-N 3.5Å; I325-I329 HydrophobicContact CG2-CD1 3.71Å; I325-I329 HydrophobicContact CG2-CG1 4.3Å; I325-I329 VanDerWaalsContact O-CG1 3.32Å; I325-I329 WeakPolarHBondContact O-CG1 3.2Å; I325-I329 PolarHBondContact O-N 3.4Å
326	Q	78.8	Confident	76.2	Confident	94 Å²	94	78.4 Å²	78.4	44%	0.439	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-43.2	179.4	-164.8	68.6	5.2	0	0	111.6	H322 G323 F324 Q328 I329 T330	H322-Q326 WeakPolarHBondContact O-CB 3.48Å; H322-Q326 PolarHBondContact O-N 3.09Å; G323-Q326 PolarHBondContact O-N 3.42Å; F324-Q326 VanDerWaalsContact C-N 3.34Å; F324-Q326 PolarHBondContact O-N 3.47Å; Q326-Q328 VanDerWaalsContact C-N 3.34Å; Q326-Q328 PolarHBondContact O-N 3.03Å; Q326-I329 WeakPolarHBondContact O-CB 3.32Å; Q326-I329 PolarHBondContact O-N 3.39Å; Q326-T330 PolarHBondContact O-N 2.88Å; Q326-T330 PolarHBondContact O-OG1 2.87Å
327	N	78.5	Confident	74.8	Confident	118 Å²	118	79.6 Å²	79.6	63%	0.631	44%	0.442	S	S	*	.	H	α-helix	trans	-62	-40.6	175.7	-71.5	-17.5	0	0	0	112.1	G323 F324 I325 T330 F331	G323-N327 WeakPolarHBondContact O-CB 3.28Å; G323-N327 VanDerWaalsContact O-CG 3.23Å; G323-N327 PolarHBondContact O-N 3.34Å; G323-N327 PolarHBondContact O-ND2 3.39Å; F324-N327 PolarHBondContact O-N 2.96Å; I325-N327 VanDerWaalsContact C-N 3.34Å; I325-N327 PolarHBondContact O-N 2.85Å; N327-T330 PolarHBondContact O-N 3.18Å; N327-F331 WeakPolarHBondContact O-CB 3.35Å; N327-F331 PolarHBondContact O-N 3.44Å
328	Q	70.8	Confident	73.5	Confident	104 Å²	104	83.7 Å²	83.7	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-64.8	-41.3	173.3	-73.8	-150	-5.9	0	0	112.3	F324 I325 Q326 F331 L332	F324-Q328 HydrophobicContact CE1-CG 4.21Å; F324-Q328 HydrophobicContact CZ-CG 4.26Å; F324-Q328 PolarHBondContact O-N 2.97Å; I325-Q328 PolarHBondContact O-N 3.5Å; Q326-Q328 VanDerWaalsContact C-N 3.34Å; Q326-Q328 PolarHBondContact O-N 3.03Å; Q328-F331 PolarHBondContact O-N 2.88Å; Q328-L332 WeakPolarHBondContact O-CB 3.33Å; Q328-L332 VanDerWaalsContact O-CG 3.27Å; Q328-L332 WeakPolarHBondContact O-CG 3.37Å; Q328-L332 PolarHBondContact O-N 3.49Å
329	I	69.2	Low	72.2	Confident	55 Å²	55	81.6 Å²	81.6	28%	0.282	45%	0.449	S	S	.	.	H	α-helix	trans	-59.9	-46.9	175.4	-70.9	168.5	0	0	0	110.1	I325 Q326 F331 L332 Q333 I340	I325-I329 HydrophobicContact CG2-CD1 3.71Å; I325-I329 HydrophobicContact CG2-CG1 4.3Å; I325-I329 VanDerWaalsContact O-CG1 3.32Å; I325-I329 WeakPolarHBondContact O-CG1 3.2Å; I325-I329 PolarHBondContact O-N 3.4Å; Q326-I329 WeakPolarHBondContact O-CB 3.32Å; Q326-I329 PolarHBondContact O-N 3.39Å; I329-F331 PolarHBondContact O-N 3Å; I329-L332 PolarHBondContact O-N 3.47Å; I329-Q333 HydrophobicContact CG2-CG 4.22Å; I329-Q333 WeakPolarHBondContact O-CB 3.46Å; I329-Q333 VanDerWaalsContact O-CG 3.23Å; I329-Q333 WeakPolarHBondContact O-CG 3.46Å; I329-Q333 PolarHBondContact O-N 3.33Å; I329-I340 HydrophobicContact CG2-CD1 4.22Å
330	T	70.1	Confident	71.1	Confident	78 Å²	78	80.7 Å²	80.7	48%	0.479	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-42.6	178	-54.8	0	0	0	0	111.8	Q326 N327 Q333 G334	Q326-T330 PolarHBondContact O-N 2.88Å; Q326-T330 PolarHBondContact O-OG1 2.87Å; N327-T330 PolarHBondContact O-N 3.18Å; T330-Q333 PolarHBondContact O-N 2.84Å; T330-G334 PolarHBondContact O-N 3.43Å
331	F	66.5	Low	69.9	Low	137 Å²	137	80.3 Å²	80.3	60%	0.601	44%	0.435	S	S	*	.	H	α-helix	trans	-61.3	-44.9	175	178.6	-85	0	0	0	111.7	N327 Q328 I329 G334 T402	N327-F331 WeakPolarHBondContact O-CB 3.35Å; N327-F331 PolarHBondContact O-N 3.44Å; Q328-F331 PolarHBondContact O-N 2.88Å; I329-F331 PolarHBondContact O-N 3Å; F331-G334 PolarHBondContact O-N 2.97Å; F331-T402 HydrophobicContact CD1-CG2 4.27Å; F331-T402 HydrophobicContact CE1-CG2 3.33Å; F331-T402 HydrophobicContact CZ-CG2 4.01Å
332	L	62.7	Low	68.8	Low	33 Å²	33	84.1 Å²	84.1	17%	0.173	46%	0.456	C	S	.	.	H	α-helix	trans	-65.7	-42.5	178.2	-72.9	172.9	0	0	0	111.5	Q328 I329 G334 S335 Y336 I340 C400	Q328-L332 WeakPolarHBondContact O-CB 3.33Å; Q328-L332 VanDerWaalsContact O-CG 3.27Å; Q328-L332 WeakPolarHBondContact O-CG 3.37Å; Q328-L332 PolarHBondContact O-N 3.49Å; I329-L332 PolarHBondContact O-N 3.47Å; L332-G334 PolarHBondContact O-N 3Å; L332-G334 VanDerWaalsContact O-N 3.15Å; L332-S335 WeakPolarHBondContact O-CB 3.14Å; L332-S335 PolarHBondContact O-N 2.73Å; L332-Y336 HydrophobicContact CB-CE2 4.38Å; L332-Y336 WeakPolarHBondContact O-CD2 3.43Å; L332-I340 HydrophobicContact CB-CD1 3.53Å; L332-I340 HydrophobicContact CB-CG1 4.5Å; L332-I340 HydrophobicContact CD1-CD1 4.27Å; L332-C400 WeakPolarHBondContact CD2-O 3.07Å
333	Q	61.2	Low	67.9	Low	87 Å²	87	83 Å²	83	41%	0.407	45%	0.454	S	S	.	.	H	α-helix	trans	-53.6	-34.2	179.1	-81	173.1	-10.8	0	0	113.1	I329 T330 S335 Y336 I340	I329-Q333 HydrophobicContact CG2-CG 4.22Å; I329-Q333 WeakPolarHBondContact O-CB 3.46Å; I329-Q333 VanDerWaalsContact O-CG 3.23Å; I329-Q333 WeakPolarHBondContact O-CG 3.46Å; I329-Q333 PolarHBondContact O-N 3.33Å; T330-Q333 PolarHBondContact O-N 2.84Å; Q333-S335 PolarHBondContact O-N 2.86Å; Q333-S335 VanDerWaalsContact O-N 3.1Å; Q333-Y336 PolarHBondContact O-N 2.87Å; Q333-Y336 VanDerWaalsContact O-O 3.09Å; Q333-I340 HydrophobicContact CG-CD1 4.15Å; Q333-I340 HydrophobicContact CG-CG1 4.17Å
334	G	58.7	Low	67.2	Low	73 Å²	73	88.4 Å²	88.4	75%	0.753	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.4	176.3	0	0	0	0	0	114.9	T330 F331 L332	T330-G334 PolarHBondContact O-N 3.43Å; F331-G334 PolarHBondContact O-N 2.97Å; L332-G334 PolarHBondContact O-N 3Å; L332-G334 VanDerWaalsContact O-N 3.15Å
335	S	61.8	Low	67.1	Low	49 Å²	49	84.1 Å²	84.1	34%	0.343	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-11.2	176.1	-60.1	0	0	0	0	114.1	L332 Q333	L332-S335 WeakPolarHBondContact O-CB 3.14Å; L332-S335 PolarHBondContact O-N 2.73Å; Q333-S335 PolarHBondContact O-N 2.86Å; Q333-S335 VanDerWaalsContact O-N 3.1Å
336	Y	63.3	Low	67.2	Low	30 Å²	30	83.4 Å²	83.4	12%	0.118	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-103.5	141.3	179.9	-66.3	-89.9	0	0	0	110.1	L332 Q333 G339 I340 F399 C400 K649	L332-Y336 HydrophobicContact CB-CE2 4.38Å; L332-Y336 WeakPolarHBondContact O-CD2 3.43Å; Q333-Y336 PolarHBondContact O-N 2.87Å; Q333-Y336 VanDerWaalsContact O-O 3.09Å; Y336-G339 WeakPolarHBondContact CB-O 3.44Å; Y336-I340 HydrophobicContact CD2-CG1 3.82Å; Y336-I340 HydrophobicContact CE2-CG1 4.06Å; Y336-I340 HydrophobicContact CG-CG1 4.4Å; Y336-F399 PolarHBondContact OH-O 3.4Å; Y336-C400 VanDerWaalsContact OH-C 3.29Å; Y336-C400 WeakPolarHBondContact OH-CA 3.28Å; Y336-C400 PolarHBondContact OH-O 2.95Å; Y336-K649 HydrophobicContact CD1-CB 4.34Å; Y336-K649 HydrophobicContact CE1-CB 4.26Å; Y336-K649 HydrophobicContact CE1-CD 3.89Å; Y336-K649 HydrophobicContact CE1-CG 4.35Å; Y336-K649 PolarHBondContact OH-NZ 3.03Å
337	T	60.1	Low	67.6	Low	78 Å²	78	85.7 Å²	85.7	48%	0.479	46%	0.459	S	S	.	.	S	Bend	trans	-76.9	-25.2	-178.2	54.1	0	0	0	0	113.2	C647 M648 V650	T337-C647 PolarHBondContact OG1-O 2.88Å; T337-M648 PolarHBondContact N-O 3.19Å; T337-M648 PolarHBondContact OG1-O 3.45Å; T337-V650 HydrophobicContact CG2-CG2 4.27Å
338	R	61	Low	67.9	Low	194 Å²	194	81.5 Å²	81.5	73%	0.732	44%	0.437	S	S	*	.	S	Bend	trans	-134.8	17.2	-175	-72.3	-170	174.7	168	3.8	114.2	N646	R338-N646 PolarHBondContact NH1-ND2 3.1Å; R338-N646 VanDerWaalsContact NH1-ND2 3.15Å; R338-N646 PolarHBondContact NH1-OD1 3.34Å
339	G	61.3	Low	68.6	Low	34 Å²	34	79.4 Å²	79.4	35%	0.351	43%	0.434	S	S	.	.			trans	89.9	178.4	-175	0	0	0	0	0	113.8	Y336	Y336-G339 WeakPolarHBondContact CB-O 3.44Å
340	I	63.1	Low	69.5	Low	54 Å²	54	76.8 Å²	76.8	28%	0.277	42%	0.42	S	S	.	.			trans	-92.4	124.7	-176.3	-56.6	171.1	0	0	0	108.2	I329 L332 Q333 Y336 P342	I329-I340 HydrophobicContact CG2-CD1 4.22Å; L332-I340 HydrophobicContact CB-CD1 3.53Å; L332-I340 HydrophobicContact CB-CG1 4.5Å; L332-I340 HydrophobicContact CD1-CD1 4.27Å; Q333-I340 HydrophobicContact CG-CD1 4.15Å; Q333-I340 HydrophobicContact CG-CG1 4.17Å; Y336-I340 HydrophobicContact CD2-CG1 3.82Å; Y336-I340 HydrophobicContact CE2-CG1 4.06Å; Y336-I340 HydrophobicContact CG-CG1 4.4Å; I340-P342 WeakPolarHBondContact O-CD 3.27Å
341	D	62.7	Low	70.2	Confident	73 Å²	73	73.7 Å²	73.7	39%	0.39	40%	0.401	S	S	.	.			trans	-73.3	120.1	169.6	-170	-20.2	0	0	0	108.9	N343	D341-N343 PolarHBondContact O-N 3.12Å; D341-N343 PolarHBondContact OD1-N 3.25Å
342	P	62.3	Low	71.1	Confident	128 Å²	128	67.2 Å²	67.2	83%	0.831	37%	0.373	S	S	*	.	S	Bend	trans	-66.9	-19.3	179.7	27.9	-35.3	0	0	0	112.7	I340 Y344	I340-P342 WeakPolarHBondContact O-CD 3.27Å; P342-Y344 PolarHBondContact O-N 2.95Å
343	N	64.9	Low	72.1	Confident	76 Å²	76	66 Å²	66	41%	0.406	37%	0.367	S	S	.	.			trans	-82.7	108.4	178.7	-163.8	1.6	0	0	0	110.7	D341 A345 N397	D341-N343 PolarHBondContact O-N 3.12Å; D341-N343 PolarHBondContact OD1-N 3.25Å; N343-A345 PolarHBondContact OD1-O 2.89Å; N343-N397 PolarHBondContact O-ND2 2.82Å
344	Y	70.6	Confident	73.1	Confident	145 Å²	145	66.8 Å²	66.8	57%	0.569	37%	0.369	S	S	*	.			trans	-69.9	-42.3	-179.1	177.4	-102.4	0	0	0	112.7	P342 R396 N397	P342-Y344 PolarHBondContact O-N 2.95Å; Y344-R396 CarbonylContact O-C 3.52Å; Y344-R396 WeakPolarHBondContact O-CA 3.48Å; Y344-N397 HydrophobicContact CD2-CB 4.44Å; Y344-N397 PolarHBondContact O-N 2.9Å
345	A	80.9	Confident	73.6	Confident	37 Å²	37	68.9 Å²	68.9	31%	0.306	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	139.3	-176.5	0	0	0	0	0	110.9	N343 E395 R396	N343-A345 PolarHBondContact OD1-O 2.89Å; A345-E395 CarbonylContact C-O 3.52Å; A345-E395 WeakPolarHBondContact CA-O 3.39Å; A345-R396 HydrophobicContact CB-CG 3.86Å
346	N	83.4	Confident	73.5	Confident	75 Å²	75	71.8 Å²	71.8	40%	0.401	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	154	177.2	-161.8	10.9	0	0	0	110.7	V348 E395	N346-V348 HydrophobicContact CB-CG2 4.37Å; N346-E395 HydrophobicContact CB-CB 4.41Å; N346-E395 PolarHBondContact N-O 2.99Å; N346-E395 PolarHBondContact O-N 3Å
347	K	85.6	Confident	72.8	Confident	142 Å²	142	78.3 Å²	78.3	62%	0.617	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	116.4	170.4	-77.7	171.7	168.5	-169.3	0	107.8	L392	K347-L392 HydrophobicContact CB-CD1 4.26Å; K347-L392 HydrophobicContact CB-CD2 4.02Å; K347-L392 HydrophobicContact CB-CG 4.22Å; K347-L392 HydrophobicContact CD-CD2 3.92Å; K347-L392 HydrophobicContact CG-CD2 4.05Å
348	V	85.4	Confident	71.9	Confident	30 Å²	30	80.6 Å²	80.6	18%	0.182	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	133.9	-173.7	-174.2	0	0	0	0	109.3	N346 I350 M393 E395 F643	N346-V348 HydrophobicContact CB-CG2 4.37Å; V348-I350 HydrophobicContact CG1-CG1 4.47Å; V348-M393 PolarHBondContact N-O 2.7Å; V348-M393 PolarHBondContact O-N 3.34Å; V348-E395 HydrophobicContact CG2-CB 4.08Å; V348-F643 HydrophobicContact CB-CE2 4.39Å; V348-F643 HydrophobicContact CB-CZ 4.02Å; V348-F643 HydrophobicContact CG1-CE1 4.28Å; V348-F643 HydrophobicContact CG1-CE2 4.17Å; V348-F643 HydrophobicContact CG1-CZ 3.64Å; V348-F643 HydrophobicContact CG2-CE2 4.35Å; V348-F643 HydrophobicContact CG2-CZ 4.47Å
349	S	86.6	Confident	71.1	Confident	59 Å²	59	74.6 Å²	74.6	41%	0.413	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	119.8	173.6	-167.6	0	0	0	0	109.8	Q390	S349-Q390 WeakPolarHBondContact OG-CB 3.5Å; S349-Q390 PolarHBondContact OG-OE1 2.91Å
350	I	86.2	Confident	70	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.005	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.6	-177.3	-55.1	-168.8	0	0	0	109.9	V348 V352 L379 W380 V391 M393 L626 F643	V348-I350 HydrophobicContact CG1-CG1 4.47Å; I350-V352 PolarHBondContact O-N 2.89Å; I350-L379 HydrophobicContact CG2-CD2 3.83Å; I350-W380 HydrophobicContact CG2-CH2 4.19Å; I350-W380 HydrophobicContact CG2-CZ3 4.15Å; I350-V391 PolarHBondContact N-O 2.95Å; I350-V391 PolarHBondContact O-N 3.29Å; I350-M393 HydrophobicContact CB-CE 4.31Å; I350-M393 HydrophobicContact CB-CG 4.43Å; I350-M393 HydrophobicContact CB-SD 4.43Å; I350-M393 HydrophobicContact CD1-CB 3.75Å; I350-M393 HydrophobicContact CD1-CG 3.94Å; I350-M393 HydrophobicContact CD1-SD 3.69Å; I350-M393 HydrophobicContact CG1-CB 4.16Å; I350-M393 HydrophobicContact CG1-CG 4.23Å; I350-M393 HydrophobicContact CG1-SD 4.41Å; I350-M393 HydrophobicContact CG2-CE 4.48Å; I350-L626 HydrophobicContact CD1-CD1 3.63Å; I350-L626 HydrophobicContact CD1-CD2 3.52Å; I350-L626 HydrophobicContact CD1-CG 4.21Å; I350-F643 HydrophobicContact CD1-CE1 3.48Å; I350-F643 VanDerWaalsContact CD1-CE1 3.48Å; I350-F643 HydrophobicContact CD1-CZ 3.47Å; I350-F643 VanDerWaalsContact CD1-CZ 3.47Å; I350-F643 HydrophobicContact CG1-CE1 3.77Å; I350-F643 HydrophobicContact CG1-CZ 3.89Å
351	P	85.3	Confident	68.8	Low	12 Å²	12	83.6 Å²	83.6	8%	0.078	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	127.7	166.3	24.7	-37.2	0	0	0	111.2	W380 Y383 T388 Q389	P351-W380 HydrophobicContact CG-CD2 4.18Å; P351-W380 HydrophobicContact CG-CE3 3.24Å; P351-W380 HydrophobicContact CG-CH2 3.9Å; P351-W380 HydrophobicContact CG-CZ3 3.1Å; P351-Y383 HydrophobicContact CG-CD2 4.49Å; P351-Y383 VanDerWaalsContact O-CE2 3.26Å; P351-Y383 WeakPolarHBondContact O-CE2 3.47Å; P351-T388 HydrophobicContact CB-CG2 3.96Å; P351-Q389 CarbonylContact C-O 3.59Å; P351-Q389 WeakPolarHBondContact CA-O 3.4Å
352	V	85.7	Confident	67.2	Low	2 Å²	2	88.2 Å²	88.2	1%	0.012	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.2	173	176.8	0	0	0	0	107.6	I350 K354 T388 Q389 V391 M393 W585 V602	I350-V352 PolarHBondContact O-N 2.89Å; V352-K354 PolarHBondContact O-N 3.46Å; V352-T388 CarbonylContact O-C 3.57Å; V352-T388 WeakPolarHBondContact O-CA 3.4Å; V352-T388 WeakPolarHBondContact O-CB 3.48Å; V352-Q389 HydrophobicContact CB-CG 4.48Å; V352-Q389 PolarHBondContact N-O 3.48Å; V352-Q389 PolarHBondContact O-N 3.15Å; V352-V391 HydrophobicContact CB-CG2 4.11Å; V352-V391 HydrophobicContact CG2-CB 4.13Å; V352-V391 HydrophobicContact CG2-CG2 3.85Å; V352-M393 HydrophobicContact CG2-CE 3.79Å; V352-W585 HydrophobicContact CB-CE3 4.36Å; V352-W585 HydrophobicContact CG1-CE3 3.52Å; V352-W585 HydrophobicContact CG1-CZ3 3.74Å; V352-W585 HydrophobicContact CG2-CD2 4.46Å; V352-W585 HydrophobicContact CG2-CE3 4.14Å; V352-V602 HydrophobicContact CG1-CB 4.13Å; V352-V602 HydrophobicContact CG1-CG1 4.43Å; V352-V602 HydrophobicContact CG1-CG2 3.51Å
353	P	84.9	Confident	65.7	Low	7 Å²	7	93.5 Å²	93.5	5%	0.045	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	138	176.4	-26.6	35.8	0	0	0	111.9	Y383 V602 Y605	P353-Y383 VanDerWaalsContact CD-CE1 3.43Å; P353-Y383 HydrophobicContact CG-CD1 3.78Å; P353-Y383 HydrophobicContact CG-CE1 3.26Å; P353-V602 HydrophobicContact CB-CG1 4.35Å; P353-V602 VanDerWaalsContact O-CG1 3.31Å; P353-V602 WeakPolarHBondContact O-CG1 3.26Å; P353-Y605 HydrophobicContact CG-CG 4.38Å
354	K	80.8	Confident	64.3	Low	103 Å²	103	94.1 Å²	94.1	45%	0.448	49%	0.491	S	S	.	.			trans	-71.6	137.4	169.5	-70.9	-177.6	-178	176	0	109.4	V352 V356 E387 T388 Q389	V352-K354 PolarHBondContact O-N 3.46Å; K354-V356 PolarHBondContact O-N 3.38Å; K354-E387 PolarHBondContact N-O 3.41Å; K354-T388 WeakPolarHBondContact CE-O 3.19Å; K354-Q389 HydrophobicContact CG-CB 3.89Å; K354-Q389 HydrophobicContact CG-CG 4.21Å
355	M	70.4	Confident	62.4	Low	118 Å²	118	96.7 Å²	96.7	58%	0.581	51%	0.505	S	S	*	.			trans	-75.8	114.7	166.6	-66.5	-160.7	-177.3	0	0	107.4	V602	M355-V602 HydrophobicContact CE-CB 4.41Å; M355-V602 HydrophobicContact CE-CG1 3.74Å; M355-V602 HydrophobicContact CG-CG1 3.63Å
356	V	60.1	Low	60.6	Low	109 Å²	109	98.5 Å²	98.5	66%	0.661	51%	0.507	S	S	*	.			trans	-84.6	125.2	167.6	-173.8	0	0	0	0	106.6	K354 D358	K354-V356 PolarHBondContact O-N 3.38Å; V356-D358 PolarHBondContact O-N 2.97Å; V356-D358 VanDerWaalsContact O-N 3.08Å
357	D	47.8	Very low	58.2	Low	168 Å²	168	99.4 Å²	99.4	90%	0.898	52%	0.517	S	S	*	.	S	Bend	trans	-63.2	-12.2	-176.2	-82.1	-32.1	0	0	0	113.9
358	D	40.4	Very low	55.8	Low	125 Å²	125	102.3 Å²	102.3	67%	0.668	53%	0.529	S	S	*	.	S	Bend	trans	-95.7	124.4	-179.8	-80.7	-30.1	0	0	0	112.9	V356 K360	V356-D358 PolarHBondContact O-N 2.97Å; V356-D358 VanDerWaalsContact O-N 3.08Å; D358-K360 PolarHBondContact O-N 2.85Å
359	G	45	Very low	53.6	Low	69 Å²	69	110.2 Å²	110.2	71%	0.711	56%	0.556	S	S	*	*	S	Bend	trans	-60.1	21.9	172.2	0	0	0	0	0	116.2
360	K	37.4	Very low	51.2	Low	191 Å²	191	116.1 Å²	116.1	83%	0.83	57%	0.574	S	S	*	*			trans	-125.5	71.2	171.8	-67.2	-179.4	-177.7	173.3	0	110.3	D358 M362	D358-K360 PolarHBondContact O-N 2.85Å; K360-M362 PolarHBondContact O-N 2.87Å
361	S	38.1	Very low	49	Very low	85 Å²	85	122.4 Å²	122.4	59%	0.594	61%	0.607	S	S	*	*			trans	-67.4	122.9	150.3	69.9	0	0	0	0	106.7	R363	S361-R363 PolarHBondContact O-N 2.96Å; S361-R363 VanDerWaalsContact O-N 3.11Å
362	M	28.6	Very low	46.8	Very low	171 Å²	171	132.1 Å²	132.1	84%	0.842	64%	0.642	S	S	*	*			trans	-42.2	121.7	171.7	-80.6	-87.6	-84.7	0	0	109.3	K360 V364	K360-M362 PolarHBondContact O-N 2.87Å; M362-V364 PolarHBondContact O-N 3.41Å
363	R	32.1	Very low	44.6	Very low	239 Å²	239	137.9 Å²	137.9	90%	0.902	68%	0.678	S	S	*	*			trans	-65.9	81	165.3	-83.1	-170.2	-173.2	-175.5	3.6	107.3	S361 K365	S361-R363 PolarHBondContact O-N 2.96Å; S361-R363 VanDerWaalsContact O-N 3.11Å; R363-K365 VanDerWaalsContact C-N 3.31Å; R363-K365 PolarHBondContact O-N 2.87Å; R363-K365 VanDerWaalsContact O-N 3.07Å
364	V	34.9	Very low	42.7	Very low	89 Å²	89	145.7 Å²	145.7	54%	0.539	71%	0.711	S	S	.	*			trans	-68.4	105.6	152.6	-175.8	0	0	0	0	103.8	M362 H366	M362-V364 PolarHBondContact O-N 3.41Å; V364-H366 PolarHBondContact O-N 3.05Å
365	K	31	Very low	40.8	Very low	198 Å²	198	147.9 Å²	147.9	86%	0.861	73%	0.727	S	S	*	*			trans	-57.4	91.7	166.3	-76.8	-179.9	178.7	174.8	0	105.9	R363	R363-K365 VanDerWaalsContact C-N 3.31Å; R363-K365 PolarHBondContact O-N 2.87Å; R363-K365 VanDerWaalsContact O-N 3.07Å
366	H	43.3	Very low	39.7	Very low	75 Å²	75	148.5 Å²	148.5	35%	0.347	73%	0.729	S	S	.	*			trans	-65.6	130.3	173	-66	-49	0	0	0	106.7	V364 K368 R607	V364-H366 PolarHBondContact O-N 3.05Å; H366-K368 PolarHBondContact O-N 3.24Å; H366-R607 PolarHBondContact CE1-NH2 2.61Å; H366-R607 PolarHBondContact ND1-NH2 3.11Å; H366-R607 PolarHBondContact NE2-NH2 3.01Å
367	P	32.4	Very low	39.7	Very low	94 Å²	94	147 Å²	147	61%	0.61	71%	0.712	S	S	*	*			trans	-53.9	144.4	173.6	22.4	-30.6	0	0	0	107.6	W369	P367-W369 VanDerWaalsContact C-N 3.35Å; P367-W369 VanDerWaalsContact O-CD1 3.3Å; P367-W369 PolarHBondContact O-N 2.82Å
368	K	36.1	Very low	40.6	Very low	203 Å²	203	142.8 Å²	142.8	88%	0.883	69%	0.689	S	S	*	*			trans	-52.7	104.1	170.5	-73.7	178.7	176.7	177.3	0	107.3	H366 K370	H366-K368 PolarHBondContact O-N 3.24Å; K368-K370 PolarHBondContact O-N 2.6Å
369	W	37.8	Very low	42.3	Very low	197 Å²	197	137 Å²	137	75%	0.746	66%	0.658	S	S	*	*			trans	-67.5	105.5	179.3	-94.3	45.5	0	0	0	107	P367	P367-W369 VanDerWaalsContact C-N 3.35Å; P367-W369 VanDerWaalsContact O-CD1 3.3Å; P367-W369 PolarHBondContact O-N 2.82Å
370	K	37.5	Very low	43.9	Very low	182 Å²	182	139.6 Å²	139.6	79%	0.791	65%	0.647	S	S	*	*			trans	-85.4	130.6	166.9	-77.2	-172.8	175.4	-176.3	0	107.7	K368 R372	K368-K370 PolarHBondContact O-N 2.6Å; K370-R372 PolarHBondContact O-N 3.29Å
371	L	40	Very low	45.7	Very low	134 Å²	134	133.5 Å²	133.5	70%	0.702	63%	0.625	S	S	*	*			trans	-44.1	106.2	175.8	-162.1	85.9	0	0	0	110.8	Y377	L371-Y377 WeakPolarHBondContact CD1-OH 3.35Å
372	R	38.1	Very low	47.7	Very low	216 Å²	216	130 Å²	130	82%	0.815	60%	0.602	S	S	*	*			trans	-128.4	112.1	169.4	-75.4	-168	174.4	-170.3	-0.9	108.3	K370	K370-R372 PolarHBondContact O-N 3.29Å
373	T	40.5	Very low	50.1	Low	123 Å²	123	122.3 Å²	122.3	76%	0.755	56%	0.564	S	S	*	*			trans	77.8	147.5	166	15.5	0	0	0	0	119.5	N375	T373-N375 PolarHBondContact O-N 3.05Å
374	K	44.2	Very low	51.9	Low	170 Å²	170	118 Å²	118	74%	0.739	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-5.1	-153.7	-106.3	172	175.1	174.1	0	116.2
375	N	41	Very low	53.7	Low	149 Å²	149	119.7 Å²	119.7	80%	0.797	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	11.1	-159.2	-84.2	6.9	0	0	0	116.7	T373	T373-N375 PolarHBondContact O-N 3.05Å
376	E	46.7	Very low	55.9	Low	132 Å²	132	114.3 Å²	114.3	62%	0.617	54%	0.537	S	S	*	.			trans	-113.1	20.1	-170.7	-68.3	-176.2	178.1	0	0	115.6	N378 T381	E376-N378 PolarHBondContact O-N 2.96Å; E376-T381 PolarHBondContact O-OG1 2.64Å
377	Y	59.9	Low	57.6	Low	78 Å²	78	117.3 Å²	117.3	31%	0.306	55%	0.552	S	S	.	*			trans	-87.1	90.9	167.3	-61.4	-71.4	0	0	0	108.1	L371 M610 A611	L371-Y377 WeakPolarHBondContact CD1-OH 3.35Å; Y377-M610 VanDerWaalsContact C-SD 3.53Å; Y377-A611 HydrophobicContact CD1-CB 4.38Å; Y377-A611 HydrophobicContact CD2-CB 4.07Å; Y377-A611 HydrophobicContact CE1-CB 4.39Å; Y377-A611 HydrophobicContact CE2-CB 4.07Å; Y377-A611 HydrophobicContact CG-CB 4.23Å
378	N	67.8	Low	60.2	Low	78 Å²	78	115.1 Å²	115.1	42%	0.417	54%	0.536	S	S	.	.			trans	-122.7	136.8	166.8	-82.3	-29.2	0	0	0	107.1	E376 W380 T381 A382	E376-N378 PolarHBondContact O-N 2.96Å; N378-W380 PolarHBondContact O-N 2.87Å; N378-T381 HydrophobicContact CB-CG2 4.03Å; N378-T381 PolarHBondContact N-OG1 3.16Å; N378-T381 PolarHBondContact O-N 3.41Å; N378-T381 PolarHBondContact O-OG1 3.46Å; N378-A382 PolarHBondContact O-N 2.79Å; N378-A382 VanDerWaalsContact O-N 3.13Å
379	L	75.9	Confident	62.6	Low	3 Å²	3	109.3 Å²	109.3	2%	0.016	51%	0.512	C	S	.	.	H	α-helix	trans	-56.4	-33	-177.3	-173.4	60.5	0	0	0	111.3	I350 Y383 L609 M610 F642 F643	I350-L379 HydrophobicContact CG2-CD2 3.83Å; L379-Y383 HydrophobicContact CD1-CD2 4.46Å; L379-Y383 HydrophobicContact CD1-CE2 3.79Å; L379-Y383 HydrophobicContact CG-CE2 4.25Å; L379-Y383 VanDerWaalsContact O-CD2 3.28Å; L379-Y383 WeakPolarHBondContact O-CD2 3.21Å; L379-L609 HydrophobicContact CD1-CB 3.87Å; L379-L609 HydrophobicContact CD1-CD1 3.95Å; L379-L609 HydrophobicContact CD1-CD2 4.16Å; L379-L609 HydrophobicContact CD1-CG 4.21Å; L379-M610 HydrophobicContact CB-CE 3.97Å; L379-F642 HydrophobicContact CD1-CE1 3.88Å; L379-F642 HydrophobicContact CD1-CZ 4.43Å; L379-F642 HydrophobicContact CD2-CD1 4.08Å; L379-F642 HydrophobicContact CD2-CE1 3.71Å; L379-F642 HydrophobicContact CG-CE1 4.42Å; L379-F643 HydrophobicContact CD2-CD1 3.85Å; L379-F643 HydrophobicContact CD2-CE1 3.97Å
380	W	77.6	Confident	65	Low	125 Å²	125	105.4 Å²	105.4	47%	0.473	50%	0.503	S	S	.	.	H	α-helix	trans	-75.3	-34.7	179.6	-53.5	162.9	0	0	0	113.3	I350 P351 N378 A382 Y383 Q384 F643	I350-W380 HydrophobicContact CG2-CH2 4.19Å; I350-W380 HydrophobicContact CG2-CZ3 4.15Å; P351-W380 HydrophobicContact CG-CD2 4.18Å; P351-W380 HydrophobicContact CG-CE3 3.24Å; P351-W380 HydrophobicContact CG-CH2 3.9Å; P351-W380 HydrophobicContact CG-CZ3 3.1Å; N378-W380 PolarHBondContact O-N 2.87Å; W380-A382 VanDerWaalsContact C-N 3.32Å; W380-Y383 PolarHBondContact O-N 3.19Å; W380-Q384 PolarHBondContact O-N 3.49Å; W380-F643 HydrophobicContact CH2-CD1 4.16Å; W380-F643 AromaticContact CH2-CE1 3.99Å; W380-F643 HydrophobicContact CH2-CE1 3.99Å; W380-F643 HydrophobicContact CZ2-CD1 4.41Å; W380-F643 HydrophobicContact CZ2-CE1 4.47Å
381	T	76.3	Confident	67.4	Low	62 Å²	62	98 Å²	98	38%	0.38	47%	0.472	S	S	.	.	H	α-helix	trans	-72	-31.5	176.9	56.1	0	0	0	0	111.1	E376 N378 Y383 Q384	E376-T381 PolarHBondContact O-OG1 2.64Å; N378-T381 HydrophobicContact CB-CG2 4.03Å; N378-T381 PolarHBondContact N-OG1 3.16Å; N378-T381 PolarHBondContact O-N 3.41Å; N378-T381 PolarHBondContact O-OG1 3.46Å; T381-Y383 VanDerWaalsContact C-N 3.3Å; T381-Y383 PolarHBondContact O-N 3.13Å; T381-Q384 WeakPolarHBondContact O-CB 3.41Å; T381-Q384 PolarHBondContact O-N 3.02Å
382	A	79.1	Confident	69.8	Low	12 Å²	12	97 Å²	97	10%	0.099	47%	0.467	C	S	.	.	H	α-helix	trans	-58.2	-43.6	175.3	0	0	0	0	0	111.5	N378 W380 Y605 L609	N378-A382 PolarHBondContact O-N 2.79Å; N378-A382 VanDerWaalsContact O-N 3.13Å; W380-A382 VanDerWaalsContact C-N 3.32Å; A382-Y605 PolarHBondContact O-OH 3.31Å; A382-L609 HydrophobicContact CB-CD2 3.91Å
383	Y	80.5	Confident	72.2	Confident	10 Å²	10	87.7 Å²	87.7	4%	0.039	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	6.9	-176.9	-62.7	-55.1	0	0	0	115.6	P351 P353 L379 W380 T381 N385 E386 T388 Y605 L609	P351-Y383 HydrophobicContact CG-CD2 4.49Å; P351-Y383 VanDerWaalsContact O-CE2 3.26Å; P351-Y383 WeakPolarHBondContact O-CE2 3.47Å; P353-Y383 VanDerWaalsContact CD-CE1 3.43Å; P353-Y383 HydrophobicContact CG-CD1 3.78Å; P353-Y383 HydrophobicContact CG-CE1 3.26Å; L379-Y383 HydrophobicContact CD1-CD2 4.46Å; L379-Y383 HydrophobicContact CD1-CE2 3.79Å; L379-Y383 HydrophobicContact CG-CE2 4.25Å; L379-Y383 VanDerWaalsContact O-CD2 3.28Å; L379-Y383 WeakPolarHBondContact O-CD2 3.21Å; W380-Y383 PolarHBondContact O-N 3.19Å; T381-Y383 VanDerWaalsContact C-N 3.3Å; T381-Y383 PolarHBondContact O-N 3.13Å; Y383-N385 PolarHBondContact O-N 3.43Å; Y383-E386 PolarHBondContact O-N 3.47Å; Y383-T388 HydrophobicContact CD1-CG2 4.46Å; Y383-T388 HydrophobicContact CG-CG2 4.07Å; Y383-Y605 HydrophobicContact CD1-CE1 4.24Å; Y383-Y605 AromaticContact CD1-CE2 3.96Å; Y383-Y605 HydrophobicContact CD1-CE2 3.96Å; Y383-Y605 AromaticContact CD1-CZ 3.76Å; Y383-Y605 HydrophobicContact CE1-CD1 4.12Å; Y383-Y605 HydrophobicContact CE1-CD2 4.49Å; Y383-Y605 AromaticContact CE1-CE1 3.77Å; Y383-Y605 HydrophobicContact CE1-CE1 3.77Å; Y383-Y605 HydrophobicContact CE1-CE2 4.18Å; Y383-Y605 HydrophobicContact CE1-CG 4.44Å; Y383-Y605 AromaticContact CE1-CZ 3.78Å; Y383-L609 HydrophobicContact CD1-CD2 4.48Å; Y383-L609 HydrophobicContact CE1-CD2 3.66Å; Y383-L609 HydrophobicContact CE2-CD2 3.87Å; Y383-L609 WeakPolarHBondContact OH-CD1 3.21Å; Y383-L609 VanDerWaalsContact OH-CD2 3.31Å; Y383-L609 WeakPolarHBondContact OH-CD2 3.39Å
384	Q	70.3	Confident	74.4	Confident	149 Å²	149	84.8 Å²	84.8	70%	0.696	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-23.1	-170.7	-172.2	172.9	3.3	0	0	115.3	W380 T381	W380-Q384 PolarHBondContact O-N 3.49Å; T381-Q384 WeakPolarHBondContact O-CB 3.41Å; T381-Q384 PolarHBondContact O-N 3.02Å
385	N	71.5	Confident	76.3	Confident	124 Å²	124	77.8 Å²	77.8	66%	0.663	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	17.7	-177.5	-61.4	-32.8	0	0	0	113.7	Y383	Y383-N385 PolarHBondContact O-N 3.43Å
386	E	76.3	Confident	78.3	Confident	84 Å²	84	74.7 Å²	74.7	39%	0.393	36%	0.358	S	S	.	.	S	Bend	trans	-122.1	147.5	-179.8	-66	-66.7	153.8	0	0	111.2	Y383 T388 Y605	Y383-E386 PolarHBondContact O-N 3.47Å; E386-T388 PolarHBondContact O-N 2.9Å; E386-Y605 HydrophobicContact CG-CD2 3.85Å; E386-Y605 HydrophobicContact CG-CE2 3.66Å
387	E	81.1	Confident	79.8	Confident	138 Å²	138	69 Å²	69	65%	0.645	33%	0.332	S	S	*	.			trans	-70.7	122	169.2	-71.7	-169.9	-171.3	0	0	110.2	K354	K354-E387 PolarHBondContact N-O 3.41Å
388	T	86.1	Confident	80.1	Confident	48 Å²	48	66.6 Å²	66.6	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	150.1	-178.2	57.2	0	0	0	0	111.9	P351 V352 K354 Y383 E386	P351-T388 HydrophobicContact CB-CG2 3.96Å; V352-T388 CarbonylContact O-C 3.57Å; V352-T388 WeakPolarHBondContact O-CA 3.4Å; V352-T388 WeakPolarHBondContact O-CB 3.48Å; K354-T388 WeakPolarHBondContact CE-O 3.19Å; Y383-T388 HydrophobicContact CD1-CG2 4.46Å; Y383-T388 HydrophobicContact CG-CG2 4.07Å; E386-T388 PolarHBondContact O-N 2.9Å
389	Q	86.4	Confident	80	Confident	81 Å²	81	64.5 Å²	64.5	38%	0.379	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	146.2	165	61.7	178.3	11.2	0	0	109.3	P351 V352 K354 V391	P351-Q389 CarbonylContact C-O 3.59Å; P351-Q389 WeakPolarHBondContact CA-O 3.4Å; V352-Q389 HydrophobicContact CB-CG 4.48Å; V352-Q389 PolarHBondContact N-O 3.48Å; V352-Q389 PolarHBondContact O-N 3.15Å; K354-Q389 HydrophobicContact CG-CB 3.89Å; K354-Q389 HydrophobicContact CG-CG 4.21Å; Q389-V391 HydrophobicContact CG-CG2 4.26Å
390	Q	88.1	Confident	78.9	Confident	115 Å²	115	66.6 Å²	66.6	54%	0.537	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119.2	178.3	-70.8	-66.6	-21.8	0	0	109.6	S349	S349-Q390 WeakPolarHBondContact OG-CB 3.5Å; S349-Q390 PolarHBondContact OG-OE1 2.91Å
391	V	88	Confident	78.1	Confident	26 Å²	26	62.3 Å²	62.3	16%	0.158	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.4	176	-178.6	0	0	0	0	108.6	I350 V352 Q389 M393 W585	I350-V391 PolarHBondContact N-O 2.95Å; I350-V391 PolarHBondContact O-N 3.29Å; V352-V391 HydrophobicContact CB-CG2 4.11Å; V352-V391 HydrophobicContact CG2-CB 4.13Å; V352-V391 HydrophobicContact CG2-CG2 3.85Å; Q389-V391 HydrophobicContact CG-CG2 4.26Å; V391-M393 HydrophobicContact CB-CE 4.02Å; V391-M393 HydrophobicContact CG1-CE 3.87Å; V391-M393 HydrophobicContact CG1-CG 4.15Å; V391-M393 PolarHBondContact O-N 3.3Å; V391-W585 HydrophobicContact CG1-CZ2 3.97Å; V391-W585 HydrophobicContact CG2-CH2 4.11Å; V391-W585 HydrophobicContact CG2-CZ2 4.3Å; V391-W585 HydrophobicContact CG2-CZ3 4.45Å
392	L	89.8	Confident	77.5	Confident	114 Å²	114	64.2 Å²	64.2	60%	0.597	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	118.7	177.6	-168	113.6	0	0	0	109.7	K347	K347-L392 HydrophobicContact CB-CD1 4.26Å; K347-L392 HydrophobicContact CB-CD2 4.02Å; K347-L392 HydrophobicContact CB-CG 4.22Å; K347-L392 HydrophobicContact CD-CD2 3.92Å; K347-L392 HydrophobicContact CG-CD2 4.05Å
393	M	88.4	Confident	77.2	Confident	20 Å²	20	67 Å²	67	10%	0.099	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	155.6	-179.8	-59.5	-161.5	-164.5	0	0	110.9	V348 I350 V352 V391 W585 H586 L626	V348-M393 PolarHBondContact N-O 2.7Å; V348-M393 PolarHBondContact O-N 3.34Å; I350-M393 HydrophobicContact CB-CE 4.31Å; I350-M393 HydrophobicContact CB-CG 4.43Å; I350-M393 HydrophobicContact CB-SD 4.43Å; I350-M393 HydrophobicContact CD1-CB 3.75Å; I350-M393 HydrophobicContact CD1-CG 3.94Å; I350-M393 HydrophobicContact CD1-SD 3.69Å; I350-M393 HydrophobicContact CG1-CB 4.16Å; I350-M393 HydrophobicContact CG1-CG 4.23Å; I350-M393 HydrophobicContact CG1-SD 4.41Å; I350-M393 HydrophobicContact CG2-CE 4.48Å; V352-M393 HydrophobicContact CG2-CE 3.79Å; V391-M393 HydrophobicContact CB-CE 4.02Å; V391-M393 HydrophobicContact CG1-CE 3.87Å; V391-M393 HydrophobicContact CG1-CG 4.15Å; V391-M393 PolarHBondContact O-N 3.3Å; M393-W585 HydrophobicContact CE-CB 3.85Å; M393-W585 VanDerWaalsContact CE-CD1 3.43Å; M393-W585 HydrophobicContact CE-CD2 3.98Å; M393-W585 HydrophobicContact CE-CG 3.47Å; M393-W585 VanDerWaalsContact CE-CG 3.47Å; M393-H586 VanDerWaalsContact SD-CE1 3.59Å; M393-L626 HydrophobicContact CB-CD1 3.9Å; M393-L626 HydrophobicContact CB-CD2 4.49Å; M393-L626 HydrophobicContact SD-CD2 4.19Å
394	E	86.6	Confident	76.9	Confident	62 Å²	62	73 Å²	73	29%	0.29	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	126	-176	-165.7	174.5	-160.8	0	0	111.7	R396 F625	E394-R396 VanDerWaalsContact CD-CZ 3.47Å; E394-R396 HydrophobicContact CG-CG 3.96Å; E394-R396 IonicContact OE1-CZ 3.32Å; E394-R396 IonicContact OE1-NE 3.3Å; E394-R396 PolarHBondContact OE1-NE 2.71Å; E394-R396 IonicContact OE1-NH2 2.99Å; E394-R396 PolarHBondContact OE1-NH2 2.64Å; E394-R396 IonicContact OE2-CZ 2.99Å; E394-R396 VanDerWaalsContact OE2-CZ 3.32Å; E394-R396 IonicContact OE2-NE 3.09Å; E394-R396 PolarHBondContact OE2-NE 2.98Å; E394-R396 IonicContact OE2-NH2 2.7Å; E394-R396 PolarHBondContact OE2-NH2 2.83Å; E394-F625 CarbonylContact O-C 3.58Å; E394-F625 VanDerWaalsContact O-C 3.26Å; E394-F625 VanDerWaalsContact O-CA 3.26Å; E394-F625 WeakPolarHBondContact O-CA 3.34Å
395	E	84.8	Confident	77.3	Confident	24 Å²	24	69.2 Å²	69.2	11%	0.112	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.7	170.8	-174.8	176.3	-165	0	0	108.5	A345 N346 V348 F625 L626 R627 N641	A345-E395 CarbonylContact C-O 3.52Å; A345-E395 WeakPolarHBondContact CA-O 3.39Å; N346-E395 HydrophobicContact CB-CB 4.41Å; N346-E395 PolarHBondContact N-O 2.99Å; N346-E395 PolarHBondContact O-N 3Å; V348-E395 HydrophobicContact CG2-CB 4.08Å; E395-F625 WeakPolarHBondContact CA-O 3.43Å; E395-L626 HydrophobicContact CB-CD1 4.24Å; E395-R627 IonicContact OE1-CZ 3.38Å; E395-R627 IonicContact OE1-NH1 3.78Å; E395-R627 PolarHBondContact OE1-NH1 2.85Å; E395-R627 IonicContact OE1-NH2 3.96Å; E395-R627 PolarHBondContact OE1-NH2 2.79Å; E395-N641 PolarHBondContact OE1-ND2 3.27Å
396	R	83	Confident	77.7	Confident	84 Å²	84	68.7 Å²	68.7	32%	0.317	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.2	173.9	-59.4	-170.8	173.8	166	5.3	110.9	Y344 A345 E394 V398 F625 R627	Y344-R396 CarbonylContact O-C 3.52Å; Y344-R396 WeakPolarHBondContact O-CA 3.48Å; A345-R396 HydrophobicContact CB-CG 3.86Å; E394-R396 VanDerWaalsContact CD-CZ 3.47Å; E394-R396 HydrophobicContact CG-CG 3.96Å; E394-R396 IonicContact OE1-CZ 3.32Å; E394-R396 IonicContact OE1-NE 3.3Å; E394-R396 PolarHBondContact OE1-NE 2.71Å; E394-R396 IonicContact OE1-NH2 2.99Å; E394-R396 PolarHBondContact OE1-NH2 2.64Å; E394-R396 IonicContact OE2-CZ 2.99Å; E394-R396 VanDerWaalsContact OE2-CZ 3.32Å; E394-R396 IonicContact OE2-NE 3.09Å; E394-R396 PolarHBondContact OE2-NE 2.98Å; E394-R396 IonicContact OE2-NH2 2.7Å; E394-R396 PolarHBondContact OE2-NH2 2.83Å; R396-V398 PolarHBondContact O-N 2.64Å; R396-F625 HydrophobicContact CB-CB 3.64Å; R396-F625 HydrophobicContact CB-CD1 4.48Å; R396-F625 HydrophobicContact CB-CD2 3.71Å; R396-F625 HydrophobicContact CB-CG 3.71Å; R396-F625 HydrophobicContact CG-CB 3.96Å; R396-F625 HydrophobicContact CG-CD1 4.04Å; R396-F625 HydrophobicContact CG-CD2 4.05Å; R396-F625 HydrophobicContact CG-CG 3.77Å; R396-F625 PolarHBondContact N-O 3.19Å; R396-R627 WeakPolarHBondContact O-CG 3.46Å; R396-R627 PolarHBondContact O-NE 2.94Å
397	N	77.3	Confident	78.1	Confident	13 Å²	13	68.2 Å²	68.2	7%	0.07	35%	0.35	C	S	.	.			trans	-74.7	97	167.4	-71	-21.4	0	0	0	109.3	N343 Y344 F399 C400 R627	N343-N397 PolarHBondContact O-ND2 2.82Å; Y344-N397 HydrophobicContact CD2-CB 4.44Å; Y344-N397 PolarHBondContact O-N 2.9Å; N397-F399 PolarHBondContact O-N 2.7Å; N397-F399 VanDerWaalsContact O-N 3.16Å; N397-C400 WeakPolarHBondContact CB-SG 3.19Å; N397-R627 PolarHBondContact OD1-NH2 2.82Å
398	V	67.4	Low	78.1	Confident	27 Å²	27	62.6 Å²	62.6	16%	0.164	32%	0.324	C	S	.	.	S	Bend	trans	-62.3	-24	-177.8	-171.2	0	0	0	0	111.9	R396 L624 F625 R627 I629	R396-V398 PolarHBondContact O-N 2.64Å; V398-L624 HydrophobicContact CG1-CD2 3.66Å; V398-L624 HydrophobicContact CG1-CG 4.44Å; V398-L624 HydrophobicContact CG2-CB 4.23Å; V398-L624 HydrophobicContact CG2-CD2 4.24Å; V398-L624 HydrophobicContact CG2-CG 4.16Å; V398-L624 WeakPolarHBondContact CG2-O 3.25Å; V398-F625 HydrophobicContact CG2-CD2 4.09Å; V398-R627 HydrophobicContact CG2-CB 3.84Å; V398-R627 HydrophobicContact CG2-CG 3.71Å; V398-I629 HydrophobicContact CB-CD1 4.47Å; V398-I629 HydrophobicContact CG1-CD1 4Å
399	F	64.7	Low	77.8	Confident	34 Å²	34	61.9 Å²	61.9	15%	0.149	32%	0.32	C	S	.	.			trans	-146.9	106.8	-179.7	-72.5	-86.4	0	0	0	113.5	Y336 N397 I629 I639 K649 K674 Y676	Y336-F399 PolarHBondContact OH-O 3.4Å; N397-F399 PolarHBondContact O-N 2.7Å; N397-F399 VanDerWaalsContact O-N 3.16Å; F399-I629 HydrophobicContact CE2-CD1 4.39Å; F399-I639 HydrophobicContact CB-CD1 3.93Å; F399-I639 HydrophobicContact CD2-CD1 3.46Å; F399-I639 VanDerWaalsContact CD2-CD1 3.46Å; F399-I639 HydrophobicContact CE2-CD1 4.34Å; F399-I639 HydrophobicContact CG-CD1 4.01Å; F399-K649 HydrophobicContact CB-CD 4.33Å; F399-K674 HydrophobicContact CE1-CD 3.92Å; F399-Y676 WeakPolarHBondContact CE1-OH 3.19Å; F399-Y676 WeakPolarHBondContact CZ-OH 3.49Å
400	C	54.3	Low	77.3	Confident	47 Å²	47	62.6 Å²	62.6	32%	0.318	33%	0.327	S	S	.	.			trans	-105.6	-7	176.3	-68.5	0	0	0	0	115.2	L332 Y336 N397	L332-C400 WeakPolarHBondContact CD2-O 3.07Å; Y336-C400 VanDerWaalsContact OH-C 3.29Å; Y336-C400 WeakPolarHBondContact OH-CA 3.28Å; Y336-C400 PolarHBondContact OH-O 2.95Å; N397-C400 WeakPolarHBondContact CB-SG 3.19Å
401	G	59.9	Low	76.8	Confident	35 Å²	35	60.8 Å²	60.8	36%	0.361	32%	0.324	S	S	.	.	S	Bend	trans	-120.7	-177.6	-168.5	0	0	0	0	0	116.4	K649	G401-K649 PolarHBondContact O-NZ 3.11Å
402	T	64.4	Low	76	Confident	101 Å²	101	67 Å²	67	62%	0.62	34%	0.344	S	S	*	.			trans	-60.9	154.3	162.8	40.4	0	0	0	0	110.9	F331	F331-T402 HydrophobicContact CD1-CG2 4.27Å; F331-T402 HydrophobicContact CE1-CG2 3.33Å; F331-T402 HydrophobicContact CZ-CG2 4.01Å
403	Y	72.4	Confident	75.5	Confident	71 Å²	71	62.8 Å²	62.8	28%	0.278	32%	0.323	S	S	.	.			trans	-122.8	137.9	171.3	59.5	-81.4	0	0	0	108.7	V405 I651 K652	Y403-V405 HydrophobicContact CD2-CG2 3.94Å; Y403-V405 HydrophobicContact CE2-CG2 3.97Å; Y403-I651 HydrophobicContact CD1-CG2 4.14Å; Y403-I651 HydrophobicContact CD2-CG2 4.09Å; Y403-I651 HydrophobicContact CE1-CG2 3.83Å; Y403-I651 HydrophobicContact CE2-CG2 3.76Å; Y403-I651 HydrophobicContact CG-CG2 4.28Å; Y403-K652 WeakPolarHBondContact CE2-O 3.45Å; Y403-K652 PolarHBondContact OH-N 3.4Å; Y403-K652 PolarHBondContact OH-O 3.21Å
404	N	74.2	Confident	74.9	Confident	137 Å²	137	69.1 Å²	69.1	73%	0.733	35%	0.352	S	S	*	.			trans	-94.8	144.3	171.3	-68.7	-24.8	0	0	0	108.5	Y676	N404-Y676 WeakPolarHBondContact O-CD2 3.4Å
405	V	78	Confident	74.6	Confident	68 Å²	68	68.9 Å²	68.9	41%	0.412	35%	0.353	S	S	.	.			trans	-109.6	127.9	178.3	173.2	0	0	0	0	108.1	Y403 P678	Y403-V405 HydrophobicContact CD2-CG2 3.94Å; Y403-V405 HydrophobicContact CE2-CG2 3.97Å; V405-P678 HydrophobicContact CG1-CB 4.47Å; V405-P678 HydrophobicContact CG1-CG 3.11Å
406	R	81.4	Confident	74.7	Confident	114 Å²	114	69.2 Å²	69.2	43%	0.43	35%	0.353	S	S	.	.			trans	-125.5	115.4	176.9	-166.6	-178.5	-165.8	-165.9	4.1	109	I439 I440	R406-I439 PolarHBondContact NH1-O 3.01Å; R406-I440 PolarHBondContact NH1-O 3.41Å; R406-I440 PolarHBondContact NH2-O 2.99Å
407	I	82.9	Confident	75	Confident	74 Å²	74	66.6 Å²	66.6	38%	0.379	35%	0.346	S	S	.	.			trans	-83.6	121	178.8	-57.1	171.2	0	0	0	107.8	D410 P678	I407-D410 HydrophobicContact CG2-CB 4.41Å; I407-P678 HydrophobicContact CG1-CG 4.2Å
408	L	82.5	Confident	75.7	Confident	20 Å²	20	68.3 Å²	68.3	11%	0.105	36%	0.355	C	S	.	.	S	Bend	trans	-89.9	-29.1	176	-51.2	177.3	0	0	0	112.9	I426 I439 V442 T675 L677	L408-I426 HydrophobicContact CD1-CD1 3.7Å; L408-I439 HydrophobicContact CD1-CG1 4.37Å; L408-V442 HydrophobicContact CB-CG1 4.16Å; L408-V442 HydrophobicContact CD2-CB 4.2Å; L408-V442 HydrophobicContact CD2-CG1 3.72Å; L408-V442 HydrophobicContact CD2-CG2 3.65Å; L408-T675 HydrophobicContact CD1-CG2 4Å; L408-T675 HydrophobicContact CD2-CG2 4.24Å; L408-T675 HydrophobicContact CG-CG2 4.28Å; L408-L677 HydrophobicContact CB-CD2 3.54Å; L408-L677 HydrophobicContact CD1-CD1 4.02Å; L408-L677 HydrophobicContact CD1-CD2 3.56Å; L408-L677 HydrophobicContact CD1-CG 3.91Å; L408-L677 HydrophobicContact CG-CD2 3.35Å; L408-L677 HydrophobicContact CG-CG 4.17Å
409	S	79.8	Confident	76.8	Confident	32 Å²	32	69 Å²	69	22%	0.224	36%	0.356	C	S	.	.			trans	-155.4	134	177.9	-179.2	0	0	0	0	110.1	T411	S409-T411 PolarHBondContact OG-OG1 2.91Å
410	D	75.2	Confident	78	Confident	97 Å²	97	69.3 Å²	69.3	52%	0.519	36%	0.357	S	S	.	.			trans	-107.8	33.5	-178	-167.1	25	0	0	0	112.5	I407 E680	I407-D410 HydrophobicContact CG2-CB 4.41Å; D410-E680 WeakPolarHBondContact OD1-CB 3.46Å; D410-E680 VanDerWaalsContact OD1-CG 3.28Å; D410-E680 WeakPolarHBondContact OD1-CG 3.38Å; D410-E680 VanDerWaalsContact OD1-OE2 3.08Å
411	T	77.9	Confident	79.4	Confident	76 Å²	76	69.2 Å²	69.2	47%	0.466	36%	0.356	S	S	.	.			trans	-100	142.9	-175.4	51.1	0	0	0	0	112.5	S409 R416	S409-T411 PolarHBondContact OG-OG1 2.91Å; T411-R416 VanDerWaalsContact O-CZ 3.25Å; T411-R416 PolarHBondContact O-NH1 3.07Å; T411-R416 PolarHBondContact O-NH2 2.93Å; T411-R416 PolarHBondContact OG1-NH2 3.16Å
412	W	71.4	Confident	80.4	Confident	156 Å²	156	68.4 Å²	68.4	59%	0.591	35%	0.348	S	S	*	.			trans	-78.8	125.1	176.5	-164.1	131.3	0	0	0	114.1	Q414 W681	W412-Q414 HydrophobicContact CH2-CB 3.38Å; W412-Q414 HydrophobicContact CH2-CG 4.39Å; W412-Q414 HydrophobicContact CZ2-CB 3.78Å; W412-Q414 HydrophobicContact CZ3-CB 3.85Å; W412-W681 HydrophobicContact CB-CE3 4.46Å; W412-W681 HydrophobicContact CB-CH2 2.93Å; W412-W681 HydrophobicContact CB-CZ2 3.51Å; W412-W681 HydrophobicContact CB-CZ3 3.48Å; W412-W681 VanDerWaalsContact CB-CZ3 3.48Å; W412-W681 AromaticContact CD1-CD2 3.46Å; W412-W681 VanDerWaalsContact CD1-CD2 3.46Å; W412-W681 AromaticContact CD1-CE2 3.54Å; W412-W681 AromaticContact CD1-CE3 2.84Å; W412-W681 AromaticContact CD1-CH2 2.92Å; W412-W681 AromaticContact CD1-CZ2 3.22Å; W412-W681 AromaticContact CD1-CZ3 2.69Å; W412-W681 HydrophobicContact CD2-CH2 4.05Å; W412-W681 AromaticContact CD2-CZ2 3.8Å; W412-W681 HydrophobicContact CD2-CZ2 3.8Å; W412-W681 HydrophobicContact CD2-CZ3 4.43Å; W412-W681 AromaticContact CE2-CE2 3.96Å; W412-W681 AromaticContact CE2-CZ2 3.93Å; W412-W681 HydrophobicContact CG-CD2 4.18Å; W412-W681 AromaticContact CG-CE2 3.81Å; W412-W681 AromaticContact CG-CE3 3.75Å; W412-W681 HydrophobicContact CG-CE3 3.75Å; W412-W681 AromaticContact CG-CH2 2.88Å; W412-W681 HydrophobicContact CG-CH2 2.88Å; W412-W681 AromaticContact CG-CZ2 3.06Å; W412-W681 HydrophobicContact CG-CZ2 3.06Å; W412-W681 AromaticContact CG-CZ3 3.23Å; W412-W681 HydrophobicContact CG-CZ3 3.23Å; W412-W681 AromaticContact NE1-CD2 3.11Å; W412-W681 AromaticContact NE1-CE2 3.19Å; W412-W681 AromaticContact NE1-CE3 2.96Å; W412-W681 AromaticContact NE1-CH2 3.54Å; W412-W681 AromaticContact NE1-CZ2 3.33Å; W412-W681 VanDerWaalsContact NE1-CZ2 3.33Å; W412-W681 AromaticContact NE1-CZ3 3.36Å
413	D	79.4	Confident	81.3	Confident	27 Å²	27	64.7 Å²	64.7	14%	0.144	33%	0.33	C	S	.	.			trans	-156.5	112.7	165.4	-168.9	-16.8	0	0	0	111.8	N415 R416 S430	D413-N415 VanDerWaalsContact C-N 3.25Å; D413-N415 PolarHBondContact O-N 3.15Å; D413-N415 PolarHBondContact OD1-N 3.19Å; D413-R416 HydrophobicContact CB-CB 4.02Å; D413-R416 WeakPolarHBondContact O-CB 3.01Å; D413-R416 PolarHBondContact O-N 2.95Å; D413-R416 PolarHBondContact OD1-N 3.1Å; D413-S430 WeakPolarHBondContact OD2-CA 3.47Å; D413-S430 VanDerWaalsContact OD2-CB 3.24Å; D413-S430 WeakPolarHBondContact OD2-CB 3.43Å; D413-S430 PolarHBondContact OD2-OG 3.03Å
414	Q	74.6	Confident	82.1	Confident	152 Å²	152	65.2 Å²	65.2	71%	0.71	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.4	177.5	179.4	174.9	16.4	0	0	113.6	W412	W412-Q414 HydrophobicContact CH2-CB 3.38Å; W412-Q414 HydrophobicContact CH2-CG 4.39Å; W412-Q414 HydrophobicContact CZ2-CB 3.78Å; W412-Q414 HydrophobicContact CZ3-CB 3.85Å
415	N	80.8	Confident	82.9	Confident	58 Å²	58	60 Å²	60	31%	0.31	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	13.8	-178.3	-67.1	-22.3	0	0	0	112.3	D413 V417	D413-N415 VanDerWaalsContact C-N 3.25Å; D413-N415 PolarHBondContact O-N 3.15Å; D413-N415 PolarHBondContact OD1-N 3.19Å; N415-V417 PolarHBondContact O-N 3.29Å
416	R	87	Confident	83.6	Confident	31 Å²	31	57 Å²	57	12%	0.117	29%	0.291	C	S	.	.			trans	-64.7	127.6	177	-177.1	172.9	-63.4	168.2	5.1	110.9	T411 D413 I418 V428 S429	T411-R416 VanDerWaalsContact O-CZ 3.25Å; T411-R416 PolarHBondContact O-NH1 3.07Å; T411-R416 PolarHBondContact O-NH2 2.93Å; T411-R416 PolarHBondContact OG1-NH2 3.16Å; D413-R416 HydrophobicContact CB-CB 4.02Å; D413-R416 WeakPolarHBondContact O-CB 3.01Å; D413-R416 PolarHBondContact O-N 2.95Å; D413-R416 PolarHBondContact OD1-N 3.1Å; R416-I418 HydrophobicContact CG-CG2 3.92Å; R416-V428 HydrophobicContact CG-CG1 3.83Å; R416-S429 WeakPolarHBondContact CA-O 3.13Å
417	V	89.7	Confident	84.1	Confident	29 Å²	29	51.6 Å²	51.6	18%	0.176	27%	0.271	C	S	.	.			trans	-117.7	138.3	167.9	-175.9	0	0	0	0	106.8	N415 S429 L459	N415-V417 PolarHBondContact O-N 3.29Å; V417-S429 WeakPolarHBondContact CB-OG 3.46Å; V417-S429 PolarHBondContact N-OG 3.23Å; V417-S429 PolarHBondContact O-N 2.99Å; V417-S429 PolarHBondContact O-OG 2.89Å; V417-L459 HydrophobicContact CB-CD1 4.3Å; V417-L459 HydrophobicContact CB-CG 4.43Å; V417-L459 HydrophobicContact CG1-CB 4.22Å; V417-L459 HydrophobicContact CG1-CD1 4.32Å; V417-L459 HydrophobicContact CG1-CG 4.17Å; V417-L459 WeakPolarHBondContact O-CD1 3.11Å
418	I	91.3	Very high	84.6	Confident	48 Å²	48	48.3 Å²	48.3	25%	0.246	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.7	177.1	63.1	176.7	0	0	0	109.6	R416 A427 V428 S662 L677	R416-I418 HydrophobicContact CG-CG2 3.92Å; I418-A427 VanDerWaalsContact CA-O 3.28Å; I418-A427 WeakPolarHBondContact CA-O 3.17Å; I418-V428 HydrophobicContact CG2-CB 4.35Å; I418-V428 HydrophobicContact CG2-CG1 4.09Å; I418-V428 HydrophobicContact CG2-CG2 3.95Å; I418-S662 WeakPolarHBondContact CG1-OG 3.47Å; I418-L677 HydrophobicContact CD1-CD1 4.48Å
419	H	92	Very high	85	Confident	42 Å²	42	47.4 Å²	47.4	19%	0.194	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.4	167.7	-170.9	-83.3	0	0	0	109.7	A427 L459 F460 L461	H419-A427 PolarHBondContact N-O 3.03Å; H419-A427 PolarHBondContact O-N 3.31Å; H419-L459 HydrophobicContact CB-CB 3.85Å; H419-L459 PolarHBondContact CD2-O 3.43Å; H419-L459 VanDerWaalsContact CD2-O 3.27Å; H419-F460 AromaticContact CE1-CD2 3.96Å; H419-F460 AromaticContact NE2-CD2 3.6Å; H419-F460 AromaticContact NE2-CE2 3.93Å; H419-L461 PolarHBondContact ND1-N 2.83Å
420	Y	89.8	Confident	85.4	Confident	41 Å²	41	48.2 Å²	48.2	16%	0.161	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.2	177.6	176	-119.8	0	0	0	109	G422 G423 L425 I426 I439 F664 Q666	Y420-G422 WeakPolarHBondContact OH-CA 3.4Å; Y420-G422 PolarHBondContact OH-O 3.06Å; Y420-G423 WeakPolarHBondContact CE2-O 3.49Å; Y420-G423 PolarHBondContact OH-O 3.06Å; Y420-L425 VanDerWaalsContact CD2-O 3.28Å; Y420-L425 WeakPolarHBondContact CD2-O 3.42Å; Y420-I426 HydrophobicContact CD2-CD1 4.46Å; Y420-I426 HydrophobicContact CD2-CG1 3.69Å; Y420-I426 HydrophobicContact CE2-CG1 4.37Å; Y420-I426 HydrophobicContact CG-CG1 4.21Å; Y420-I439 HydrophobicContact CD2-CD1 3.8Å; Y420-I439 HydrophobicContact CE2-CD1 3.17Å; Y420-F664 HydrophobicContact CD1-CB 3.78Å; Y420-F664 AromaticContact CD1-CD1 3.33Å; Y420-F664 HydrophobicContact CD1-CD1 3.33Å; Y420-F664 HydrophobicContact CD1-CD2 4.39Å; Y420-F664 AromaticContact CD1-CE1 3.94Å; Y420-F664 HydrophobicContact CD1-CE1 3.94Å; Y420-F664 AromaticContact CD1-CG 3.58Å; Y420-F664 HydrophobicContact CD1-CG 3.58Å; Y420-F664 AromaticContact CE1-CD1 3.44Å; Y420-F664 HydrophobicContact CE1-CD1 3.44Å; Y420-F664 VanDerWaalsContact CE1-CD1 3.44Å; Y420-F664 AromaticContact CE1-CE1 3.78Å; Y420-F664 HydrophobicContact CE1-CE1 3.78Å; Y420-F664 HydrophobicContact CE1-CG 4.18Å; Y420-F664 WeakPolarHBondContact O-CD2 3.23Å; Y420-Q666 PolarHBondContact OH-OE1 3.03Å
421	S	83.3	Confident	86	Confident	44 Å²	44	47.2 Å²	47.2	31%	0.308	25%	0.25	S	C	.	.			trans	-116.6	11.6	-175	56.5	0	0	0	0	114	L461	S421-L461 WeakPolarHBondContact CB-O 3.5Å; S421-L461 PolarHBondContact OG-O 2.87Å
422	G	79.6	Confident	86.6	Confident	18 Å²	18	50.2 Å²	50.2	19%	0.186	25%	0.253	C	S	.	.	S	Bend	trans	95.2	1.9	176.8	0	0	0	0	0	116.2	Y420 Q666	Y420-G422 WeakPolarHBondContact OH-CA 3.4Å; Y420-G422 PolarHBondContact OH-O 3.06Å; G422-Q666 PolarHBondContact O-NE2 3.04Å; G422-Q666 PolarHBondContact O-OE1 3.25Å
423	G	85.1	Confident	87.5	Confident	23 Å²	23	47.1 Å²	47.1	24%	0.237	24%	0.243	C	C	.	.	S	Bend	trans	-93.3	-150.1	176.3	0	0	0	0	0	113.6	Y420 E463	Y420-G423 WeakPolarHBondContact CE2-O 3.49Å; Y420-G423 PolarHBondContact OH-O 3.06Å; G423-E463 WeakPolarHBondContact CA-OE2 3.37Å
424	D	89.4	Confident	88.3	Confident	82 Å²	82	45.9 Å²	45.9	44%	0.439	24%	0.237	S	C	.	.	S	Bend	trans	-90.6	-11.9	179.8	-69.9	-26.3	0	0	0	112.5	I439 I440 E463	D424-I439 WeakPolarHBondContact O-CB 3.48Å; D424-I439 WeakPolarHBondContact O-CG1 3.45Å; D424-I439 PolarHBondContact O-N 3.45Å; D424-I440 HydrophobicContact CB-CD1 4.44Å; D424-I440 VanDerWaalsContact OD1-CD1 3.28Å; D424-I440 WeakPolarHBondContact OD1-CD1 3.28Å; D424-E463 PolarHBondContact N-OE1 2.95Å; D424-E463 VanDerWaalsContact N-OE1 3.1Å; D424-E463 PolarHBondContact N-OE2 2.95Å
425	L	90.8	Very high	89.1	Confident	27 Å²	27	40.7 Å²	40.7	14%	0.141	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.3	-171.3	-54.2	-174.7	0	0	0	113.2	Y420 L436 L437 D438 I445 L461 E463	Y420-L425 VanDerWaalsContact CD2-O 3.28Å; Y420-L425 WeakPolarHBondContact CD2-O 3.42Å; L425-L436 HydrophobicContact CD1-CD1 4.31Å; L425-L437 WeakPolarHBondContact CA-O 3.47Å; L425-D438 HydrophobicContact CD2-CB 4.42Å; L425-I445 HydrophobicContact CD1-CD1 4.15Å; L425-I445 HydrophobicContact CD2-CD1 3.26Å; L425-I445 HydrophobicContact CD2-CG1 4.49Å; L425-I445 HydrophobicContact CG-CD1 4.34Å; L425-L461 HydrophobicContact CB-CD2 4.22Å; L425-L461 WeakPolarHBondContact O-CD2 3.21Å; L425-E463 WeakPolarHBondContact CB-OE2 3.49Å; L425-E463 HydrophobicContact CD1-CG 4.22Å; L425-E463 HydrophobicContact CG-CG 4.35Å; L425-E463 PolarHBondContact N-OE2 2.92Å
426	I	91.9	Very high	89.7	Confident	7 Å²	7	38.1 Å²	38.1	4%	0.036	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.3	168.8	-60.8	178.9	0	0	0	108.9	L408 Y420 V428 L436 L437 I439 L677	L408-I426 HydrophobicContact CD1-CD1 3.7Å; Y420-I426 HydrophobicContact CD2-CD1 4.46Å; Y420-I426 HydrophobicContact CD2-CG1 3.69Å; Y420-I426 HydrophobicContact CE2-CG1 4.37Å; Y420-I426 HydrophobicContact CG-CG1 4.21Å; I426-V428 HydrophobicContact CG2-CG2 3.86Å; I426-L436 CarbonylContact O-C 3.52Å; I426-L436 WeakPolarHBondContact O-CA 3.38Å; I426-L437 PolarHBondContact N-O 2.99Å; I426-L437 PolarHBondContact O-N 2.82Å; I426-I439 HydrophobicContact CD1-CD1 3.73Å; I426-I439 HydrophobicContact CD1-CG1 3.56Å; I426-I439 HydrophobicContact CG1-CD1 3.61Å; I426-I439 HydrophobicContact CG1-CG1 3.65Å; I426-L677 HydrophobicContact CD1-CD1 3.6Å; I426-L677 HydrophobicContact CD1-CG 4.48Å; I426-L677 HydrophobicContact CG2-CD1 4.47Å
427	A	92.9	Very high	89.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	126.5	170.9	0	0	0	0	0	109.7	I418 H419 I434 L436 L459 L461 L468	I418-A427 VanDerWaalsContact CA-O 3.28Å; I418-A427 WeakPolarHBondContact CA-O 3.17Å; H419-A427 PolarHBondContact N-O 3.03Å; H419-A427 PolarHBondContact O-N 3.31Å; A427-I434 HydrophobicContact CB-CG2 4.49Å; A427-L436 HydrophobicContact CB-CD2 4.01Å; A427-L459 HydrophobicContact CB-CD1 4.27Å; A427-L461 HydrophobicContact CB-CB 4.15Å; A427-L461 HydrophobicContact CB-CD1 4.45Å; A427-L461 HydrophobicContact CB-CD2 4.28Å; A427-L468 HydrophobicContact CB-CD1 3.59Å
428	V	92.3	Very high	89.8	Confident	5 Å²	5	37 Å²	37	3%	0.03	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	122.2	179.1	-177.2	0	0	0	0	108.9	R416 I418 I426 I434 H435 L437	R416-V428 HydrophobicContact CG-CG1 3.83Å; I418-V428 HydrophobicContact CG2-CB 4.35Å; I418-V428 HydrophobicContact CG2-CG1 4.09Å; I418-V428 HydrophobicContact CG2-CG2 3.95Å; I426-V428 HydrophobicContact CG2-CG2 3.86Å; V428-I434 WeakPolarHBondContact O-CA 3.35Å; V428-H435 WeakPolarHBondContact CB-NE2 3.47Å; V428-H435 VanDerWaalsContact CG1-CE1 3.47Å; V428-H435 WeakPolarHBondContact CG1-CE1 3.45Å; V428-H435 WeakPolarHBondContact CG1-NE2 3.47Å; V428-H435 PolarHBondContact N-O 2.79Å; V428-H435 PolarHBondContact O-CE1 2.82Å; V428-H435 PolarHBondContact O-N 3.33Å; V428-H435 PolarHBondContact O-ND1 2.8Å; V428-H435 VanDerWaalsContact O-ND1 3.07Å; V428-L437 HydrophobicContact CG2-CD1 3.78Å; V428-L437 HydrophobicContact CG2-CG 4.21Å
429	S	91.7	Very high	89.6	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	141.9	169.4	70.3	0	0	0	0	110.8	R416 V417 K433	R416-S429 WeakPolarHBondContact CA-O 3.13Å; V417-S429 WeakPolarHBondContact CB-OG 3.46Å; V417-S429 PolarHBondContact N-OG 3.23Å; V417-S429 PolarHBondContact O-N 2.99Å; V417-S429 PolarHBondContact O-OG 2.89Å; S429-K433 CarbonylContact C-O 3.59Å; S429-K433 WeakPolarHBondContact CA-O 3.37Å
430	S	86.9	Confident	89.2	Confident	50 Å²	50	35.9 Å²	35.9	35%	0.35	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	100.8	162.2	-175.4	0	0	0	0	109.2	D413 R432 K433	D413-S430 WeakPolarHBondContact OD2-CA 3.47Å; D413-S430 VanDerWaalsContact OD2-CB 3.24Å; D413-S430 WeakPolarHBondContact OD2-CB 3.43Å; D413-S430 PolarHBondContact OD2-OG 3.03Å; S430-R432 PolarHBondContact O-N 3.47Å; S430-K433 PolarHBondContact N-O 2.78Å; S430-K433 PolarHBondContact O-N 3.29Å; S430-K433 VanDerWaalsContact O-N 3.08Å
431	N	88	Confident	88.9	Confident	75 Å²	75	39.8 Å²	39.8	40%	0.401	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	-104	-172.3	-168	8.6	0	0	0	112.3	S455 V456	N431-S455 CarbonylContact O-C 3.46Å; N431-S455 WeakPolarHBondContact O-CA 3.2Å; N431-S455 WeakPolarHBondContact OD1-CB 3.28Å; N431-V456 PolarHBondContact O-N 3.4Å
432	R	90.6	Very high	88.8	Confident	140 Å²	140	39.9 Å²	39.9	53%	0.528	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-12.6	-177.5	-55.5	-173.1	-177.6	163.2	-2.4	114.4	S430 A453	S430-R432 PolarHBondContact O-N 3.47Å; R432-A453 PolarHBondContact NE-O 2.85Å; R432-A453 PolarHBondContact NH2-O 3.18Å
433	K	91.4	Very high	89	Confident	91 Å²	91	45.5 Å²	45.5	40%	0.396	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	150.1	-176.1	-59.2	-174.9	-175.7	177.8	0	109.8	S429 S430 R450	S429-K433 CarbonylContact C-O 3.59Å; S429-K433 WeakPolarHBondContact CA-O 3.37Å; S430-K433 PolarHBondContact N-O 2.78Å; S430-K433 PolarHBondContact O-N 3.29Å; S430-K433 VanDerWaalsContact O-N 3.08Å; K433-R450 HydrophobicContact CG-CG 4.32Å
434	I	94.5	Very high	89	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.9	170.6	-45.9	157.1	0	0	0	107.7	A427 V428 F449 V456 L459 L468 S470	A427-I434 HydrophobicContact CB-CG2 4.49Å; V428-I434 WeakPolarHBondContact O-CA 3.35Å; I434-F449 HydrophobicContact CB-CB 4.04Å; I434-F449 HydrophobicContact CB-CD2 3.93Å; I434-F449 HydrophobicContact CB-CG 4.39Å; I434-F449 HydrophobicContact CD1-CB 4.33Å; I434-F449 HydrophobicContact CG2-CD2 4.19Å; I434-F449 PolarHBondContact N-O 2.83Å; I434-F449 VanDerWaalsContact N-O 3.16Å; I434-F449 WeakPolarHBondContact O-CD2 3.49Å; I434-F449 PolarHBondContact O-N 3.39Å; I434-V456 HydrophobicContact CD1-CG1 4.4Å; I434-V456 HydrophobicContact CD1-CG2 4.15Å; I434-V456 HydrophobicContact CG1-CG1 4.48Å; I434-V456 HydrophobicContact CG1-CG2 4.04Å; I434-L459 HydrophobicContact CD1-CD2 3.71Å; I434-L459 HydrophobicContact CG1-CD2 4.12Å; I434-L459 HydrophobicContact CG2-CD1 4.29Å; I434-L459 HydrophobicContact CG2-CD2 4.16Å; I434-L468 HydrophobicContact CB-CD2 4.36Å; I434-L468 HydrophobicContact CD1-CD2 3.98Å; I434-L468 HydrophobicContact CG2-CD2 3.83Å; I434-S470 VanDerWaalsContact CD1-CB 3.45Å
435	H	92	Very high	89	Confident	43 Å²	43	46 Å²	46	20%	0.199	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	156.2	176.2	56.8	-80.3	0	0	0	109.7	V428	V428-H435 WeakPolarHBondContact CB-NE2 3.47Å; V428-H435 VanDerWaalsContact CG1-CE1 3.47Å; V428-H435 WeakPolarHBondContact CG1-CE1 3.45Å; V428-H435 WeakPolarHBondContact CG1-NE2 3.47Å; V428-H435 PolarHBondContact N-O 2.79Å; V428-H435 PolarHBondContact O-CE1 2.82Å; V428-H435 PolarHBondContact O-N 3.33Å; V428-H435 PolarHBondContact O-ND1 2.8Å; V428-H435 VanDerWaalsContact O-ND1 3.07Å
436	L	93	Very high	88.6	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.1	176.3	-55.8	172.9	0	0	0	109.9	L425 I426 A427 A444 I445 F449 L461 L482	L425-L436 HydrophobicContact CD1-CD1 4.31Å; I426-L436 CarbonylContact O-C 3.52Å; I426-L436 WeakPolarHBondContact O-CA 3.38Å; A427-L436 HydrophobicContact CB-CD2 4.01Å; L436-A444 WeakPolarHBondContact O-CA 3.44Å; L436-I445 HydrophobicContact CB-CB 4.18Å; L436-I445 HydrophobicContact CB-CD1 4.23Å; L436-I445 HydrophobicContact CB-CG1 4.45Å; L436-I445 PolarHBondContact O-N 2.9Å; L436-F449 HydrophobicContact CD1-CE2 4.01Å; L436-F449 HydrophobicContact CD1-CZ 4.09Å; L436-F449 HydrophobicContact CD2-CE2 4.04Å; L436-F449 HydrophobicContact CG-CE2 3.83Å; L436-F449 HydrophobicContact CG-CZ 4.4Å; L436-L461 HydrophobicContact CD2-CD1 4.38Å; L436-L482 HydrophobicContact CD1-CD2 3.84Å; L436-L482 HydrophobicContact CD2-CD2 4.09Å
437	L	91.1	Very high	88.5	Confident	18 Å²	18	52 Å²	52	9%	0.094	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.8	172.4	-63.4	178.4	0	0	0	109.2	L425 I426 V428 A444	L425-L437 WeakPolarHBondContact CA-O 3.47Å; I426-L437 PolarHBondContact N-O 2.99Å; I426-L437 PolarHBondContact O-N 2.82Å; V428-L437 HydrophobicContact CG2-CD1 3.78Å; V428-L437 HydrophobicContact CG2-CG 4.21Å; L437-A444 HydrophobicContact CD2-CB 3.74Å
438	D	88.9	Confident	88.2	Confident	19 Å²	19	56.7 Å²	56.7	10%	0.102	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	122.5	168.8	179	-25.6	0	0	0	109.1	L425 I440 Q441 V442 K443	L425-D438 HydrophobicContact CD2-CB 4.42Å; D438-I440 WeakPolarHBondContact OD1-CA 3.47Å; D438-I440 WeakPolarHBondContact OD1-CB 3.48Å; D438-I440 PolarHBondContact OD1-N 2.83Å; D438-Q441 HydrophobicContact CB-CB 4.32Å; D438-Q441 PolarHBondContact OD1-N 3.08Å; D438-Q441 VanDerWaalsContact OD2-CD 3.24Å; D438-Q441 WeakPolarHBondContact OD2-CG 3.46Å; D438-Q441 PolarHBondContact OD2-NE2 3.46Å; D438-Q441 VanDerWaalsContact OD2-NE2 3.09Å; D438-V442 WeakPolarHBondContact O-CA 3.33Å; D438-V442 PolarHBondContact O-N 3.16Å; D438-K443 PolarHBondContact N-O 3.35Å; D438-K443 PolarHBondContact O-N 2.83Å
439	I	85.9	Confident	88.3	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-38.5	179.7	-68.8	168.2	0	0	0	112.1	R406 L408 Y420 D424 I426 T675	R406-I439 PolarHBondContact NH1-O 3.01Å; L408-I439 HydrophobicContact CD1-CG1 4.37Å; Y420-I439 HydrophobicContact CD2-CD1 3.8Å; Y420-I439 HydrophobicContact CE2-CD1 3.17Å; D424-I439 WeakPolarHBondContact O-CB 3.48Å; D424-I439 WeakPolarHBondContact O-CG1 3.45Å; D424-I439 PolarHBondContact O-N 3.45Å; I426-I439 HydrophobicContact CD1-CD1 3.73Å; I426-I439 HydrophobicContact CD1-CG1 3.56Å; I426-I439 HydrophobicContact CG1-CD1 3.61Å; I426-I439 HydrophobicContact CG1-CG1 3.65Å; I439-T675 HydrophobicContact CG2-CG2 3.88Å; I439-T675 WeakPolarHBondContact CG2-OG1 3.49Å
440	I	84.5	Confident	88.4	Confident	60 Å²	60	63.4 Å²	63.4	31%	0.308	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-55.9	-176.3	-58.1	-168.7	0	0	0	108.7	R406 D424 D438 R673	R406-I440 PolarHBondContact NH1-O 3.41Å; R406-I440 PolarHBondContact NH2-O 2.99Å; D424-I440 HydrophobicContact CB-CD1 4.44Å; D424-I440 VanDerWaalsContact OD1-CD1 3.28Å; D424-I440 WeakPolarHBondContact OD1-CD1 3.28Å; D438-I440 WeakPolarHBondContact OD1-CA 3.47Å; D438-I440 WeakPolarHBondContact OD1-CB 3.48Å; D438-I440 PolarHBondContact OD1-N 2.83Å; I440-R673 VanDerWaalsContact CG2-NH1 3.31Å
441	Q	82.4	Confident	88.6	Confident	123 Å²	123	63 Å²	63	58%	0.575	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-18.1	-174.8	-60.4	-176.4	40.2	0	0	113	D438 K443	D438-Q441 HydrophobicContact CB-CB 4.32Å; D438-Q441 PolarHBondContact OD1-N 3.08Å; D438-Q441 VanDerWaalsContact OD2-CD 3.24Å; D438-Q441 WeakPolarHBondContact OD2-CG 3.46Å; D438-Q441 PolarHBondContact OD2-NE2 3.46Å; D438-Q441 VanDerWaalsContact OD2-NE2 3.09Å; Q441-K443 VanDerWaalsContact C-N 3.27Å; Q441-K443 HydrophobicContact CB-CB 4.36Å; Q441-K443 HydrophobicContact CB-CG 4.44Å; Q441-K443 PolarHBondContact O-N 2.62Å
442	V	81.1	Confident	88.9	Confident	46 Å²	46	59.9 Å²	59.9	28%	0.279	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	47.6	-173.4	-166.4	0	0	0	0	110.5	L408 D438	L408-V442 HydrophobicContact CB-CG1 4.16Å; L408-V442 HydrophobicContact CD2-CB 4.2Å; L408-V442 HydrophobicContact CD2-CG1 3.72Å; L408-V442 HydrophobicContact CD2-CG2 3.65Å; D438-V442 WeakPolarHBondContact O-CA 3.33Å; D438-V442 PolarHBondContact O-N 3.16Å
443	K	84.4	Confident	89.1	Confident	135 Å²	135	56.5 Å²	56.5	59%	0.587	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	145	180	-73.9	-176.6	-179.3	179.5	0	109.9	D438 Q441	D438-K443 PolarHBondContact N-O 3.35Å; D438-K443 PolarHBondContact O-N 2.83Å; Q441-K443 VanDerWaalsContact C-N 3.27Å; Q441-K443 HydrophobicContact CB-CB 4.36Å; Q441-K443 HydrophobicContact CB-CG 4.44Å; Q441-K443 PolarHBondContact O-N 2.62Å
444	A	85.6	Confident	89.1	Confident	66 Å²	66	52.5 Å²	52.5	55%	0.545	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.8	169.1	0	0	0	0	0	109.6	L436 L437	L436-A444 WeakPolarHBondContact O-CA 3.44Å; L437-A444 HydrophobicContact CD2-CB 3.74Å
445	I	88.2	Confident	89.1	Confident	49 Å²	49	53.1 Å²	53.1	25%	0.251	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	137.3	170.1	-61.3	-178.3	0	0	0	107.1	L425 L436 V447	L425-I445 HydrophobicContact CD1-CD1 4.15Å; L425-I445 HydrophobicContact CD2-CD1 3.26Å; L425-I445 HydrophobicContact CD2-CG1 4.49Å; L425-I445 HydrophobicContact CG-CD1 4.34Å; L436-I445 HydrophobicContact CB-CB 4.18Å; L436-I445 HydrophobicContact CB-CD1 4.23Å; L436-I445 HydrophobicContact CB-CG1 4.45Å; L436-I445 PolarHBondContact O-N 2.9Å; I445-V447 HydrophobicContact CG2-CB 4.17Å; I445-V447 HydrophobicContact CG2-CG2 3.89Å; I445-V447 PolarHBondContact O-N 2.85Å
446	P	83.9	Confident	89.3	Confident	131 Å²	131	51.1 Å²	51.1	85%	0.851	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	15	-177	30.5	-36.9	0	0	0	114.4
447	V	88.6	Confident	89.3	Confident	31 Å²	31	56.1 Å²	56.1	19%	0.188	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.3	174.1	179.6	0	0	0	0	108.6	I445 F449	I445-V447 HydrophobicContact CG2-CB 4.17Å; I445-V447 HydrophobicContact CG2-CG2 3.89Å; I445-V447 PolarHBondContact O-N 2.85Å; V447-F449 HydrophobicContact CG1-CE1 4.27Å; V447-F449 HydrophobicContact CG1-CE2 4.23Å; V447-F449 HydrophobicContact CG1-CZ 3.88Å
448	E	87.8	Confident	89.5	Confident	97 Å²	97	55.5 Å²	55.5	45%	0.453	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.4	176	-69	-168.7	172.5	0	0	111.2	R450	E448-R450 IonicContact OE1-NH2 2.82Å; E448-R450 IonicContact OE2-CZ 2.64Å; E448-R450 IonicContact OE2-NE 3.94Å; E448-R450 PolarHBondContact OE2-NE 3.15Å; E448-R450 IonicContact OE2-NH2 2.93Å; E448-R450 PolarHBondContact OE2-NH2 2.77Å
449	F	94.6	Very high	89.8	Confident	1 Å²	1	55 Å²	55	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	111.2	174.5	-49.7	-88.9	0	0	0	109.3	I434 L436 V447 L468 W480 D481 L482	I434-F449 HydrophobicContact CB-CB 4.04Å; I434-F449 HydrophobicContact CB-CD2 3.93Å; I434-F449 HydrophobicContact CB-CG 4.39Å; I434-F449 HydrophobicContact CD1-CB 4.33Å; I434-F449 HydrophobicContact CG2-CD2 4.19Å; I434-F449 PolarHBondContact N-O 2.83Å; I434-F449 VanDerWaalsContact N-O 3.16Å; I434-F449 WeakPolarHBondContact O-CD2 3.49Å; I434-F449 PolarHBondContact O-N 3.39Å; L436-F449 HydrophobicContact CD1-CE2 4.01Å; L436-F449 HydrophobicContact CD1-CZ 4.09Å; L436-F449 HydrophobicContact CD2-CE2 4.04Å; L436-F449 HydrophobicContact CG-CE2 3.83Å; L436-F449 HydrophobicContact CG-CZ 4.4Å; V447-F449 HydrophobicContact CG1-CE1 4.27Å; V447-F449 HydrophobicContact CG1-CE2 4.23Å; V447-F449 HydrophobicContact CG1-CZ 3.88Å; F449-L468 HydrophobicContact CD1-CD2 4.39Å; F449-L468 HydrophobicContact CD2-CD2 3.83Å; F449-L468 HydrophobicContact CE1-CD2 4.41Å; F449-L468 HydrophobicContact CE2-CD2 3.88Å; F449-L468 HydrophobicContact CG-CD2 4.1Å; F449-L468 HydrophobicContact CZ-CD2 4.2Å; F449-W480 HydrophobicContact CB-CD2 3.95Å; F449-W480 HydrophobicContact CB-CE3 3.87Å; F449-W480 HydrophobicContact CB-CG 4.46Å; F449-W480 HydrophobicContact CB-CH2 4.43Å; F449-W480 HydrophobicContact CB-CZ2 4.49Å; F449-W480 HydrophobicContact CB-CZ3 4.11Å; F449-W480 HydrophobicContact CD1-CB 3.46Å; F449-W480 VanDerWaalsContact CD1-CB 3.46Å; F449-W480 AromaticContact CD1-CD2 3.81Å; F449-W480 HydrophobicContact CD1-CD2 3.81Å; F449-W480 AromaticContact CD1-CE3 3.78Å; F449-W480 HydrophobicContact CD1-CE3 3.78Å; F449-W480 AromaticContact CD1-CG 3.69Å; F449-W480 HydrophobicContact CD1-CG 3.69Å; F449-W480 HydrophobicContact CE1-CB 3.61Å; F449-W480 HydrophobicContact CE1-CG 4.32Å; F449-W480 HydrophobicContact CG-CB 4.47Å; F449-W480 HydrophobicContact CG-CD2 4.27Å; F449-W480 HydrophobicContact CG-CE3 4.32Å; F449-W480 HydrophobicContact CG-CG 4.33Å; F449-D481 WeakPolarHBondContact CE1-O 3.33Å; F449-L482 HydrophobicContact CZ-CD2 3.89Å
450	R	92.3	Very high	90.3	Very high	146 Å²	146	56.1 Å²	56.1	55%	0.551	31%	0.306	S	S	*	.			trans	-123.3	135.8	179.3	-61.9	-173.3	179	-165	7.2	110	K433 E448 W480	K433-R450 HydrophobicContact CG-CG 4.32Å; E448-R450 IonicContact OE1-NH2 2.82Å; E448-R450 IonicContact OE2-CZ 2.64Å; E448-R450 IonicContact OE2-NE 3.94Å; E448-R450 PolarHBondContact OE2-NE 3.15Å; E448-R450 IonicContact OE2-NH2 2.93Å; E448-R450 PolarHBondContact OE2-NH2 2.77Å; R450-W480 WeakPolarHBondContact O-CH2 3.18Å; R450-W480 WeakPolarHBondContact O-CZ3 3.42Å
451	G	91.4	Very high	90.8	Very high	40 Å²	40	53.2 Å²	53.2	41%	0.412	29%	0.291	S	S	.	.			trans	158.9	-20.9	174.9	0	0	0	0	0	115	R478	G451-R478 PolarHBondContact O-NH1 2.7Å; G451-R478 PolarHBondContact O-NH2 3.41Å
452	H	94.9	Very high	91.3	Very high	11 Å²	11	48.3 Å²	48.3	5%	0.051	27%	0.27	C	S	.	.			trans	-65.2	138.3	172.5	-83.7	-63.4	0	0	0	112	V456 S470 S472 D474 S476 R478 W480	H452-V456 HydrophobicContact CB-CG2 4.46Å; H452-S470 PolarHBondContact CD2-OG 3.37Å; H452-S470 PolarHBondContact NE2-O 2.9Å; H452-S470 PolarHBondContact NE2-OG 2.77Å; H452-S472 WeakPolarHBondContact CE1-CB 3.28Å; H452-S472 WeakPolarHBondContact ND1-CB 3.35Å; H452-D474 VanDerWaalsContact CA-OD2 3.28Å; H452-D474 WeakPolarHBondContact CA-OD2 3.21Å; H452-D474 WeakPolarHBondContact CB-OD2 3.38Å; H452-D474 IonicContact CE1-OD1 2.78Å; H452-D474 IonicContact CE1-OD2 3.16Å; H452-D474 IonicContact CG-OD2 2.78Å; H452-D474 IonicContact ND1-OD1 2.7Å; H452-D474 PolarHBondContact ND1-OD1 2.83Å; H452-D474 IonicContact ND1-OD2 2.68Å; H452-D474 PolarHBondContact ND1-OD2 2.84Å; H452-S476 PolarHBondContact CE1-O 2.78Å; H452-R478 VanDerWaalsContact CE1-CD 3.45Å; H452-R478 WeakPolarHBondContact CE1-CD 3.46Å; H452-W480 AromaticContact CD2-CZ2 3.98Å
453	A	93.9	Very high	91.7	Very high	68 Å²	68	48.7 Å²	48.7	56%	0.562	27%	0.269	S	S	*	.	S	Bend	trans	-85.3	-16.3	176	0	0	0	0	0	112.4	R432 D474	R432-A453 PolarHBondContact NE-O 2.85Å; R432-A453 PolarHBondContact NH2-O 3.18Å; A453-D474 HydrophobicContact CB-CB 4.01Å; A453-D474 PolarHBondContact N-OD2 3.42Å
454	G	92.8	Very high	91.9	Very high	7 Å²	7	51.5 Å²	51.5	7%	0.072	28%	0.284	C	S	.	.	S	Bend	trans	-126.8	171.3	-179.4	0	0	0	0	0	112.8	V456 S472	G454-V456 PolarHBondContact O-N 2.88Å; G454-S472 VanDerWaalsContact C-OG 3.22Å; G454-S472 PolarHBondContact O-OG 2.6Å
455	S	93.2	Very high	92.2	Very high	15 Å²	15	54.6 Å²	54.6	11%	0.105	29%	0.287	C	S	.	.			trans	-61.7	133.4	176.7	-172.6	0	0	0	0	110.5	N431 S472 Y473	N431-S455 CarbonylContact O-C 3.46Å; N431-S455 WeakPolarHBondContact O-CA 3.2Å; N431-S455 WeakPolarHBondContact OD1-CB 3.28Å; S455-S472 WeakPolarHBondContact O-CA 3.43Å; S455-S472 PolarHBondContact O-OG 2.68Å; S455-S472 VanDerWaalsContact O-OG 3.13Å; S455-Y473 PolarHBondContact O-N 3.35Å
456	V	96	Very high	92.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	129.2	170.9	-179.7	0	0	0	0	108.6	N431 I434 H452 G454 L459	N431-V456 PolarHBondContact O-N 3.4Å; I434-V456 HydrophobicContact CD1-CG1 4.4Å; I434-V456 HydrophobicContact CD1-CG2 4.15Å; I434-V456 HydrophobicContact CG1-CG1 4.48Å; I434-V456 HydrophobicContact CG1-CG2 4.04Å; H452-V456 HydrophobicContact CB-CG2 4.46Å; G454-V456 PolarHBondContact O-N 2.88Å; V456-L459 HydrophobicContact CG1-CD2 3.69Å; V456-L459 HydrophobicContact CG1-CG 3.99Å
457	R	94.5	Very high	92.9	Very high	109 Å²	109	48.3 Å²	48.3	41%	0.411	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-16.2	-173.4	-66.6	-51.1	-56	-115.1	0.4	113.7	G471 T497 I498	R457-G471 PolarHBondContact N-O 2.93Å; R457-T497 HydrophobicContact CB-CG2 4.44Å; R457-T497 HydrophobicContact CG-CG2 3.97Å; R457-I498 VanDerWaalsContact CB-O 3.23Å; R457-I498 WeakPolarHBondContact CB-O 3.41Å
458	A	94.4	Very high	93.3	Very high	6 Å²	6	46.9 Å²	46.9	5%	0.05	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	142.9	172.9	0	0	0	0	0	109.6	S470 G471 I498 M501	A458-S470 WeakPolarHBondContact O-CA 3.38Å; A458-G471 PolarHBondContact N-O 2.99Å; A458-G471 VanDerWaalsContact N-O 3.09Å; A458-G471 PolarHBondContact O-N 3.26Å; A458-I498 HydrophobicContact CB-CG2 4.42Å; A458-M501 HydrophobicContact CB-CB 4.27Å; A458-M501 HydrophobicContact CB-CE 3.86Å; A458-M501 HydrophobicContact CB-CG 3.82Å; A458-M501 HydrophobicContact CB-SD 4.34Å
459	L	96.1	Very high	93.7	Very high	9 Å²	9	42.2 Å²	42.2	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.1	176.8	-74.5	177.7	0	0	0	109.5	V417 H419 A427 I434 V456 L468 L469	V417-L459 HydrophobicContact CB-CD1 4.3Å; V417-L459 HydrophobicContact CB-CG 4.43Å; V417-L459 HydrophobicContact CG1-CB 4.22Å; V417-L459 HydrophobicContact CG1-CD1 4.32Å; V417-L459 HydrophobicContact CG1-CG 4.17Å; V417-L459 WeakPolarHBondContact O-CD1 3.11Å; H419-L459 HydrophobicContact CB-CB 3.85Å; H419-L459 PolarHBondContact CD2-O 3.43Å; H419-L459 VanDerWaalsContact CD2-O 3.27Å; A427-L459 HydrophobicContact CB-CD1 4.27Å; I434-L459 HydrophobicContact CD1-CD2 3.71Å; I434-L459 HydrophobicContact CG1-CD2 4.12Å; I434-L459 HydrophobicContact CG2-CD1 4.29Å; I434-L459 HydrophobicContact CG2-CD2 4.16Å; V456-L459 HydrophobicContact CG1-CD2 3.69Å; V456-L459 HydrophobicContact CG1-CG 3.99Å; L459-L468 HydrophobicContact CD2-CD1 4.41Å; L459-L469 WeakPolarHBondContact CA-O 3.26Å
460	F	95.5	Very high	93.9	Very high	28 Å²	28	42.2 Å²	42.2	12%	0.123	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	115.4	167.8	-172.2	-81.4	0	0	0	108.6	H419 C462 L469 L503	H419-F460 AromaticContact CE1-CD2 3.96Å; H419-F460 AromaticContact NE2-CD2 3.6Å; H419-F460 AromaticContact NE2-CE2 3.93Å; F460-C462 HydrophobicContact CE1-CB 4.23Å; F460-L469 HydrophobicContact CB-CB 4.2Å; F460-L469 PolarHBondContact N-O 2.8Å; F460-L469 PolarHBondContact O-N 2.84Å; F460-L503 HydrophobicContact CD1-CB 4Å; F460-L503 HydrophobicContact CD1-CD2 4.05Å; F460-L503 HydrophobicContact CD2-CB 4.13Å; F460-L503 HydrophobicContact CE1-CB 3.65Å; F460-L503 HydrophobicContact CE1-CD2 3.49Å; F460-L503 VanDerWaalsContact CE1-CD2 3.49Å; F460-L503 HydrophobicContact CE1-CG 4.2Å; F460-L503 HydrophobicContact CE2-CB 3.76Å; F460-L503 HydrophobicContact CG-CB 4.25Å; F460-L503 HydrophobicContact CZ-CB 3.53Å; F460-L503 HydrophobicContact CZ-CD2 4.05Å; F460-L503 HydrophobicContact CZ-CG 4.38Å
461	L	94.6	Very high	94.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.1	178.5	175.8	66.3	0	0	0	109	H419 S421 L425 A427 L436 L468 L482	H419-L461 PolarHBondContact ND1-N 2.83Å; S421-L461 WeakPolarHBondContact CB-O 3.5Å; S421-L461 PolarHBondContact OG-O 2.87Å; L425-L461 HydrophobicContact CB-CD2 4.22Å; L425-L461 WeakPolarHBondContact O-CD2 3.21Å; A427-L461 HydrophobicContact CB-CB 4.15Å; A427-L461 HydrophobicContact CB-CD1 4.45Å; A427-L461 HydrophobicContact CB-CD2 4.28Å; L436-L461 HydrophobicContact CD2-CD1 4.38Å; L461-L468 HydrophobicContact CB-CD1 4.08Å; L461-L468 HydrophobicContact CD1-CD1 4.08Å; L461-L482 HydrophobicContact CD1-CD1 3.63Å; L461-L482 HydrophobicContact CD1-CD2 3.58Å; L461-L482 HydrophobicContact CD1-CG 4.24Å
462	C	93.1	Very high	94.3	Very high	20 Å²	20	33.3 Å²	33.3	14%	0.135	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	94.5	168.9	-169.5	0	0	0	0	108.8	F460 N466 F467 L482	F460-C462 HydrophobicContact CE1-CB 4.23Å; C462-N466 PolarHBondContact O-N 3.27Å; C462-N466 VanDerWaalsContact O-N 3.13Å; C462-F467 CarbonylContact C-O 3.55Å; C462-F467 HydrophobicContact CB-CD1 3.97Å; C462-F467 HydrophobicContact CB-CD2 4.17Å; C462-F467 HydrophobicContact CB-CE1 3.54Å; C462-F467 HydrophobicContact CB-CE2 3.73Å; C462-F467 HydrophobicContact CB-CG 4.27Å; C462-F467 HydrophobicContact CB-CZ 3.38Å; C462-F467 PolarHBondContact N-O 3.47Å; C462-F467 PolarHBondContact O-N 3.46Å; C462-F467 VanDerWaalsContact O-O 3.14Å; C462-L482 WeakPolarHBondContact O-CD1 3.28Å
463	E	90.4	Very high	94.4	Very high	53 Å²	53	39.7 Å²	39.7	25%	0.248	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-37.5	-178.7	-167.9	173.6	158	0	0	112.1	G423 D424 L425 E465 N466	G423-E463 WeakPolarHBondContact CA-OE2 3.37Å; D424-E463 PolarHBondContact N-OE1 2.95Å; D424-E463 VanDerWaalsContact N-OE1 3.1Å; D424-E463 PolarHBondContact N-OE2 2.95Å; L425-E463 WeakPolarHBondContact CB-OE2 3.49Å; L425-E463 HydrophobicContact CD1-CG 4.22Å; L425-E463 HydrophobicContact CG-CG 4.35Å; L425-E463 PolarHBondContact N-OE2 2.92Å; E463-E465 PolarHBondContact O-N 2.91Å; E463-N466 PolarHBondContact O-N 2.94Å
464	E	88.8	Confident	94.5	Very high	194 Å²	194	38.2 Å²	38.2	91%	0.907	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-44.1	-179.5	-63.7	-175.7	170.7	0	0	112.5	N466	E464-N466 VanDerWaalsContact C-N 3.34Å
465	E	90.1	Very high	94.6	Very high	131 Å²	131	41 Å²	41	61%	0.612	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	8.2	178.6	-60.9	-175.4	169.3	0	0	112.6	E463 F467	E463-E465 PolarHBondContact O-N 2.91Å; E465-F467 HydrophobicContact CB-CD1 3.7Å; E465-F467 HydrophobicContact CB-CE1 3.54Å; E465-F467 HydrophobicContact CG-CE1 4.44Å; E465-F467 PolarHBondContact O-N 2.83Å; E465-F467 VanDerWaalsContact OE2-CE1 3.28Å; E465-F467 WeakPolarHBondContact OE2-CE1 3.48Å
466	N	92.8	Very high	94.8	Very high	44 Å²	44	41 Å²	41	24%	0.235	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	39	172.7	-164.5	64.2	0	0	0	115.7	C462 E463 E464 D481 L482 K483	C462-N466 PolarHBondContact O-N 3.27Å; C462-N466 VanDerWaalsContact O-N 3.13Å; E463-N466 PolarHBondContact O-N 2.94Å; E464-N466 VanDerWaalsContact C-N 3.34Å; N466-D481 PolarHBondContact ND2-OD1 2.78Å; N466-L482 WeakPolarHBondContact O-CB 3.26Å; N466-L482 PolarHBondContact O-N 3.38Å; N466-K483 WeakPolarHBondContact ND2-CD 3.29Å; N466-K483 WeakPolarHBondContact ND2-CG 3.47Å; N466-K483 WeakPolarHBondContact OD1-CE 3.35Å; N466-K483 WeakPolarHBondContact OD1-CG 3.4Å
467	F	94.9	Very high	94.9	Very high	5 Å²	5	41 Å²	41	2%	0.022	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	163.2	176.6	73.2	-95.7	0	0	0	114.9	C462 E465 L469 Y479 W480 L482 L503	C462-F467 CarbonylContact C-O 3.55Å; C462-F467 HydrophobicContact CB-CD1 3.97Å; C462-F467 HydrophobicContact CB-CD2 4.17Å; C462-F467 HydrophobicContact CB-CE1 3.54Å; C462-F467 HydrophobicContact CB-CE2 3.73Å; C462-F467 HydrophobicContact CB-CG 4.27Å; C462-F467 HydrophobicContact CB-CZ 3.38Å; C462-F467 PolarHBondContact N-O 3.47Å; C462-F467 PolarHBondContact O-N 3.46Å; C462-F467 VanDerWaalsContact O-O 3.14Å; E465-F467 HydrophobicContact CB-CD1 3.7Å; E465-F467 HydrophobicContact CB-CE1 3.54Å; E465-F467 HydrophobicContact CG-CE1 4.44Å; E465-F467 PolarHBondContact O-N 2.83Å; E465-F467 VanDerWaalsContact OE2-CE1 3.28Å; E465-F467 WeakPolarHBondContact OE2-CE1 3.48Å; F467-L469 HydrophobicContact CD2-CG 4.11Å; F467-L469 HydrophobicContact CE2-CD1 3.92Å; F467-L469 HydrophobicContact CE2-CG 3.97Å; F467-Y479 HydrophobicContact CB-CD1 4.5Å; F467-Y479 HydrophobicContact CB-CE1 3.66Å; F467-Y479 HydrophobicContact CB-CE2 3.9Å; F467-Y479 WeakPolarHBondContact CB-OH 3.35Å; F467-Y479 HydrophobicContact CD1-CE2 4.19Å; F467-Y479 WeakPolarHBondContact CD1-OH 3.46Å; F467-Y479 HydrophobicContact CD2-CD2 4.3Å; F467-Y479 AromaticContact CD2-CE2 3.71Å; F467-Y479 HydrophobicContact CD2-CE2 3.71Å; F467-Y479 HydrophobicContact CE2-CE2 4.32Å; F467-Y479 HydrophobicContact CG-CE1 4.35Å; F467-Y479 AromaticContact CG-CE2 3.66Å; F467-Y479 HydrophobicContact CG-CE2 3.66Å; F467-Y479 AromaticContact CG-CZ 3.53Å; F467-Y479 WeakPolarHBondContact CG-OH 3.26Å; F467-W480 WeakPolarHBondContact CA-O 3.43Å; F467-W480 WeakPolarHBondContact CB-O 3.37Å; F467-L482 WeakPolarHBondContact O-CD1 3.27Å; F467-L503 HydrophobicContact CE2-CD2 4.07Å; F467-L503 HydrophobicContact CZ-CD2 3.58Å
468	L	96.6	Very high	95.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.4	175	179.2	78	0	0	0	109.7	A427 I434 F449 L459 L461 W480 L482	A427-L468 HydrophobicContact CB-CD1 3.59Å; I434-L468 HydrophobicContact CB-CD2 4.36Å; I434-L468 HydrophobicContact CD1-CD2 3.98Å; I434-L468 HydrophobicContact CG2-CD2 3.83Å; F449-L468 HydrophobicContact CD1-CD2 4.39Å; F449-L468 HydrophobicContact CD2-CD2 3.83Å; F449-L468 HydrophobicContact CE1-CD2 4.41Å; F449-L468 HydrophobicContact CE2-CD2 3.88Å; F449-L468 HydrophobicContact CG-CD2 4.1Å; F449-L468 HydrophobicContact CZ-CD2 4.2Å; L459-L468 HydrophobicContact CD2-CD1 4.41Å; L461-L468 HydrophobicContact CB-CD1 4.08Å; L461-L468 HydrophobicContact CD1-CD1 4.08Å; L468-W480 HydrophobicContact CB-CB 4.26Å; L468-W480 PolarHBondContact N-O 2.73Å; L468-W480 PolarHBondContact O-N 3.05Å; L468-L482 HydrophobicContact CB-CD2 3.8Å; L468-L482 HydrophobicContact CB-CG 4.44Å
469	L	97.5	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	138.3	168.8	-66.2	165.7	0	0	0	109.9	L459 F460 F467 R478 Y479 F491 M501 L503 L508	L459-L469 WeakPolarHBondContact CA-O 3.26Å; F460-L469 HydrophobicContact CB-CB 4.2Å; F460-L469 PolarHBondContact N-O 2.8Å; F460-L469 PolarHBondContact O-N 2.84Å; F467-L469 HydrophobicContact CD2-CG 4.11Å; F467-L469 HydrophobicContact CE2-CD1 3.92Å; F467-L469 HydrophobicContact CE2-CG 3.97Å; L469-R478 CarbonylContact C-O 3.6Å; L469-R478 VanDerWaalsContact CA-O 3.29Å; L469-R478 WeakPolarHBondContact CA-O 3.37Å; L469-Y479 HydrophobicContact CD2-CD2 3.69Å; L469-Y479 HydrophobicContact CD2-CG 4.24Å; L469-F491 HydrophobicContact CD2-CE2 3.89Å; L469-F491 HydrophobicContact CD2-CZ 4.3Å; L469-M501 HydrophobicContact CB-CE 4.22Å; L469-L503 HydrophobicContact CD1-CD1 4.38Å; L469-L508 HydrophobicContact CD1-CD1 3.83Å; L469-L508 HydrophobicContact CD1-CD2 4.09Å; L469-L508 HydrophobicContact CD1-CG 4.41Å; L469-L508 HydrophobicContact CD2-CD2 4.39Å
470	S	97.6	Very high	95.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	131.5	176	62.1	0	0	0	0	112.4	I434 H452 A458 I477 R478 W480	I434-S470 VanDerWaalsContact CD1-CB 3.45Å; H452-S470 PolarHBondContact CD2-OG 3.37Å; H452-S470 PolarHBondContact NE2-O 2.9Å; H452-S470 PolarHBondContact NE2-OG 2.77Å; A458-S470 WeakPolarHBondContact O-CA 3.38Å; S470-I477 CarbonylContact O-C 3.48Å; S470-I477 WeakPolarHBondContact O-CA 3.47Å; S470-I477 WeakPolarHBondContact O-CG2 3.37Å; S470-R478 PolarHBondContact N-O 3.01Å; S470-R478 PolarHBondContact O-N 3.36Å; S470-W480 PolarHBondContact OG-NE1 2.7Å
471	G	97	Very high	95.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.2	174.7	0	0	0	0	0	110.4	R457 A458 M501	R457-G471 PolarHBondContact N-O 2.93Å; A458-G471 PolarHBondContact N-O 2.99Å; A458-G471 VanDerWaalsContact N-O 3.09Å; A458-G471 PolarHBondContact O-N 3.26Å; G471-M501 VanDerWaalsContact N-CE 3.28Å
472	S	96.4	Very high	95.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	166.8	-168.3	176.2	0	0	0	0	114.2	H452 G454 S455 D474 L475 S476 I498	H452-S472 WeakPolarHBondContact CE1-CB 3.28Å; H452-S472 WeakPolarHBondContact ND1-CB 3.35Å; G454-S472 VanDerWaalsContact C-OG 3.22Å; G454-S472 PolarHBondContact O-OG 2.6Å; S455-S472 WeakPolarHBondContact O-CA 3.43Å; S455-S472 PolarHBondContact O-OG 2.68Å; S455-S472 VanDerWaalsContact O-OG 3.13Å; S472-D474 VanDerWaalsContact CB-OD1 3.27Å; S472-D474 WeakPolarHBondContact CB-OD1 3.24Å; S472-D474 PolarHBondContact O-N 2.91Å; S472-D474 PolarHBondContact OG-N 2.99Å; S472-D474 PolarHBondContact OG-OD1 3.35Å; S472-L475 PolarHBondContact O-N 2.69Å; S472-S476 PolarHBondContact N-O 3.38Å; S472-I498 PolarHBondContact O-N 3.39Å
473	Y	95.7	Very high	95.1	Very high	144 Å²	144	47.4 Å²	47.4	57%	0.565	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.3	166	-168.7	-94.9	0	0	0	112.9	S455 L475 T497	S455-Y473 PolarHBondContact O-N 3.35Å; Y473-L475 PolarHBondContact O-N 3.15Å; Y473-L475 VanDerWaalsContact O-N 3.15Å; Y473-T497 HydrophobicContact CD2-CG2 3.9Å; Y473-T497 WeakPolarHBondContact CD2-OG1 3.33Å; Y473-T497 VanDerWaalsContact CE2-OG1 3.29Å; Y473-T497 WeakPolarHBondContact CE2-OG1 3Å
474	D	95.8	Very high	95.1	Very high	37 Å²	37	48.1 Å²	48.1	20%	0.198	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	12.4	175.3	69.3	17.4	0	0	0	114.9	H452 A453 S472 S476	H452-D474 VanDerWaalsContact CA-OD2 3.28Å; H452-D474 WeakPolarHBondContact CA-OD2 3.21Å; H452-D474 WeakPolarHBondContact CB-OD2 3.38Å; H452-D474 IonicContact CE1-OD1 2.78Å; H452-D474 IonicContact CE1-OD2 3.16Å; H452-D474 IonicContact CG-OD2 2.78Å; H452-D474 IonicContact ND1-OD1 2.7Å; H452-D474 PolarHBondContact ND1-OD1 2.83Å; H452-D474 IonicContact ND1-OD2 2.68Å; H452-D474 PolarHBondContact ND1-OD2 2.84Å; A453-D474 HydrophobicContact CB-CB 4.01Å; A453-D474 PolarHBondContact N-OD2 3.42Å; S472-D474 VanDerWaalsContact CB-OD1 3.27Å; S472-D474 WeakPolarHBondContact CB-OD1 3.24Å; S472-D474 PolarHBondContact O-N 2.91Å; S472-D474 PolarHBondContact OG-N 2.99Å; S472-D474 PolarHBondContact OG-OD1 3.35Å; D474-S476 VanDerWaalsContact CG-OG 3.32Å; D474-S476 PolarHBondContact O-N 3.04Å; D474-S476 VanDerWaalsContact O-N 3.11Å; D474-S476 WeakPolarHBondContact OD1-CB 3.37Å; D474-S476 PolarHBondContact OD1-N 3.39Å; D474-S476 PolarHBondContact OD1-OG 3.3Å
475	L	96.8	Very high	95.3	Very high	65 Å²	65	39.4 Å²	39.4	34%	0.34	19%	0.19	S	C	.	.	S	Bend	trans	68.8	0.7	176.7	-34	179.3	0	0	0	114.5	S472 Y473 G496	S472-L475 PolarHBondContact O-N 2.69Å; Y473-L475 PolarHBondContact O-N 3.15Å; Y473-L475 VanDerWaalsContact O-N 3.15Å; L475-G496 WeakPolarHBondContact CD2-O 3.08Å
476	S	96.7	Very high	95.5	Very high	15 Å²	15	37.3 Å²	37.3	11%	0.105	19%	0.187	C	C	.	.			trans	-104	144.6	-179.6	75.5	0	0	0	0	112.4	H452 S472 D474 I498	H452-S476 PolarHBondContact CE1-O 2.78Å; S472-S476 PolarHBondContact N-O 3.38Å; D474-S476 VanDerWaalsContact CG-OG 3.32Å; D474-S476 PolarHBondContact O-N 3.04Å; D474-S476 VanDerWaalsContact O-N 3.11Å; D474-S476 WeakPolarHBondContact OD1-CB 3.37Å; D474-S476 PolarHBondContact OD1-N 3.39Å; D474-S476 PolarHBondContact OD1-OG 3.3Å; S476-I498 WeakPolarHBondContact O-CD1 2.84Å
477	I	98	Very high	95.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	141.3	161.7	-51.1	166.4	0	0	0	107.2	S470 I490 F491 I498 M501 L508 S510	S470-I477 CarbonylContact O-C 3.48Å; S470-I477 WeakPolarHBondContact O-CA 3.47Å; S470-I477 WeakPolarHBondContact O-CG2 3.37Å; I477-I490 CarbonylContact O-C 3.53Å; I477-I490 WeakPolarHBondContact O-CA 3.4Å; I477-F491 HydrophobicContact CB-CB 4.03Å; I477-F491 HydrophobicContact CB-CD2 3.88Å; I477-F491 HydrophobicContact CB-CG 4.28Å; I477-F491 HydrophobicContact CG2-CD2 3.92Å; I477-F491 HydrophobicContact CG2-CE2 4.4Å; I477-F491 PolarHBondContact N-O 3.44Å; I477-F491 WeakPolarHBondContact O-CD2 3.44Å; I477-F491 PolarHBondContact O-N 2.87Å; I477-I498 HydrophobicContact CB-CD1 4.46Å; I477-I498 HydrophobicContact CD1-CD1 4.45Å; I477-I498 HydrophobicContact CG1-CD1 3.44Å; I477-I498 VanDerWaalsContact CG1-CD1 3.44Å; I477-I498 HydrophobicContact CG1-CG1 4.1Å; I477-I498 HydrophobicContact CG1-CG2 4.39Å; I477-M501 HydrophobicContact CB-SD 4.35Å; I477-M501 HydrophobicContact CD1-SD 4Å; I477-M501 HydrophobicContact CG1-SD 3.91Å; I477-M501 HydrophobicContact CG2-CE 4.45Å; I477-M501 HydrophobicContact CG2-SD 3.57Å; I477-M501 VanDerWaalsContact CG2-SD 3.57Å; I477-L508 HydrophobicContact CD1-CD2 4.09Å; I477-L508 HydrophobicContact CG2-CD2 4.02Å; I477-S510 VanDerWaalsContact CD1-CB 3.48Å
478	R	97.7	Very high	95.7	Very high	41 Å²	41	41 Å²	41	16%	0.155	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140.3	177.9	-68	-176.9	179	-131.2	4.2	111.1	G451 H452 L469 S470 W480 R489 I490	G451-R478 PolarHBondContact O-NH1 2.7Å; G451-R478 PolarHBondContact O-NH2 3.41Å; H452-R478 VanDerWaalsContact CE1-CD 3.45Å; H452-R478 WeakPolarHBondContact CE1-CD 3.46Å; L469-R478 CarbonylContact C-O 3.6Å; L469-R478 VanDerWaalsContact CA-O 3.29Å; L469-R478 WeakPolarHBondContact CA-O 3.37Å; S470-R478 PolarHBondContact N-O 3.01Å; S470-R478 PolarHBondContact O-N 3.36Å; R478-W480 HydrophobicContact CB-CZ2 3.82Å; R478-W480 VanDerWaalsContact CD-CZ2 3.4Å; R478-W480 HydrophobicContact CG-CZ2 4.26Å; R478-R489 WeakPolarHBondContact CA-O 3.49Å; R478-I490 HydrophobicContact CG-CG1 4.27Å; R478-I490 HydrophobicContact CG-CG2 4.49Å
479	Y	97.6	Very high	95.6	Very high	53 Å²	53	45.4 Å²	45.4	21%	0.208	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.1	169.1	-171.1	-75.6	0	0	0	108.6	F467 L469 C487 T488 R489 V522	F467-Y479 HydrophobicContact CB-CD1 4.5Å; F467-Y479 HydrophobicContact CB-CE1 3.66Å; F467-Y479 HydrophobicContact CB-CE2 3.9Å; F467-Y479 WeakPolarHBondContact CB-OH 3.35Å; F467-Y479 HydrophobicContact CD1-CE2 4.19Å; F467-Y479 WeakPolarHBondContact CD1-OH 3.46Å; F467-Y479 HydrophobicContact CD2-CD2 4.3Å; F467-Y479 AromaticContact CD2-CE2 3.71Å; F467-Y479 HydrophobicContact CD2-CE2 3.71Å; F467-Y479 HydrophobicContact CE2-CE2 4.32Å; F467-Y479 HydrophobicContact CG-CE1 4.35Å; F467-Y479 AromaticContact CG-CE2 3.66Å; F467-Y479 HydrophobicContact CG-CE2 3.66Å; F467-Y479 AromaticContact CG-CZ 3.53Å; F467-Y479 WeakPolarHBondContact CG-OH 3.26Å; L469-Y479 HydrophobicContact CD2-CD2 3.69Å; L469-Y479 HydrophobicContact CD2-CG 4.24Å; Y479-C487 CarbonylContact O-C 3.57Å; Y479-C487 WeakPolarHBondContact O-CA 3.3Å; Y479-T488 PolarHBondContact O-N 2.9Å; Y479-R489 PolarHBondContact N-O 3.38Å; Y479-R489 PolarHBondContact O-N 3.37Å; Y479-V522 HydrophobicContact CD2-CG1 3.76Å; Y479-V522 HydrophobicContact CE2-CG1 3.55Å
480	W	97.1	Very high	95.5	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.015	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.7	178.7	-47	85.4	0	0	0	110.5	F449 R450 H452 F467 L468 S470 R478 V486 C487	F449-W480 HydrophobicContact CB-CD2 3.95Å; F449-W480 HydrophobicContact CB-CE3 3.87Å; F449-W480 HydrophobicContact CB-CG 4.46Å; F449-W480 HydrophobicContact CB-CH2 4.43Å; F449-W480 HydrophobicContact CB-CZ2 4.49Å; F449-W480 HydrophobicContact CB-CZ3 4.11Å; F449-W480 HydrophobicContact CD1-CB 3.46Å; F449-W480 VanDerWaalsContact CD1-CB 3.46Å; F449-W480 AromaticContact CD1-CD2 3.81Å; F449-W480 HydrophobicContact CD1-CD2 3.81Å; F449-W480 AromaticContact CD1-CE3 3.78Å; F449-W480 HydrophobicContact CD1-CE3 3.78Å; F449-W480 AromaticContact CD1-CG 3.69Å; F449-W480 HydrophobicContact CD1-CG 3.69Å; F449-W480 HydrophobicContact CE1-CB 3.61Å; F449-W480 HydrophobicContact CE1-CG 4.32Å; F449-W480 HydrophobicContact CG-CB 4.47Å; F449-W480 HydrophobicContact CG-CD2 4.27Å; F449-W480 HydrophobicContact CG-CE3 4.32Å; F449-W480 HydrophobicContact CG-CG 4.33Å; R450-W480 WeakPolarHBondContact O-CH2 3.18Å; R450-W480 WeakPolarHBondContact O-CZ3 3.42Å; H452-W480 AromaticContact CD2-CZ2 3.98Å; F467-W480 WeakPolarHBondContact CA-O 3.43Å; F467-W480 WeakPolarHBondContact CB-O 3.37Å; L468-W480 HydrophobicContact CB-CB 4.26Å; L468-W480 PolarHBondContact N-O 2.73Å; L468-W480 PolarHBondContact O-N 3.05Å; S470-W480 PolarHBondContact OG-NE1 2.7Å; R478-W480 HydrophobicContact CB-CZ2 3.82Å; R478-W480 VanDerWaalsContact CD-CZ2 3.4Å; R478-W480 HydrophobicContact CG-CZ2 4.26Å; W480-V486 WeakPolarHBondContact CA-O 3.49Å; W480-C487 HydrophobicContact CD2-CB 4.25Å; W480-C487 HydrophobicContact CE3-CB 3.62Å; W480-C487 HydrophobicContact CH2-CB 4Å; W480-C487 HydrophobicContact CZ3-CB 3.49Å; W480-C487 VanDerWaalsContact CZ3-CB 3.49Å
481	D	95.1	Very high	95.5	Very high	42 Å²	42	50 Å²	50	23%	0.225	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.4	165.9	169.1	52.9	0	0	0	109.8	F449 N466 K483 S484 G485 V486	F449-D481 WeakPolarHBondContact CE1-O 3.33Å; N466-D481 PolarHBondContact ND2-OD1 2.78Å; D481-K483 VanDerWaalsContact C-N 3.26Å; D481-K483 PolarHBondContact O-N 2.84Å; D481-S484 WeakPolarHBondContact CB-OG 3.4Å; D481-S484 WeakPolarHBondContact OD2-CB 3.37Å; D481-S484 PolarHBondContact OD2-N 2.81Å; D481-S484 PolarHBondContact OD2-OG 3.4Å; D481-G485 WeakPolarHBondContact O-CA 3.3Å; D481-G485 PolarHBondContact O-N 3.05Å; D481-V486 PolarHBondContact N-O 3.36Å
482	L	93.6	Very high	95.4	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.042	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29	-174.3	-81.4	176.7	0	0	0	113.4	L436 F449 L461 C462 N466 F467 L468	L436-L482 HydrophobicContact CD1-CD2 3.84Å; L436-L482 HydrophobicContact CD2-CD2 4.09Å; F449-L482 HydrophobicContact CZ-CD2 3.89Å; L461-L482 HydrophobicContact CD1-CD1 3.63Å; L461-L482 HydrophobicContact CD1-CD2 3.58Å; L461-L482 HydrophobicContact CD1-CG 4.24Å; C462-L482 WeakPolarHBondContact O-CD1 3.28Å; N466-L482 WeakPolarHBondContact O-CB 3.26Å; N466-L482 PolarHBondContact O-N 3.38Å; F467-L482 WeakPolarHBondContact O-CD1 3.27Å; L468-L482 HydrophobicContact CB-CD2 3.8Å; L468-L482 HydrophobicContact CB-CG 4.44Å
483	K	90.7	Very high	95.3	Very high	159 Å²	159	54.4 Å²	54.4	69%	0.691	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-49.7	-176.7	-76.4	171.5	-172.3	177	0	112.1	N466 D481	N466-K483 WeakPolarHBondContact ND2-CD 3.29Å; N466-K483 WeakPolarHBondContact ND2-CG 3.47Å; N466-K483 WeakPolarHBondContact OD1-CE 3.35Å; N466-K483 WeakPolarHBondContact OD1-CG 3.4Å; D481-K483 VanDerWaalsContact C-N 3.26Å; D481-K483 PolarHBondContact O-N 2.84Å
484	S	91.4	Very high	95.3	Very high	69 Å²	69	47.8 Å²	47.8	48%	0.483	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-21.7	-175.1	64.4	0	0	0	0	113.7	D481 V486	D481-S484 WeakPolarHBondContact CB-OG 3.4Å; D481-S484 WeakPolarHBondContact OD2-CB 3.37Å; D481-S484 PolarHBondContact OD2-N 2.81Å; D481-S484 PolarHBondContact OD2-OG 3.4Å; S484-V486 PolarHBondContact O-N 2.65Å; S484-V486 WeakPolarHBondContact OG-CB 3.43Å; S484-V486 PolarHBondContact OG-N 3.49Å
485	G	92.4	Very high	95.3	Very high	10 Å²	10	53 Å²	53	10%	0.103	30%	0.295	C	S	.	.			trans	76.7	3	-172.2	0	0	0	0	0	114	D481	D481-G485 WeakPolarHBondContact O-CA 3.3Å; D481-G485 PolarHBondContact O-N 3.05Å
486	V	94.9	Very high	95.3	Very high	88 Å²	88	50.3 Å²	50.3	53%	0.533	28%	0.283	S	S	.	.			trans	-81.3	138.9	-174.3	177.7	0	0	0	0	110.8	W480 D481 S484 T488	W480-V486 WeakPolarHBondContact CA-O 3.49Å; D481-V486 PolarHBondContact N-O 3.36Å; S484-V486 PolarHBondContact O-N 2.65Å; S484-V486 WeakPolarHBondContact OG-CB 3.43Å; S484-V486 PolarHBondContact OG-N 3.49Å; V486-T488 PolarHBondContact O-N 2.86Å
487	C	95.6	Very high	95.3	Very high	36 Å²	36	50 Å²	50	24%	0.243	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	103.9	171.3	-170.3	0	0	0	0	109.4	Y479 W480 R489	Y479-C487 CarbonylContact O-C 3.57Å; Y479-C487 WeakPolarHBondContact O-CA 3.3Å; W480-C487 HydrophobicContact CD2-CB 4.25Å; W480-C487 HydrophobicContact CE3-CB 3.62Å; W480-C487 HydrophobicContact CH2-CB 4Å; W480-C487 HydrophobicContact CZ3-CB 3.49Å; W480-C487 VanDerWaalsContact CZ3-CB 3.49Å; C487-R489 PolarHBondContact SG-O 3.39Å
488	T	94.8	Very high	95.3	Very high	91 Å²	91	50 Å²	50	56%	0.558	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	-27.5	-179	-21.8	0	0	0	0	112.1	Y479 V486	Y479-T488 PolarHBondContact O-N 2.9Å; V486-T488 PolarHBondContact O-N 2.86Å
489	R	95.3	Very high	95.2	Very high	92 Å²	92	49.5 Å²	49.5	35%	0.347	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.9	-176.6	-160	175.3	-62.6	-102.1	-1.7	113.1	R478 Y479 C487 D523 T524	R478-R489 WeakPolarHBondContact CA-O 3.49Å; Y479-R489 PolarHBondContact N-O 3.38Å; Y479-R489 PolarHBondContact O-N 3.37Å; C487-R489 PolarHBondContact SG-O 3.39Å; R489-D523 PolarHBondContact NH1-O 3.35Å; R489-D523 PolarHBondContact NH2-O 3.06Å; R489-T524 PolarHBondContact NH1-O 2.87Å
490	I	96.4	Very high	95.1	Very high	94 Å²	94	47.7 Å²	47.7	48%	0.482	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.7	172.9	-52.4	-178.2	0	0	0	108.5	I477 R478	I477-I490 CarbonylContact O-C 3.53Å; I477-I490 WeakPolarHBondContact O-CA 3.4Å; R478-I490 HydrophobicContact CG-CG1 4.27Å; R478-I490 HydrophobicContact CG-CG2 4.49Å
491	F	97.1	Very high	95.1	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	107.9	173.5	-47.7	-107.2	0	0	0	108.5	L469 I477 W520	L469-F491 HydrophobicContact CD2-CE2 3.89Å; L469-F491 HydrophobicContact CD2-CZ 4.3Å; I477-F491 HydrophobicContact CB-CB 4.03Å; I477-F491 HydrophobicContact CB-CD2 3.88Å; I477-F491 HydrophobicContact CB-CG 4.28Å; I477-F491 HydrophobicContact CG2-CD2 3.92Å; I477-F491 HydrophobicContact CG2-CE2 4.4Å; I477-F491 PolarHBondContact N-O 3.44Å; I477-F491 WeakPolarHBondContact O-CD2 3.44Å; I477-F491 PolarHBondContact O-N 2.87Å; F491-W520 HydrophobicContact CB-CD2 4.28Å; F491-W520 HydrophobicContact CB-CE3 3.95Å; F491-W520 HydrophobicContact CB-CH2 4.5Å; F491-W520 HydrophobicContact CB-CZ3 4.07Å; F491-W520 HydrophobicContact CD1-CB 3.99Å; F491-W520 HydrophobicContact CD1-CD2 4.25Å; F491-W520 HydrophobicContact CD1-CE3 4.05Å; F491-W520 HydrophobicContact CD1-CG 4.24Å; F491-W520 HydrophobicContact CE1-CB 4.2Å; F491-W520 HydrophobicContact CG-CE3 4.5Å
492	G	94.3	Very high	95.1	Very high	60 Å²	60	47.1 Å²	47.1	62%	0.619	27%	0.274	S	S	*	.			trans	-100.3	139.6	175.6	0	0	0	0	0	111.5	W520	G492-W520 WeakPolarHBondContact O-CH2 3.27Å; G492-W520 WeakPolarHBondContact O-CZ3 3.35Å
493	G	93.4	Very high	95.2	Very high	33 Å²	33	48 Å²	48	34%	0.34	28%	0.279	S	S	.	.			trans	154.1	-18.3	170.9	0	0	0	0	0	115.5	K518	G493-K518 WeakPolarHBondContact O-CE 3.19Å
494	H	96.4	Very high	95.3	Very high	5 Å²	5	41.8 Å²	41.8	2%	0.023	26%	0.255	C	S	.	.			trans	-68.1	147.1	166.4	-86	-68.8	0	0	0	110.7	I498 S510 D514 W520	H494-I498 HydrophobicContact CB-CG1 4.4Å; H494-S510 PolarHBondContact CD2-OG 2.8Å; H494-S510 PolarHBondContact NE2-OG 2.68Å; H494-D514 WeakPolarHBondContact CA-OD2 3.04Å; H494-D514 IonicContact CE1-OD1 3.5Å; H494-D514 IonicContact CE1-OD2 3.82Å; H494-D514 IonicContact CG-OD2 3.22Å; H494-D514 IonicContact ND1-OD1 2.86Å; H494-D514 PolarHBondContact ND1-OD1 2.89Å; H494-D514 IonicContact ND1-OD2 3.91Å; H494-D514 PolarHBondContact ND1-OD2 2.96Å; H494-W520 AromaticContact CD2-CZ2 3.77Å
495	Q	96.7	Very high	95.3	Very high	145 Å²	145	45.5 Å²	45.5	68%	0.678	26%	0.263	S	S	*	.	S	Bend	trans	-110.7	8.5	177.2	-60	-59.7	-41.1	0	0	112	D514	Q495-D514 HydrophobicContact CB-CB 4.12Å; Q495-D514 PolarHBondContact N-OD2 2.97Å
496	G	96	Very high	95.3	Very high	9 Å²	9	47.5 Å²	47.5	9%	0.093	27%	0.271	C	S	.	.	S	Bend	trans	-146.5	162.8	-179.2	0	0	0	0	0	110.3	L475 I498	L475-G496 WeakPolarHBondContact CD2-O 3.08Å; G496-I498 PolarHBondContact O-N 2.94Å
497	T	96.3	Very high	95.4	Very high	10 Å²	10	48.3 Å²	48.3	6%	0.061	26%	0.264	C	S	.	.			trans	-50.1	130.5	177.2	-56.5	0	0	0	0	110.9	R457 Y473 T499 G512 R513	R457-T497 HydrophobicContact CB-CG2 4.44Å; R457-T497 HydrophobicContact CG-CG2 3.97Å; Y473-T497 HydrophobicContact CD2-CG2 3.9Å; Y473-T497 WeakPolarHBondContact CD2-OG1 3.33Å; Y473-T497 VanDerWaalsContact CE2-OG1 3.29Å; Y473-T497 WeakPolarHBondContact CE2-OG1 3Å; T497-T499 PolarHBondContact O-N 3.08Å; T497-G512 CarbonylContact O-C 3.47Å; T497-G512 VanDerWaalsContact O-CA 3.26Å; T497-G512 WeakPolarHBondContact O-CA 3.36Å; T497-R513 PolarHBondContact O-N 3.38Å
498	I	97.8	Very high	95.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	122.1	172.9	-62.5	139.6	0	0	0	107.9	R457 A458 S472 S476 I477 H494 G496 M501	R457-I498 VanDerWaalsContact CB-O 3.23Å; R457-I498 WeakPolarHBondContact CB-O 3.41Å; A458-I498 HydrophobicContact CB-CG2 4.42Å; S472-I498 PolarHBondContact O-N 3.39Å; S476-I498 WeakPolarHBondContact O-CD1 2.84Å; I477-I498 HydrophobicContact CB-CD1 4.46Å; I477-I498 HydrophobicContact CD1-CD1 4.45Å; I477-I498 HydrophobicContact CG1-CD1 3.44Å; I477-I498 VanDerWaalsContact CG1-CD1 3.44Å; I477-I498 HydrophobicContact CG1-CG1 4.1Å; I477-I498 HydrophobicContact CG1-CG2 4.39Å; H494-I498 HydrophobicContact CB-CG1 4.4Å; G496-I498 PolarHBondContact O-N 2.94Å; I498-M501 HydrophobicContact CG2-CG 3.81Å; I498-M501 HydrophobicContact CG2-SD 4.09Å
499	T	95.7	Very high	95.6	Very high	30 Å²	30	42.2 Å²	42.2	18%	0.184	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-30.6	-172.7	49.6	0	0	0	0	112.8	T497 G511 R513 I537	T497-T499 PolarHBondContact O-N 3.08Å; T499-G511 PolarHBondContact N-O 3.01Å; T499-G511 PolarHBondContact OG1-O 3.37Å; T499-G511 VanDerWaalsContact OG1-O 3.12Å; T499-R513 HydrophobicContact CG2-CG 3.73Å; T499-I537 WeakPolarHBondContact CB-O 3.42Å; T499-I537 PolarHBondContact OG1-O 3.21Å
500	C	95.6	Very high	95.7	Very high	15 Å²	15	37.9 Å²	37.9	10%	0.101	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	152.8	-178.7	50.6	0	0	0	0	110.8	S510 G511 L538 A539 T540	C500-S510 WeakPolarHBondContact O-CA 3.46Å; C500-G511 PolarHBondContact N-O 3.31Å; C500-G511 PolarHBondContact O-N 3.25Å; C500-L538 WeakPolarHBondContact CB-O 3.49Å; C500-L538 PolarHBondContact SG-O 2.69Å; C500-A539 VanDerWaalsContact SG-C 3.52Å; C500-A539 VanDerWaalsContact SG-CA 3.51Å; C500-T540 HydrophobicContact CB-CG2 4.29Å; C500-T540 PolarHBondContact SG-N 2.94Å; C500-T540 VanDerWaalsContact SG-N 3.44Å
501	M	97.2	Very high	95.8	Very high	18 Å²	18	33.4 Å²	33.4	9%	0.089	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	152.7	175.7	-62.3	-173.7	-48.9	0	0	109.8	A458 L469 G471 I477 I498 L508 V509	A458-M501 HydrophobicContact CB-CB 4.27Å; A458-M501 HydrophobicContact CB-CE 3.86Å; A458-M501 HydrophobicContact CB-CG 3.82Å; A458-M501 HydrophobicContact CB-SD 4.34Å; L469-M501 HydrophobicContact CB-CE 4.22Å; G471-M501 VanDerWaalsContact N-CE 3.28Å; I477-M501 HydrophobicContact CB-SD 4.35Å; I477-M501 HydrophobicContact CD1-SD 4Å; I477-M501 HydrophobicContact CG1-SD 3.91Å; I477-M501 HydrophobicContact CG2-CE 4.45Å; I477-M501 HydrophobicContact CG2-SD 3.57Å; I477-M501 VanDerWaalsContact CG2-SD 3.57Å; I498-M501 HydrophobicContact CG2-CG 3.81Å; I498-M501 HydrophobicContact CG2-SD 4.09Å; M501-L508 HydrophobicContact CB-CD1 4.17Å; M501-V509 CarbonylContact C-O 3.26Å; M501-V509 WeakPolarHBondContact CA-O 3.28Å
502	D	96.3	Very high	95.8	Very high	15 Å²	15	33.3 Å²	33.3	8%	0.08	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	152	172.9	-163.3	34.6	0	0	0	109.4	L508 V509 R541 I542	D502-L508 WeakPolarHBondContact O-CD1 3.44Å; D502-V509 PolarHBondContact N-O 2.91Å; D502-V509 PolarHBondContact O-N 2.87Å; D502-R541 IonicContact OD1-NH1 3.92Å; D502-R541 PolarHBondContact OD1-NH1 3.34Å; D502-R541 WeakPolarHBondContact OD2-CA 3.41Å; D502-R541 WeakPolarHBondContact OD2-CD 3.49Å; D502-I542 HydrophobicContact CB-CG2 4.04Å; D502-I542 PolarHBondContact OD2-N 2.66Å
503	L	94.7	Very high	95.9	Very high	26 Å²	26	37.2 Å²	37.2	14%	0.136	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.8	-174.9	-176.7	77.4	0	0	0	110.4	F460 F467 L469 L508 V522	F460-L503 HydrophobicContact CD1-CB 4Å; F460-L503 HydrophobicContact CD1-CD2 4.05Å; F460-L503 HydrophobicContact CD2-CB 4.13Å; F460-L503 HydrophobicContact CE1-CB 3.65Å; F460-L503 HydrophobicContact CE1-CD2 3.49Å; F460-L503 VanDerWaalsContact CE1-CD2 3.49Å; F460-L503 HydrophobicContact CE1-CG 4.2Å; F460-L503 HydrophobicContact CE2-CB 3.76Å; F460-L503 HydrophobicContact CG-CB 4.25Å; F460-L503 HydrophobicContact CZ-CB 3.53Å; F460-L503 HydrophobicContact CZ-CD2 4.05Å; F460-L503 HydrophobicContact CZ-CG 4.38Å; F467-L503 HydrophobicContact CE2-CD2 4.07Å; F467-L503 HydrophobicContact CZ-CD2 3.58Å; L469-L503 HydrophobicContact CD1-CD1 4.38Å; L503-L508 HydrophobicContact CD1-CB 3.98Å; L503-V522 HydrophobicContact CD1-CG2 3.6Å
504	C	94	Very high	96.1	Very high	29 Å²	29	36.8 Å²	36.8	20%	0.196	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	118.9	167.3	-176.3	0	0	0	0	109.1	N506 R507 I542	C504-N506 PolarHBondContact O-N 3.45Å; C504-R507 PolarHBondContact N-O 3.06Å; C504-R507 PolarHBondContact O-N 3.48Å; C504-I542 HydrophobicContact CB-CB 4.41Å; C504-I542 HydrophobicContact CB-CD1 4.36Å; C504-I542 HydrophobicContact CB-CG1 3.98Å; C504-I542 HydrophobicContact CB-CG2 3.76Å
505	K	90.8	Very high	96.1	Very high	147 Å²	147	37.9 Å²	37.9	64%	0.639	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	-131.2	-172	-57.9	173.4	176.8	160	0	109.6	R507 D544	K505-R507 VanDerWaalsContact C-N 3.27Å; K505-R507 PolarHBondContact O-N 2.79Å; K505-D544 WeakPolarHBondContact CD-OD1 3.29Å; K505-D544 WeakPolarHBondContact CE-OD1 3.44Å; K505-D544 IonicContact NZ-OD1 3.98Å; K505-D544 PolarHBondContact NZ-OD1 3.41Å; K505-D544 IonicContact NZ-OD2 3.04Å; K505-D544 PolarHBondContact NZ-OD2 3.3Å
506	N	93	Very high	96.1	Very high	52 Å²	52	32.9 Å²	32.9	28%	0.278	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	10.2	178.3	-159.9	27.1	0	0	0	114.6	C504 V522 D523	C504-N506 PolarHBondContact O-N 3.45Å; N506-V522 PolarHBondContact O-N 3.16Å; N506-V522 VanDerWaalsContact O-N 3.1Å; N506-V522 WeakPolarHBondContact OD1-CB 3.48Å; N506-D523 VanDerWaalsContact CG-OD2 3.28Å; N506-D523 PolarHBondContact ND2-OD2 3.39Å; N506-D523 PolarHBondContact OD1-N 2.89Å; N506-D523 PolarHBondContact OD1-OD2 3.09Å
507	R	95.6	Very high	96.2	Very high	105 Å²	105	32.5 Å²	32.5	40%	0.396	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	111.3	-175.8	-65.7	-179.7	-176.2	161.7	2.8	110.7	C504 K505 V519 W520 I542	C504-R507 PolarHBondContact N-O 3.06Å; C504-R507 PolarHBondContact O-N 3.48Å; K505-R507 VanDerWaalsContact C-N 3.27Å; K505-R507 PolarHBondContact O-N 2.79Å; R507-V519 HydrophobicContact CB-CG1 4.37Å; R507-W520 WeakPolarHBondContact CA-O 3.39Å; R507-I542 HydrophobicContact CB-CD1 3.98Å
508	L	97.4	Very high	96.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.9	171.3	171.6	66.2	0	0	0	109.5	L469 I477 M501 D502 L503 V519 W520 V522	L469-L508 HydrophobicContact CD1-CD1 3.83Å; L469-L508 HydrophobicContact CD1-CD2 4.09Å; L469-L508 HydrophobicContact CD1-CG 4.41Å; L469-L508 HydrophobicContact CD2-CD2 4.39Å; I477-L508 HydrophobicContact CD1-CD2 4.09Å; I477-L508 HydrophobicContact CG2-CD2 4.02Å; M501-L508 HydrophobicContact CB-CD1 4.17Å; D502-L508 WeakPolarHBondContact O-CD1 3.44Å; L503-L508 HydrophobicContact CD1-CB 3.98Å; L508-V519 CarbonylContact O-C 3.54Å; L508-V519 WeakPolarHBondContact O-CA 3.35Å; L508-W520 HydrophobicContact CB-CB 4.24Å; L508-W520 HydrophobicContact CD2-CG 4.5Å; L508-W520 PolarHBondContact N-O 2.75Å; L508-W520 PolarHBondContact O-N 2.81Å; L508-V522 HydrophobicContact CB-CG2 3.74Å
509	V	97.9	Very high	96.2	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.5	169.3	179.9	0	0	0	0	109.4	M501 D502 V517 K518 V519 T540 I542 I547	M501-V509 CarbonylContact C-O 3.26Å; M501-V509 WeakPolarHBondContact CA-O 3.28Å; D502-V509 PolarHBondContact N-O 2.91Å; D502-V509 PolarHBondContact O-N 2.87Å; V509-V517 HydrophobicContact CG1-CG1 3.46Å; V509-V517 VanDerWaalsContact CG1-CG1 3.46Å; V509-K518 WeakPolarHBondContact CA-O 3.29Å; V509-V519 HydrophobicContact CG2-CG1 4.44Å; V509-V519 HydrophobicContact CG2-CG2 4.19Å; V509-T540 HydrophobicContact CG1-CG2 3.88Å; V509-T540 WeakPolarHBondContact CG1-OG1 3.39Å; V509-I542 HydrophobicContact CB-CB 4.29Å; V509-I542 HydrophobicContact CB-CG2 4.34Å; V509-I542 HydrophobicContact CG2-CB 3.7Å; V509-I542 HydrophobicContact CG2-CD1 3.34Å; V509-I542 HydrophobicContact CG2-CG1 3.98Å; V509-I542 HydrophobicContact CG2-CG2 4.04Å; V509-I547 HydrophobicContact CG1-CG2 4.01Å; V509-I547 HydrophobicContact CG2-CD1 3.81Å; V509-I547 HydrophobicContact CG2-CG1 4.02Å
510	S	98	Very high	96.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140.3	175.8	60.5	0	0	0	0	111.5	I477 H494 C500 V517 K518 W520	I477-S510 VanDerWaalsContact CD1-CB 3.48Å; H494-S510 PolarHBondContact CD2-OG 2.8Å; H494-S510 PolarHBondContact NE2-OG 2.68Å; C500-S510 WeakPolarHBondContact O-CA 3.46Å; S510-V517 CarbonylContact O-C 3.57Å; S510-V517 VanDerWaalsContact O-CA 3.25Å; S510-V517 WeakPolarHBondContact O-CA 3.16Å; S510-K518 PolarHBondContact N-O 3.37Å; S510-K518 PolarHBondContact O-N 2.86Å; S510-W520 PolarHBondContact OG-NE1 3.12Å
511	G	97.5	Very high	96.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.4	170.4	0	0	0	0	0	110.8	T499 C500	T499-G511 PolarHBondContact N-O 3.01Å; T499-G511 PolarHBondContact OG1-O 3.37Å; T499-G511 VanDerWaalsContact OG1-O 3.12Å; C500-G511 PolarHBondContact N-O 3.31Å; C500-G511 PolarHBondContact O-N 3.25Å
512	G	96.4	Very high	96.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	167.3	-179.8	0	0	0	0	0	114.8	T497 D514 C515 Q516 I537	T497-G512 CarbonylContact O-C 3.47Å; T497-G512 VanDerWaalsContact O-CA 3.26Å; T497-G512 WeakPolarHBondContact O-CA 3.36Å; G512-D514 WeakPolarHBondContact CA-OD1 3.23Å; G512-D514 PolarHBondContact O-N 2.79Å; G512-C515 PolarHBondContact O-N 2.83Å; G512-Q516 PolarHBondContact N-O 2.83Å; G512-Q516 VanDerWaalsContact N-O 3.11Å; G512-I537 PolarHBondContact O-N 2.86Å
513	R	97	Very high	96	Very high	142 Å²	142	36.4 Å²	36.4	54%	0.536	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-5	168.1	-71.5	-165.2	172.2	-163.1	-5.1	113.9	T497 T499 C515 P536	T497-R513 PolarHBondContact O-N 3.38Å; T499-R513 HydrophobicContact CG2-CG 3.73Å; R513-C515 PolarHBondContact O-N 3.46Å; R513-P536 HydrophobicContact CG-CB 4.46Å
514	D	96.8	Very high	95.9	Very high	25 Å²	25	38.4 Å²	38.4	13%	0.134	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	11.1	169.6	59.1	-1.3	0	0	0	113.4	H494 Q495 G512 Q516	H494-D514 WeakPolarHBondContact CA-OD2 3.04Å; H494-D514 IonicContact CE1-OD1 3.5Å; H494-D514 IonicContact CE1-OD2 3.82Å; H494-D514 IonicContact CG-OD2 3.22Å; H494-D514 IonicContact ND1-OD1 2.86Å; H494-D514 PolarHBondContact ND1-OD1 2.89Å; H494-D514 IonicContact ND1-OD2 3.91Å; H494-D514 PolarHBondContact ND1-OD2 2.96Å; Q495-D514 HydrophobicContact CB-CB 4.12Å; Q495-D514 PolarHBondContact N-OD2 2.97Å; G512-D514 WeakPolarHBondContact CA-OD1 3.23Å; G512-D514 PolarHBondContact O-N 2.79Å; D514-Q516 PolarHBondContact O-N 2.97Å; D514-Q516 PolarHBondContact OD1-N 3.15Å
515	C	96.9	Very high	95.8	Very high	28 Å²	28	37.8 Å²	37.8	19%	0.189	18%	0.183	C	C	.	.	S	Bend	trans	60.9	20.7	-178.1	-48	0	0	0	0	113.1	G512 R513 H533 D535 P536	G512-C515 PolarHBondContact O-N 2.83Å; R513-C515 PolarHBondContact O-N 3.46Å; C515-H533 WeakPolarHBondContact CB-O 3.45Å; C515-H533 PolarHBondContact O-N 2.89Å; C515-D535 WeakPolarHBondContact CB-O 3.39Å; C515-P536 VanDerWaalsContact SG-N 3.41Å
516	Q	97.1	Very high	96.1	Very high	40 Å²	40	37.7 Å²	37.7	19%	0.187	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144.3	-179.3	-66.2	176.8	37.5	0	0	111.4	G512 D514 T530 F531	G512-Q516 PolarHBondContact N-O 2.83Å; G512-Q516 VanDerWaalsContact N-O 3.11Å; D514-Q516 PolarHBondContact O-N 2.97Å; D514-Q516 PolarHBondContact OD1-N 3.15Å; Q516-T530 HydrophobicContact CB-CG2 4.23Å; Q516-T530 HydrophobicContact CG-CG2 4.15Å; Q516-T530 VanDerWaalsContact OE1-CG2 3.31Å; Q516-F531 WeakPolarHBondContact CA-O 3.2Å
517	V	97.6	Very high	96.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.2	164	-178.6	0	0	0	0	107.2	V509 S510 T530 F531 I537 I547	V509-V517 HydrophobicContact CG1-CG1 3.46Å; V509-V517 VanDerWaalsContact CG1-CG1 3.46Å; S510-V517 CarbonylContact O-C 3.57Å; S510-V517 VanDerWaalsContact O-CA 3.25Å; S510-V517 WeakPolarHBondContact O-CA 3.16Å; V517-T530 CarbonylContact O-C 3.6Å; V517-T530 WeakPolarHBondContact O-CA 3.22Å; V517-F531 HydrophobicContact CB-CB 4.26Å; V517-F531 PolarHBondContact N-O 2.84Å; V517-F531 PolarHBondContact O-N 3.03Å; V517-I537 HydrophobicContact CG2-CD1 3.85Å; V517-I537 HydrophobicContact CG2-CG1 3.81Å; V517-I537 HydrophobicContact CG2-CG2 4.13Å; V517-I547 HydrophobicContact CG1-CG2 4.13Å
518	K	97.4	Very high	96.2	Very high	19 Å²	19	37 Å²	37	8%	0.083	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.8	-179.5	-68.3	-177.5	-179.2	-71.4	0	110.3	G493 V509 S510 W520 K529 T530	G493-K518 WeakPolarHBondContact O-CE 3.19Å; V509-K518 WeakPolarHBondContact CA-O 3.29Å; S510-K518 PolarHBondContact N-O 3.37Å; S510-K518 PolarHBondContact O-N 2.86Å; K518-W520 HydrophobicContact CB-CZ2 3.71Å; K518-W520 HydrophobicContact CD-CH2 3.87Å; K518-W520 HydrophobicContact CD-CZ2 3.42Å; K518-W520 VanDerWaalsContact CD-CZ2 3.42Å; K518-W520 HydrophobicContact CG-CZ2 4.19Å; K518-K529 WeakPolarHBondContact CA-O 3.44Å; K518-T530 HydrophobicContact CG-CG2 4.3Å; K518-T530 PolarHBondContact NZ-OG1 2.9Å
519	V	97.5	Very high	96.1	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	128	172.4	-171.6	0	0	0	0	107.5	R507 L508 V509 C527 L528 K529 F531 I547	R507-V519 HydrophobicContact CB-CG1 4.37Å; L508-V519 CarbonylContact O-C 3.54Å; L508-V519 WeakPolarHBondContact O-CA 3.35Å; V509-V519 HydrophobicContact CG2-CG1 4.44Å; V509-V519 HydrophobicContact CG2-CG2 4.19Å; V519-C527 CarbonylContact O-C 3.57Å; V519-L528 HydrophobicContact CG1-CD1 4.39Å; V519-L528 PolarHBondContact O-N 3.02Å; V519-K529 HydrophobicContact CB-CB 4.22Å; V519-K529 HydrophobicContact CG2-CB 4.15Å; V519-K529 PolarHBondContact N-O 3.08Å; V519-K529 PolarHBondContact O-N 3.06Å; V519-F531 HydrophobicContact CG2-CD2 4.39Å; V519-F531 HydrophobicContact CG2-CE2 3.72Å; V519-I547 HydrophobicContact CG2-CD1 3.41Å; V519-I547 VanDerWaalsContact CG2-CD1 3.41Å
520	W	97.5	Very high	96	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.8	-178.6	-45.8	84	0	0	0	109.7	F491 G492 H494 R507 L508 S510 K518 K526 C527	F491-W520 HydrophobicContact CB-CD2 4.28Å; F491-W520 HydrophobicContact CB-CE3 3.95Å; F491-W520 HydrophobicContact CB-CH2 4.5Å; F491-W520 HydrophobicContact CB-CZ3 4.07Å; F491-W520 HydrophobicContact CD1-CB 3.99Å; F491-W520 HydrophobicContact CD1-CD2 4.25Å; F491-W520 HydrophobicContact CD1-CE3 4.05Å; F491-W520 HydrophobicContact CD1-CG 4.24Å; F491-W520 HydrophobicContact CE1-CB 4.2Å; F491-W520 HydrophobicContact CG-CE3 4.5Å; G492-W520 WeakPolarHBondContact O-CH2 3.27Å; G492-W520 WeakPolarHBondContact O-CZ3 3.35Å; H494-W520 AromaticContact CD2-CZ2 3.77Å; R507-W520 WeakPolarHBondContact CA-O 3.39Å; L508-W520 HydrophobicContact CB-CB 4.24Å; L508-W520 HydrophobicContact CD2-CG 4.5Å; L508-W520 PolarHBondContact N-O 2.75Å; L508-W520 PolarHBondContact O-N 2.81Å; S510-W520 PolarHBondContact OG-NE1 3.12Å; K518-W520 HydrophobicContact CB-CZ2 3.71Å; K518-W520 HydrophobicContact CD-CH2 3.87Å; K518-W520 HydrophobicContact CD-CZ2 3.42Å; K518-W520 VanDerWaalsContact CD-CZ2 3.42Å; K518-W520 HydrophobicContact CG-CZ2 4.19Å; W520-K526 WeakPolarHBondContact CA-O 3.48Å; W520-C527 HydrophobicContact CD2-CB 4.4Å; W520-C527 HydrophobicContact CE3-CB 3.71Å; W520-C527 HydrophobicContact CH2-CB 4.19Å; W520-C527 HydrophobicContact CZ3-CB 3.6Å
521	D	96.1	Very high	95.9	Very high	33 Å²	33	43.3 Å²	43.3	18%	0.176	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	121.1	164.7	-179.6	-80.8	0	0	0	108	D523 T524 G525 K526 L528	D521-D523 PolarHBondContact OD1-N 3.09Å; D521-T524 VanDerWaalsContact CB-OG1 3.28Å; D521-T524 WeakPolarHBondContact CB-OG1 3.43Å; D521-T524 VanDerWaalsContact CG-OG1 3.22Å; D521-T524 VanDerWaalsContact OD1-CB 3.29Å; D521-T524 WeakPolarHBondContact OD1-CB 3.37Å; D521-T524 VanDerWaalsContact OD1-CG2 3.29Å; D521-T524 WeakPolarHBondContact OD1-CG2 3.11Å; D521-T524 PolarHBondContact OD1-N 3.41Å; D521-T524 PolarHBondContact OD1-OG1 2.7Å; D521-G525 WeakPolarHBondContact O-CA 3.4Å; D521-G525 PolarHBondContact O-N 2.94Å; D521-K526 PolarHBondContact N-O 3.34Å; D521-L528 HydrophobicContact CB-CD1 3.94Å; D521-L528 HydrophobicContact CB-CD2 3.98Å; D521-L528 HydrophobicContact CB-CG 3.92Å
522	V	94.8	Very high	95.7	Very high	9 Å²	9	52.2 Å²	52.2	6%	0.055	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-39.9	-171.9	175.5	0	0	0	0	111.2	Y479 L503 N506 L508	Y479-V522 HydrophobicContact CD2-CG1 3.76Å; Y479-V522 HydrophobicContact CE2-CG1 3.55Å; L503-V522 HydrophobicContact CD1-CG2 3.6Å; N506-V522 PolarHBondContact O-N 3.16Å; N506-V522 VanDerWaalsContact O-N 3.1Å; N506-V522 WeakPolarHBondContact OD1-CB 3.48Å; L508-V522 HydrophobicContact CB-CG2 3.74Å
523	D	92	Very high	95.6	Very high	106 Å²	106	53.1 Å²	53.1	57%	0.567	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-36.3	-179.5	-66.9	-31.9	0	0	0	113.9	R489 N506 D521	R489-D523 PolarHBondContact NH1-O 3.35Å; R489-D523 PolarHBondContact NH2-O 3.06Å; N506-D523 VanDerWaalsContact CG-OD2 3.28Å; N506-D523 PolarHBondContact ND2-OD2 3.39Å; N506-D523 PolarHBondContact OD1-N 2.89Å; N506-D523 PolarHBondContact OD1-OD2 3.09Å; D521-D523 PolarHBondContact OD1-N 3.09Å
524	T	93	Very high	95.5	Very high	68 Å²	68	55.5 Å²	55.5	42%	0.417	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-21.5	-177	63.9	0	0	0	0	112.9	R489 D521 K526	R489-T524 PolarHBondContact NH1-O 2.87Å; D521-T524 VanDerWaalsContact CB-OG1 3.28Å; D521-T524 WeakPolarHBondContact CB-OG1 3.43Å; D521-T524 VanDerWaalsContact CG-OG1 3.22Å; D521-T524 VanDerWaalsContact OD1-CB 3.29Å; D521-T524 WeakPolarHBondContact OD1-CB 3.37Å; D521-T524 VanDerWaalsContact OD1-CG2 3.29Å; D521-T524 WeakPolarHBondContact OD1-CG2 3.11Å; D521-T524 PolarHBondContact OD1-N 3.41Å; D521-T524 PolarHBondContact OD1-OG1 2.7Å; T524-K526 PolarHBondContact O-N 2.77Å; T524-K526 PolarHBondContact OG1-N 3.1Å
525	G	92.5	Very high	95.4	Very high	16 Å²	16	55.6 Å²	55.6	17%	0.165	28%	0.275	C	S	.	.			trans	76.8	2.3	-174	0	0	0	0	0	114.6	D521	D521-G525 WeakPolarHBondContact O-CA 3.4Å; D521-G525 PolarHBondContact O-N 2.94Å
526	K	95.2	Very high	95.4	Very high	145 Å²	145	55.5 Å²	55.5	63%	0.63	27%	0.274	S	S	*	.			trans	-84.9	140.7	-173.4	-67.1	-178.1	179.1	177.9	0	111	W520 D521 T524 L528	W520-K526 WeakPolarHBondContact CA-O 3.48Å; D521-K526 PolarHBondContact N-O 3.34Å; T524-K526 PolarHBondContact O-N 2.77Å; T524-K526 PolarHBondContact OG1-N 3.1Å; K526-L528 PolarHBondContact O-N 2.99Å
527	C	96.1	Very high	95.4	Very high	55 Å²	55	53.6 Å²	53.6	37%	0.372	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	111.8	169.4	178.7	0	0	0	0	109.2	V519 W520	V519-C527 CarbonylContact O-C 3.57Å; W520-C527 HydrophobicContact CD2-CB 4.4Å; W520-C527 HydrophobicContact CE3-CB 3.71Å; W520-C527 HydrophobicContact CH2-CB 4.19Å; W520-C527 HydrophobicContact CZ3-CB 3.6Å
528	L	95	Very high	95.3	Very high	88 Å²	88	55.6 Å²	55.6	46%	0.461	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	-46.3	178.3	-62.2	179.6	0	0	0	112.1	V519 D521 K526	V519-L528 HydrophobicContact CG1-CD1 4.39Å; V519-L528 PolarHBondContact O-N 3.02Å; D521-L528 HydrophobicContact CB-CD1 3.94Å; D521-L528 HydrophobicContact CB-CD2 3.98Å; D521-L528 HydrophobicContact CB-CG 3.92Å; K526-L528 PolarHBondContact O-N 2.99Å
529	K	95.1	Very high	95.3	Very high	66 Å²	66	55.1 Å²	55.1	29%	0.287	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	152.6	-174.2	-63.4	-170.2	177.6	-169.1	0	111.5	K518 V519 F531 I561 A562 A564	K518-K529 WeakPolarHBondContact CA-O 3.44Å; V519-K529 HydrophobicContact CB-CB 4.22Å; V519-K529 HydrophobicContact CG2-CB 4.15Å; V519-K529 PolarHBondContact N-O 3.08Å; V519-K529 PolarHBondContact O-N 3.06Å; K529-F531 HydrophobicContact CB-CE2 4.17Å; K529-F531 HydrophobicContact CB-CZ 4.3Å; K529-F531 HydrophobicContact CD-CZ 4.36Å; K529-I561 PolarHBondContact NZ-O 3.08Å; K529-A562 PolarHBondContact NZ-O 2.79Å; K529-A564 HydrophobicContact CD-CB 3.99Å
530	T	96.3	Very high	95.3	Very high	57 Å²	57	55.3 Å²	55.3	35%	0.35	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	126.8	174.8	-65.5	0	0	0	0	109.9	Q516 V517 K518	Q516-T530 HydrophobicContact CB-CG2 4.23Å; Q516-T530 HydrophobicContact CG-CG2 4.15Å; Q516-T530 VanDerWaalsContact OE1-CG2 3.31Å; V517-T530 CarbonylContact O-C 3.6Å; V517-T530 WeakPolarHBondContact O-CA 3.22Å; K518-T530 HydrophobicContact CG-CG2 4.3Å; K518-T530 PolarHBondContact NZ-OG1 2.9Å
531	F	95.7	Very high	95.2	Very high	8 Å²	8	59.3 Å²	59.3	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140	174.8	-53.9	-82.4	0	0	0	109.9	Q516 V517 V519 K529 I547 W559 A564	Q516-F531 WeakPolarHBondContact CA-O 3.2Å; V517-F531 HydrophobicContact CB-CB 4.26Å; V517-F531 PolarHBondContact N-O 2.84Å; V517-F531 PolarHBondContact O-N 3.03Å; V519-F531 HydrophobicContact CG2-CD2 4.39Å; V519-F531 HydrophobicContact CG2-CE2 3.72Å; K529-F531 HydrophobicContact CB-CE2 4.17Å; K529-F531 HydrophobicContact CB-CZ 4.3Å; K529-F531 HydrophobicContact CD-CZ 4.36Å; F531-I547 HydrophobicContact CD2-CD1 4.48Å; F531-I547 HydrophobicContact CE2-CD1 3.75Å; F531-I547 HydrophobicContact CZ-CD1 4.46Å; F531-W559 HydrophobicContact CB-CD2 4.12Å; F531-W559 HydrophobicContact CB-CE3 4.35Å; F531-W559 HydrophobicContact CB-CH2 4.28Å; F531-W559 HydrophobicContact CB-CZ2 4.04Å; F531-W559 HydrophobicContact CB-CZ3 4.42Å; F531-W559 HydrophobicContact CD1-CB 4.25Å; F531-W559 AromaticContact CD1-CD2 3.73Å; F531-W559 HydrophobicContact CD1-CD2 3.73Å; F531-W559 AromaticContact CD1-CE3 3.49Å; F531-W559 HydrophobicContact CD1-CE3 3.49Å; F531-W559 VanDerWaalsContact CD1-CE3 3.49Å; F531-W559 HydrophobicContact CD1-CG 4.08Å; F531-W559 HydrophobicContact CD1-CZ3 4.01Å; F531-W559 HydrophobicContact CE1-CB 4.11Å; F531-W559 HydrophobicContact CE1-CD2 4.4Å; F531-W559 HydrophobicContact CE1-CE3 4.13Å; F531-W559 HydrophobicContact CE1-CG 4.42Å; F531-W559 HydrophobicContact CG-CD2 4.05Å; F531-W559 HydrophobicContact CG-CE3 4.22Å; F531-W559 HydrophobicContact CG-CG 4.26Å; F531-W559 HydrophobicContact CZ-CB 4.39Å; F531-A564 HydrophobicContact CE1-CB 4.12Å; F531-A564 HydrophobicContact CZ-CB 4.47Å
532	R	94.4	Very high	95.2	Very high	188 Å²	188	58.3 Å²	58.3	71%	0.709	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	133.9	-173.2	-64.7	-176.3	-179	172.6	0.6	112.4
533	H	94.4	Very high	95.2	Very high	18 Å²	18	60.1 Å²	60.1	8%	0.083	30%	0.295	C	S	.	.			trans	-109.6	168.3	166.2	-74.1	-122	0	0	0	110	C515 D535 I537 S549 W559	C515-H533 WeakPolarHBondContact CB-O 3.45Å; C515-H533 PolarHBondContact O-N 2.89Å; H533-D535 WeakPolarHBondContact CB-O 3.45Å; H533-I537 HydrophobicContact CB-CD1 3.58Å; H533-I537 VanDerWaalsContact CD2-CD1 3.45Å; H533-I537 WeakPolarHBondContact CD2-CD1 3.41Å; H533-S549 PolarHBondContact CE1-OG 3Å; H533-S549 VanDerWaalsContact CE1-OG 3.26Å; H533-S549 PolarHBondContact NE2-OG 3.14Å; H533-W559 AromaticContact CD2-CZ2 3.94Å; H533-W559 AromaticContact NE2-CE2 3.87Å; H533-W559 AromaticContact NE2-CZ2 3.57Å; H533-W559 AromaticContact NE2-NE1 3.54Å
534	K	93.5	Very high	95.2	Very high	192 Å²	192	58.8 Å²	58.8	84%	0.835	29%	0.288	S	S	*	.	S	Bend	trans	-84.7	-25.8	172.9	-67.8	-173.6	176.5	-175.4	0	112.3
535	D	95.5	Very high	95.2	Very high	27 Å²	27	58.4 Å²	58.4	14%	0.144	29%	0.286	C	S	.	.	S	Bend	trans	-128	160.4	-173.1	-55	-85	0	0	0	110.3	C515 H533 C551 R553	C515-D535 WeakPolarHBondContact CB-O 3.39Å; H533-D535 WeakPolarHBondContact CB-O 3.45Å; D535-C551 HydrophobicContact CB-CB 4.12Å; D535-R553 HydrophobicContact CB-CG 4.29Å; D535-R553 VanDerWaalsContact OD1-CD 3.26Å; D535-R553 WeakPolarHBondContact OD1-CD 3.39Å; D535-R553 WeakPolarHBondContact OD1-CG 3.2Å; D535-R553 IonicContact OD1-CZ 3.97Å; D535-R553 IonicContact OD1-NE 2.91Å; D535-R553 PolarHBondContact OD1-NE 3.09Å; D535-R553 WeakPolarHBondContact OD2-CD 3.38Å; D535-R553 IonicContact OD2-NE 3.86Å
536	P	96.8	Very high	95.4	Very high	27 Å²	27	60.1 Å²	60.1	18%	0.175	29%	0.288	C	S	.	.			trans	-51.8	140.1	179.9	-32.4	39.7	0	0	0	113.4	R513 C515 C551 E552	R513-P536 HydrophobicContact CG-CB 4.46Å; C515-P536 VanDerWaalsContact SG-N 3.41Å; P536-C551 CarbonylContact O-C 3.54Å; P536-C551 WeakPolarHBondContact O-CA 3.4Å; P536-C551 WeakPolarHBondContact O-CB 3.2Å; P536-E552 WeakPolarHBondContact CG-OE2 3.48Å; P536-E552 PolarHBondContact O-N 3.19Å
537	I	97.6	Very high	95.5	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	138.4	176.2	-49.3	-57.7	0	0	0	109	T499 G512 V517 H533 S550	T499-I537 WeakPolarHBondContact CB-O 3.42Å; T499-I537 PolarHBondContact OG1-O 3.21Å; G512-I537 PolarHBondContact O-N 2.86Å; V517-I537 HydrophobicContact CG2-CD1 3.85Å; V517-I537 HydrophobicContact CG2-CG1 3.81Å; V517-I537 HydrophobicContact CG2-CG2 4.13Å; H533-I537 HydrophobicContact CB-CD1 3.58Å; H533-I537 VanDerWaalsContact CD2-CD1 3.45Å; H533-I537 WeakPolarHBondContact CD2-CD1 3.41Å; I537-S550 WeakPolarHBondContact CA-O 3.49Å; I537-S550 WeakPolarHBondContact CG2-O 3.4Å
538	L	95.9	Very high	95.5	Very high	41 Å²	41	50.6 Å²	50.6	22%	0.215	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-38.7	-179.7	-65.7	-178.3	0	0	0	113.1	C500 S550 E552 A576 V577	C500-L538 WeakPolarHBondContact CB-O 3.49Å; C500-L538 PolarHBondContact SG-O 2.69Å; L538-S550 PolarHBondContact N-O 3.01Å; L538-E552 HydrophobicContact CD1-CB 4.11Å; L538-E552 HydrophobicContact CD1-CG 4.47Å; L538-E552 HydrophobicContact CG-CB 4.47Å; L538-A576 HydrophobicContact CD1-CB 3.54Å; L538-V577 VanDerWaalsContact CB-O 3.28Å; L538-V577 WeakPolarHBondContact CB-O 3.22Å
539	A	95.9	Very high	95.7	Very high	10 Å²	10	46.4 Å²	46.4	8%	0.083	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.1	171.4	0	0	0	0	0	111.5	C500 S550 K578 L580	C500-A539 VanDerWaalsContact SG-C 3.52Å; C500-A539 VanDerWaalsContact SG-CA 3.51Å; A539-S550 WeakPolarHBondContact CB-OG 3.21Å; A539-S550 PolarHBondContact N-OG 2.68Å; A539-S550 PolarHBondContact O-N 2.74Å; A539-S550 PolarHBondContact O-OG 3.11Å; A539-K578 WeakPolarHBondContact CB-O 3.32Å; A539-L580 HydrophobicContact CB-CB 4.44Å; A539-L580 HydrophobicContact CB-CD1 4.07Å; A539-L580 HydrophobicContact CB-CG 3.97Å; A539-L580 WeakPolarHBondContact O-CD1 3.18Å
540	T	97.2	Very high	95.7	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	148.8	173.2	-164.3	0	0	0	0	110	C500 V509 V548	C500-T540 HydrophobicContact CB-CG2 4.29Å; C500-T540 PolarHBondContact SG-N 2.94Å; C500-T540 VanDerWaalsContact SG-N 3.44Å; V509-T540 HydrophobicContact CG1-CG2 3.88Å; V509-T540 WeakPolarHBondContact CG1-OG1 3.39Å; T540-V548 CarbonylContact C-O 3.57Å; T540-V548 WeakPolarHBondContact CA-O 3.25Å; T540-V548 PolarHBondContact OG1-O 2.82Å
541	R	97.1	Very high	95.6	Very high	86 Å²	86	40.6 Å²	40.6	33%	0.325	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	150.1	174.5	-68.8	-67.4	-166.5	170.2	-1.4	109.7	D502 V548 L580 F582	D502-R541 IonicContact OD1-NH1 3.92Å; D502-R541 PolarHBondContact OD1-NH1 3.34Å; D502-R541 WeakPolarHBondContact OD2-CA 3.41Å; D502-R541 WeakPolarHBondContact OD2-CD 3.49Å; R541-V548 PolarHBondContact N-O 3.45Å; R541-V548 PolarHBondContact O-N 2.71Å; R541-L580 HydrophobicContact CG-CB 3.96Å; R541-L580 WeakPolarHBondContact CG-O 3.41Å; R541-L580 PolarHBondContact NE-O 3.36Å; R541-F582 HydrophobicContact CB-CD1 3.68Å; R541-F582 HydrophobicContact CB-CE1 3.42Å; R541-F582 VanDerWaalsContact CB-CE1 3.42Å
542	I	96.1	Very high	95.5	Very high	13 Å²	13	45.1 Å²	45.1	7%	0.067	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.5	179.6	-180	167.8	0	0	0	111.5	D502 C504 R507 V509 I547 I561	D502-I542 HydrophobicContact CB-CG2 4.04Å; D502-I542 PolarHBondContact OD2-N 2.66Å; C504-I542 HydrophobicContact CB-CB 4.41Å; C504-I542 HydrophobicContact CB-CD1 4.36Å; C504-I542 HydrophobicContact CB-CG1 3.98Å; C504-I542 HydrophobicContact CB-CG2 3.76Å; R507-I542 HydrophobicContact CB-CD1 3.98Å; V509-I542 HydrophobicContact CB-CB 4.29Å; V509-I542 HydrophobicContact CB-CG2 4.34Å; V509-I542 HydrophobicContact CG2-CB 3.7Å; V509-I542 HydrophobicContact CG2-CD1 3.34Å; V509-I542 HydrophobicContact CG2-CG1 3.98Å; V509-I542 HydrophobicContact CG2-CG2 4.04Å; I542-I547 HydrophobicContact CB-CG1 4.32Å; I542-I547 HydrophobicContact CD1-CD1 4.47Å; I542-I547 HydrophobicContact CD1-CG1 4.18Å; I542-I547 HydrophobicContact CG1-CG1 4.07Å; I542-I561 HydrophobicContact CD1-CD1 3.78Å; I542-I561 HydrophobicContact CG1-CD1 3.87Å
543	N	94.9	Very high	95.5	Very high	46 Å²	46	45 Å²	45	25%	0.246	21%	0.208	C	C	.	.			trans	-127.8	-169.9	159.3	76.7	-3.9	0	0	0	109.5	T545 Y546 I561 F582	N543-T545 PolarHBondContact O-N 3.35Å; N543-T545 VanDerWaalsContact O-N 3.14Å; N543-T545 PolarHBondContact OD1-N 3.23Å; N543-Y546 PolarHBondContact N-O 2.84Å; N543-Y546 WeakPolarHBondContact OD1-CA 3.28Å; N543-Y546 PolarHBondContact OD1-N 3.4Å; N543-Y546 PolarHBondContact OD1-O 3.04Å; N543-Y546 VanDerWaalsContact OD1-O 3.09Å; N543-I561 WeakPolarHBondContact O-CD1 3.36Å; N543-F582 HydrophobicContact CB-CE2 3.87Å; N543-F582 HydrophobicContact CB-CZ 3.77Å; N543-F582 VanDerWaalsContact CG-CE2 3.45Å; N543-F582 VanDerWaalsContact ND2-CE2 3.34Å; N543-F582 WeakPolarHBondContact ND2-CE2 3.46Å
544	D	91.8	Very high	95.3	Very high	79 Å²	79	44.1 Å²	44.1	42%	0.422	21%	0.205	S	C	.	.	S	Bend	trans	-58.7	-29.2	-178.4	-77	-27.4	0	0	0	114.8	K505	K505-D544 WeakPolarHBondContact CD-OD1 3.29Å; K505-D544 WeakPolarHBondContact CE-OD1 3.44Å; K505-D544 IonicContact NZ-OD1 3.98Å; K505-D544 PolarHBondContact NZ-OD1 3.41Å; K505-D544 IonicContact NZ-OD2 3.04Å; K505-D544 PolarHBondContact NZ-OD2 3.3Å
545	T	92.8	Very high	95.3	Very high	59 Å²	59	37.6 Å²	37.6	36%	0.362	18%	0.179	S	C	.	.	S	Bend	trans	-116.5	-35	-165.4	-52.8	0	0	0	0	113	N543 H560 I561	N543-T545 PolarHBondContact O-N 3.35Å; N543-T545 VanDerWaalsContact O-N 3.14Å; N543-T545 PolarHBondContact OD1-N 3.23Å; T545-H560 WeakPolarHBondContact CG2-NE2 3.45Å; T545-H560 PolarHBondContact O-CD2 3.13Å; T545-H560 VanDerWaalsContact O-CD2 3.27Å; T545-I561 WeakPolarHBondContact O-CG1 3.35Å; T545-I561 PolarHBondContact O-N 3.36Å
546	Y	95.6	Very high	95.4	Very high	53 Å²	53	36.4 Å²	36.4	21%	0.208	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.6	-169.2	-59.9	-70	0	0	0	112.4	N543 V558 W559 H560 V567 M601	N543-Y546 PolarHBondContact N-O 2.84Å; N543-Y546 WeakPolarHBondContact OD1-CA 3.28Å; N543-Y546 PolarHBondContact OD1-N 3.4Å; N543-Y546 PolarHBondContact OD1-O 3.04Å; N543-Y546 VanDerWaalsContact OD1-O 3.09Å; Y546-V558 HydrophobicContact CD1-CG1 4.06Å; Y546-V558 HydrophobicContact CG-CG1 4.3Å; Y546-W559 CarbonylContact C-O 3.57Å; Y546-W559 WeakPolarHBondContact CA-O 3.36Å; Y546-H560 HydrophobicContact CD1-CB 4.36Å; Y546-H560 AromaticContact CD1-CD2 3.98Å; Y546-H560 HydrophobicContact CE1-CB 4.31Å; Y546-H560 AromaticContact CE1-CD2 3.61Å; Y546-V567 HydrophobicContact CD1-CG2 4.23Å; Y546-V567 HydrophobicContact CE1-CG2 3.97Å; Y546-M601 HydrophobicContact CD2-CE 4.22Å; Y546-M601 HydrophobicContact CG-CE 4.32Å
547	I	97	Very high	95.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.5	167.1	-68	163.8	0	0	0	107.6	V509 V517 V519 F531 I542 V558 W559 I561	V509-I547 HydrophobicContact CG1-CG2 4.01Å; V509-I547 HydrophobicContact CG2-CD1 3.81Å; V509-I547 HydrophobicContact CG2-CG1 4.02Å; V517-I547 HydrophobicContact CG1-CG2 4.13Å; V519-I547 HydrophobicContact CG2-CD1 3.41Å; V519-I547 VanDerWaalsContact CG2-CD1 3.41Å; F531-I547 HydrophobicContact CD2-CD1 4.48Å; F531-I547 HydrophobicContact CE2-CD1 3.75Å; F531-I547 HydrophobicContact CZ-CD1 4.46Å; I542-I547 HydrophobicContact CB-CG1 4.32Å; I542-I547 HydrophobicContact CD1-CD1 4.47Å; I542-I547 HydrophobicContact CD1-CG1 4.18Å; I542-I547 HydrophobicContact CG1-CG1 4.07Å; I547-V558 WeakPolarHBondContact O-CA 3.34Å; I547-W559 HydrophobicContact CB-CB 4.36Å; I547-W559 PolarHBondContact N-O 3.46Å; I547-W559 PolarHBondContact O-N 2.88Å; I547-I561 HydrophobicContact CD1-CD1 4.28Å; I547-I561 HydrophobicContact CD1-CG1 3.77Å; I547-I561 HydrophobicContact CG1-CD1 3.9Å; I547-I561 HydrophobicContact CG1-CG1 3.66Å
548	V	97.8	Very high	95.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	136.2	170.2	-168.8	0	0	0	0	108.7	T540 R541 V556 K557 V558 L580 F582 L587 M601	T540-V548 CarbonylContact C-O 3.57Å; T540-V548 WeakPolarHBondContact CA-O 3.25Å; T540-V548 PolarHBondContact OG1-O 2.82Å; R541-V548 PolarHBondContact N-O 3.45Å; R541-V548 PolarHBondContact O-N 2.71Å; V548-V556 HydrophobicContact CG1-CG1 3.48Å; V548-V556 VanDerWaalsContact CG1-CG1 3.48Å; V548-K557 WeakPolarHBondContact CA-O 3.47Å; V548-V558 HydrophobicContact CG1-CG2 4.38Å; V548-V558 HydrophobicContact CG2-CG1 4.45Å; V548-V558 HydrophobicContact CG2-CG2 4.2Å; V548-L580 HydrophobicContact CB-CD1 4.45Å; V548-L580 HydrophobicContact CG1-CD1 3.96Å; V548-L580 HydrophobicContact CG1-CD2 4.44Å; V548-F582 HydrophobicContact CB-CD1 4.15Å; V548-F582 HydrophobicContact CB-CE1 4.2Å; V548-F582 HydrophobicContact CG2-CD1 3.64Å; V548-F582 HydrophobicContact CG2-CD2 4.25Å; V548-F582 HydrophobicContact CG2-CE1 3.71Å; V548-F582 HydrophobicContact CG2-CE2 4.27Å; V548-F582 HydrophobicContact CG2-CG 3.92Å; V548-F582 HydrophobicContact CG2-CZ 4.03Å; V548-L587 HydrophobicContact CB-CD1 4.44Å; V548-L587 HydrophobicContact CG1-CD1 3.75Å; V548-L587 HydrophobicContact CG1-CD2 3.9Å; V548-L587 HydrophobicContact CG2-CD1 4.36Å; V548-M601 HydrophobicContact CG2-CE 4.07Å; V548-M601 HydrophobicContact CG2-SD 4.22Å
549	S	97.4	Very high	95.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144	-175.2	52.9	0	0	0	0	109.6	H533 V556 K557 W559	H533-S549 PolarHBondContact CE1-OG 3Å; H533-S549 VanDerWaalsContact CE1-OG 3.26Å; H533-S549 PolarHBondContact NE2-OG 3.14Å; S549-V556 CarbonylContact O-C 3.57Å; S549-V556 WeakPolarHBondContact O-CA 3.29Å; S549-K557 PolarHBondContact N-O 3.5Å; S549-K557 PolarHBondContact O-N 2.61Å; S549-K557 PolarHBondContact OG-O 3.27Å; S549-W559 PolarHBondContact OG-NE1 3.31Å
550	S	96.4	Very high	95.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.5	-176.5	63.7	0	0	0	0	111.6	I537 L538 A539 L555 V577	I537-S550 WeakPolarHBondContact CA-O 3.49Å; I537-S550 WeakPolarHBondContact CG2-O 3.4Å; L538-S550 PolarHBondContact N-O 3.01Å; A539-S550 WeakPolarHBondContact CB-OG 3.21Å; A539-S550 PolarHBondContact N-OG 2.68Å; A539-S550 PolarHBondContact O-N 2.74Å; A539-S550 PolarHBondContact O-OG 3.11Å; S550-L555 WeakPolarHBondContact CA-O 3.37Å; S550-V577 PolarHBondContact OG-O 2.78Å
551	C	94.6	Very high	95	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.007	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	169	-176.2	75.3	0	0	0	0	114.1	D535 P536 R553 G554 L555 V577	D535-C551 HydrophobicContact CB-CB 4.12Å; P536-C551 CarbonylContact O-C 3.54Å; P536-C551 WeakPolarHBondContact O-CA 3.4Å; P536-C551 WeakPolarHBondContact O-CB 3.2Å; C551-R553 PolarHBondContact O-N 3.41Å; C551-G554 PolarHBondContact O-N 3.1Å; C551-G554 VanDerWaalsContact O-N 3.11Å; C551-L555 PolarHBondContact N-O 3.33Å; C551-V577 PolarHBondContact O-N 2.91Å
552	E	93.8	Very high	94.7	Very high	103 Å²	103	36.4 Å²	36.4	48%	0.481	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.8	178.4	-171.2	167.7	-151.6	0	0	114.2	P536 L538 A576	P536-E552 WeakPolarHBondContact CG-OE2 3.48Å; P536-E552 PolarHBondContact O-N 3.19Å; L538-E552 HydrophobicContact CD1-CB 4.11Å; L538-E552 HydrophobicContact CD1-CG 4.47Å; L538-E552 HydrophobicContact CG-CB 4.47Å; E552-A576 HydrophobicContact CG-CB 4.36Å; E552-A576 WeakPolarHBondContact O-CA 3.27Å; E552-A576 WeakPolarHBondContact O-CB 3.43Å; E552-A576 PolarHBondContact O-N 3.32Å
553	R	92.6	Very high	94.4	Very high	184 Å²	184	41.8 Å²	41.8	69%	0.694	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	14	175.7	-72.7	-163.4	-172.5	-135	-4	114.9	D535 C551 L555	D535-R553 HydrophobicContact CB-CG 4.29Å; D535-R553 VanDerWaalsContact OD1-CD 3.26Å; D535-R553 WeakPolarHBondContact OD1-CD 3.39Å; D535-R553 WeakPolarHBondContact OD1-CG 3.2Å; D535-R553 IonicContact OD1-CZ 3.97Å; D535-R553 IonicContact OD1-NE 2.91Å; D535-R553 PolarHBondContact OD1-NE 3.09Å; D535-R553 WeakPolarHBondContact OD2-CD 3.38Å; D535-R553 IonicContact OD2-NE 3.86Å; C551-R553 PolarHBondContact O-N 3.41Å; R553-L555 VanDerWaalsContact C-N 3.34Å; R553-L555 PolarHBondContact O-N 2.9Å
554	G	90.8	Very high	94.1	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.01	22%	0.216	C	C	.	.	S	Bend	trans	82.3	5.9	173.9	0	0	0	0	0	115.6	C551 G575	C551-G554 PolarHBondContact O-N 3.1Å; C551-G554 VanDerWaalsContact O-N 3.11Å; G554-G575 WeakPolarHBondContact CA-O 3.39Å; G554-G575 PolarHBondContact N-O 3.22Å
555	L	94.8	Very high	94.1	Very high	55 Å²	55	43.9 Å²	43.9	29%	0.288	22%	0.223	S	C	.	.			trans	-84.9	134.4	175.4	-59.8	173.4	0	0	0	110.5	S550 C551 R553 T569	S550-L555 WeakPolarHBondContact CA-O 3.37Å; C551-L555 PolarHBondContact N-O 3.33Å; R553-L555 VanDerWaalsContact C-N 3.34Å; R553-L555 PolarHBondContact O-N 2.9Å; L555-T569 HydrophobicContact CD2-CG2 4.27Å
556	V	96.8	Very high	94.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.1	170.7	-174.9	0	0	0	0	108.7	V548 S549 T569 L570 V577 L580 L587	V548-V556 HydrophobicContact CG1-CG1 3.48Å; V548-V556 VanDerWaalsContact CG1-CG1 3.48Å; S549-V556 CarbonylContact O-C 3.57Å; S549-V556 WeakPolarHBondContact O-CA 3.29Å; V556-T569 CarbonylContact O-C 3.57Å; V556-L570 HydrophobicContact CB-CB 4.21Å; V556-L570 HydrophobicContact CB-CD1 4.41Å; V556-L570 HydrophobicContact CG1-CD1 4.4Å; V556-L570 PolarHBondContact N-O 2.77Å; V556-L570 PolarHBondContact O-N 3.19Å; V556-V577 HydrophobicContact CG2-CB 4.49Å; V556-V577 HydrophobicContact CG2-CG1 4.21Å; V556-V577 HydrophobicContact CG2-CG2 3.97Å; V556-L580 HydrophobicContact CG1-CD2 4Å; V556-L580 HydrophobicContact CG2-CD2 4.23Å; V556-L587 HydrophobicContact CG1-CD2 4.1Å
557	K	96.3	Very high	94	Very high	33 Å²	33	43.9 Å²	43.9	14%	0.143	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.2	178.6	-70	-171.9	179.2	-179	0	110.6	V548 S549 W559 L566 T569	V548-K557 WeakPolarHBondContact CA-O 3.47Å; S549-K557 PolarHBondContact N-O 3.5Å; S549-K557 PolarHBondContact O-N 2.61Å; S549-K557 PolarHBondContact OG-O 3.27Å; K557-W559 HydrophobicContact CB-CZ2 4.04Å; K557-W559 HydrophobicContact CD-CH2 3.94Å; K557-W559 HydrophobicContact CD-CZ2 3.33Å; K557-W559 HydrophobicContact CG-CZ2 4.36Å; K557-L566 HydrophobicContact CB-CD1 3.8Å; K557-L566 HydrophobicContact CD-CD1 3.84Å; K557-L566 HydrophobicContact CD-CD2 4.43Å; K557-L566 HydrophobicContact CG-CD1 3.97Å; K557-T569 HydrophobicContact CG-CG2 4.16Å
558	V	97	Very high	93.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.8	173.9	-175.3	0	0	0	0	108.6	Y546 I547 V548 V567 K568 L587 M601	Y546-V558 HydrophobicContact CD1-CG1 4.06Å; Y546-V558 HydrophobicContact CG-CG1 4.3Å; I547-V558 WeakPolarHBondContact O-CA 3.34Å; V548-V558 HydrophobicContact CG1-CG2 4.38Å; V548-V558 HydrophobicContact CG2-CG1 4.45Å; V548-V558 HydrophobicContact CG2-CG2 4.2Å; V558-V567 HydrophobicContact CG1-CB 4.45Å; V558-V567 WeakPolarHBondContact O-CB 3.42Å; V558-V567 PolarHBondContact O-N 3.12Å; V558-K568 HydrophobicContact CB-CG 3.96Å; V558-K568 HydrophobicContact CG2-CG 4Å; V558-K568 PolarHBondContact N-O 3.47Å; V558-K568 PolarHBondContact O-N 2.93Å; V558-L587 HydrophobicContact CG2-CD2 4.12Å; V558-M601 HydrophobicContact CG1-CE 3.92Å; V558-M601 HydrophobicContact CG2-SD 4.3Å
559	W	95.6	Very high	93.6	Very high	21 Å²	21	46.6 Å²	46.6	8%	0.08	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.7	-177	-51.3	92.2	0	0	0	109.8	F531 H533 Y546 I547 S549 K557 Q565 L566	F531-W559 HydrophobicContact CB-CD2 4.12Å; F531-W559 HydrophobicContact CB-CE3 4.35Å; F531-W559 HydrophobicContact CB-CH2 4.28Å; F531-W559 HydrophobicContact CB-CZ2 4.04Å; F531-W559 HydrophobicContact CB-CZ3 4.42Å; F531-W559 HydrophobicContact CD1-CB 4.25Å; F531-W559 AromaticContact CD1-CD2 3.73Å; F531-W559 HydrophobicContact CD1-CD2 3.73Å; F531-W559 AromaticContact CD1-CE3 3.49Å; F531-W559 HydrophobicContact CD1-CE3 3.49Å; F531-W559 VanDerWaalsContact CD1-CE3 3.49Å; F531-W559 HydrophobicContact CD1-CG 4.08Å; F531-W559 HydrophobicContact CD1-CZ3 4.01Å; F531-W559 HydrophobicContact CE1-CB 4.11Å; F531-W559 HydrophobicContact CE1-CD2 4.4Å; F531-W559 HydrophobicContact CE1-CE3 4.13Å; F531-W559 HydrophobicContact CE1-CG 4.42Å; F531-W559 HydrophobicContact CG-CD2 4.05Å; F531-W559 HydrophobicContact CG-CE3 4.22Å; F531-W559 HydrophobicContact CG-CG 4.26Å; F531-W559 HydrophobicContact CZ-CB 4.39Å; H533-W559 AromaticContact CD2-CZ2 3.94Å; H533-W559 AromaticContact NE2-CE2 3.87Å; H533-W559 AromaticContact NE2-CZ2 3.57Å; H533-W559 AromaticContact NE2-NE1 3.54Å; Y546-W559 CarbonylContact C-O 3.57Å; Y546-W559 WeakPolarHBondContact CA-O 3.36Å; I547-W559 HydrophobicContact CB-CB 4.36Å; I547-W559 PolarHBondContact N-O 3.46Å; I547-W559 PolarHBondContact O-N 2.88Å; S549-W559 PolarHBondContact OG-NE1 3.31Å; K557-W559 HydrophobicContact CB-CZ2 4.04Å; K557-W559 HydrophobicContact CD-CH2 3.94Å; K557-W559 HydrophobicContact CD-CZ2 3.33Å; K557-W559 HydrophobicContact CG-CZ2 4.36Å; W559-Q565 CarbonylContact C-O 3.59Å; W559-Q565 WeakPolarHBondContact CA-O 3.44Å; W559-L566 HydrophobicContact CD2-CD1 3.97Å; W559-L566 HydrophobicContact CE3-CB 3.75Å; W559-L566 HydrophobicContact CE3-CD1 3.87Å; W559-L566 HydrophobicContact CE3-CG 4.4Å; W559-L566 HydrophobicContact CH2-CB 4.38Å; W559-L566 HydrophobicContact CH2-CD1 4.07Å; W559-L566 HydrophobicContact CZ2-CD1 4.15Å; W559-L566 HydrophobicContact CZ3-CB 3.59Å; W559-L566 HydrophobicContact CZ3-CD1 3.92Å; W559-L566 HydrophobicContact CZ3-CG 4.22Å
560	H	94.3	Very high	93.4	Very high	31 Å²	31	46.6 Å²	46.6	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	125.6	171.7	-172.2	-116.7	0	0	0	110	T545 Y546 M563 A564 Q565 V567	T545-H560 WeakPolarHBondContact CG2-NE2 3.45Å; T545-H560 PolarHBondContact O-CD2 3.13Å; T545-H560 VanDerWaalsContact O-CD2 3.27Å; Y546-H560 HydrophobicContact CD1-CB 4.36Å; Y546-H560 AromaticContact CD1-CD2 3.98Å; Y546-H560 HydrophobicContact CE1-CB 4.31Å; Y546-H560 AromaticContact CE1-CD2 3.61Å; H560-M563 WeakPolarHBondContact ND1-CB 3.42Å; H560-M563 VanDerWaalsContact ND1-CG 3.26Å; H560-M563 WeakPolarHBondContact ND1-CG 3.09Å; H560-M563 PolarHBondContact ND1-N 3.33Å; H560-M563 PolarHBondContact ND1-SD 2.99Å; H560-M563 VanDerWaalsContact ND1-SD 3.41Å; H560-A564 VanDerWaalsContact O-CA 3.25Å; H560-A564 WeakPolarHBondContact O-CA 3.32Å; H560-A564 PolarHBondContact O-N 3.5Å; H560-Q565 PolarHBondContact N-O 2.92Å; H560-Q565 PolarHBondContact O-N 3.44Å; H560-V567 HydrophobicContact CB-CG2 3.84Å
561	I	91.5	Very high	93.2	Very high	6 Å²	6	50.6 Å²	50.6	3%	0.031	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-50.5	-172.1	-62.3	170.6	0	0	0	110.8	K529 I542 N543 T545 I547 A564	K529-I561 PolarHBondContact NZ-O 3.08Å; I542-I561 HydrophobicContact CD1-CD1 3.78Å; I542-I561 HydrophobicContact CG1-CD1 3.87Å; N543-I561 WeakPolarHBondContact O-CD1 3.36Å; T545-I561 WeakPolarHBondContact O-CG1 3.35Å; T545-I561 PolarHBondContact O-N 3.36Å; I547-I561 HydrophobicContact CD1-CD1 4.28Å; I547-I561 HydrophobicContact CD1-CG1 3.77Å; I547-I561 HydrophobicContact CG1-CD1 3.9Å; I547-I561 HydrophobicContact CG1-CG1 3.66Å; I561-A564 PolarHBondContact O-N 2.87Å
562	A	90.8	Very high	92.8	Very high	78 Å²	78	52.5 Å²	52.5	65%	0.645	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-48.6	-174.6	0	0	0	0	0	111.6	K529 A564	K529-A562 PolarHBondContact NZ-O 2.79Å; A562-A564 VanDerWaalsContact C-N 3.35Å; A562-A564 PolarHBondContact O-N 2.88Å
563	M	89	Confident	92.7	Very high	125 Å²	125	48.3 Å²	48.3	62%	0.616	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.3	-178.4	-63.1	165.7	-178.7	0	0	113.8	H560 Q565	H560-M563 WeakPolarHBondContact ND1-CB 3.42Å; H560-M563 VanDerWaalsContact ND1-CG 3.26Å; H560-M563 WeakPolarHBondContact ND1-CG 3.09Å; H560-M563 PolarHBondContact ND1-N 3.33Å; H560-M563 PolarHBondContact ND1-SD 2.99Å; H560-M563 VanDerWaalsContact ND1-SD 3.41Å; M563-Q565 HydrophobicContact CB-CB 4.3Å; M563-Q565 HydrophobicContact CB-CG 4.1Å; M563-Q565 PolarHBondContact O-N 2.79Å
564	A	90.3	Very high	92.7	Very high	47 Å²	47	47.9 Å²	47.9	39%	0.388	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	32.2	-172.5	0	0	0	0	0	114.1	K529 F531 H560 I561 A562	K529-A564 HydrophobicContact CD-CB 3.99Å; F531-A564 HydrophobicContact CE1-CB 4.12Å; F531-A564 HydrophobicContact CZ-CB 4.47Å; H560-A564 VanDerWaalsContact O-CA 3.25Å; H560-A564 WeakPolarHBondContact O-CA 3.32Å; H560-A564 PolarHBondContact O-N 3.5Å; I561-A564 PolarHBondContact O-N 2.87Å; A562-A564 VanDerWaalsContact C-N 3.35Å; A562-A564 PolarHBondContact O-N 2.88Å
565	Q	90.8	Very high	92.7	Very high	122 Å²	122	48.5 Å²	48.5	57%	0.57	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	148.5	-176.4	-72	179.8	4.3	0	0	112	W559 H560 M563 V567	W559-Q565 CarbonylContact C-O 3.59Å; W559-Q565 WeakPolarHBondContact CA-O 3.44Å; H560-Q565 PolarHBondContact N-O 2.92Å; H560-Q565 PolarHBondContact O-N 3.44Å; M563-Q565 HydrophobicContact CB-CB 4.3Å; M563-Q565 HydrophobicContact CB-CG 4.1Å; M563-Q565 PolarHBondContact O-N 2.79Å; Q565-V567 PolarHBondContact O-N 3.48Å
566	L	93.5	Very high	92.7	Very high	75 Å²	75	46.5 Å²	46.5	39%	0.393	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	115.4	170	-178.9	59.7	0	0	0	109.2	K557 W559 K568	K557-L566 HydrophobicContact CB-CD1 3.8Å; K557-L566 HydrophobicContact CD-CD1 3.84Å; K557-L566 HydrophobicContact CD-CD2 4.43Å; K557-L566 HydrophobicContact CG-CD1 3.97Å; W559-L566 HydrophobicContact CD2-CD1 3.97Å; W559-L566 HydrophobicContact CE3-CB 3.75Å; W559-L566 HydrophobicContact CE3-CD1 3.87Å; W559-L566 HydrophobicContact CE3-CG 4.4Å; W559-L566 HydrophobicContact CH2-CB 4.38Å; W559-L566 HydrophobicContact CH2-CD1 4.07Å; W559-L566 HydrophobicContact CZ2-CD1 4.15Å; W559-L566 HydrophobicContact CZ3-CB 3.59Å; W559-L566 HydrophobicContact CZ3-CD1 3.92Å; W559-L566 HydrophobicContact CZ3-CG 4.22Å; L566-K568 WeakPolarHBondContact CD1-O 3.03Å
567	V	92.5	Very high	92.7	Very high	38 Å²	38	46.5 Å²	46.5	23%	0.23	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-51.3	179.1	-178.8	0	0	0	0	109.9	Y546 V558 H560 Q565	Y546-V567 HydrophobicContact CD1-CG2 4.23Å; Y546-V567 HydrophobicContact CE1-CG2 3.97Å; V558-V567 HydrophobicContact CG1-CB 4.45Å; V558-V567 WeakPolarHBondContact O-CB 3.42Å; V558-V567 PolarHBondContact O-N 3.12Å; H560-V567 HydrophobicContact CB-CG2 3.84Å; Q565-V567 PolarHBondContact O-N 3.48Å
568	K	92.8	Very high	92.6	Very high	11 Å²	11	48.5 Å²	48.5	5%	0.048	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.6	-179.7	58.4	-173.4	166	-154.9	0	112.4	V558 L566 L570 S600 M601 G603 Y605	V558-K568 HydrophobicContact CB-CG 3.96Å; V558-K568 HydrophobicContact CG2-CG 4Å; V558-K568 PolarHBondContact N-O 3.47Å; V558-K568 PolarHBondContact O-N 2.93Å; L566-K568 WeakPolarHBondContact CD1-O 3.03Å; K568-L570 HydrophobicContact CD-CD2 4.12Å; K568-L570 HydrophobicContact CG-CD2 4.43Å; K568-S600 WeakPolarHBondContact CE-O 3.31Å; K568-S600 PolarHBondContact NZ-O 2.9Å; K568-M601 VanDerWaalsContact NZ-C 3.25Å; K568-M601 PolarHBondContact NZ-O 3.22Å; K568-G603 PolarHBondContact NZ-O 2.78Å; K568-Y605 WeakPolarHBondContact CD-O 3.28Å
569	T	94.4	Very high	92.5	Very high	45 Å²	45	48.8 Å²	48.8	28%	0.276	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.1	171.9	-58.9	0	0	0	0	108.1	L555 V556 K557	L555-T569 HydrophobicContact CD2-CG2 4.27Å; V556-T569 CarbonylContact O-C 3.57Å; K557-T569 HydrophobicContact CG-CG2 4.16Å
570	L	93.7	Very high	92.6	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.6	-179.7	-53.7	170.2	0	0	0	107.9	V556 K568 L587 W599 E606	V556-L570 HydrophobicContact CB-CB 4.21Å; V556-L570 HydrophobicContact CB-CD1 4.41Å; V556-L570 HydrophobicContact CG1-CD1 4.4Å; V556-L570 PolarHBondContact N-O 2.77Å; V556-L570 PolarHBondContact O-N 3.19Å; K568-L570 HydrophobicContact CD-CD2 4.12Å; K568-L570 HydrophobicContact CG-CD2 4.43Å; L570-L587 HydrophobicContact CD1-CD2 3.41Å; L570-L587 VanDerWaalsContact CD1-CD2 3.41Å; L570-W599 HydrophobicContact CB-CD2 4.15Å; L570-W599 HydrophobicContact CB-CE3 4.09Å; L570-W599 HydrophobicContact CB-CH2 4.3Å; L570-W599 HydrophobicContact CB-CZ2 4.36Å; L570-W599 HydrophobicContact CB-CZ3 4.17Å; L570-W599 HydrophobicContact CD1-CB 3.82Å; L570-W599 HydrophobicContact CD1-CD2 3.85Å; L570-W599 HydrophobicContact CD1-CE3 4.27Å; L570-W599 HydrophobicContact CD1-CG 3.64Å; L570-W599 HydrophobicContact CD2-CD2 4.24Å; L570-W599 HydrophobicContact CD2-CE3 3.79Å; L570-W599 HydrophobicContact CD2-CZ3 4.34Å; L570-W599 HydrophobicContact CG-CD2 4.3Å; L570-W599 HydrophobicContact CG-CE3 4.27Å; L570-E606 HydrophobicContact CD2-CB 4.02Å
571	S	91.2	Very high	92.7	Very high	83 Å²	83	48.6 Å²	48.6	58%	0.58	28%	0.283	S	S	*	.			trans	-121.6	129	177.4	61.5	0	0	0	0	109.4
572	G	86.6	Confident	92.9	Very high	42 Å²	42	49.5 Å²	49.5	43%	0.433	29%	0.287	S	S	.	.			trans	-179.5	-31.4	178.8	0	0	0	0	0	113.1	M597	G572-M597 WeakPolarHBondContact O-CE 3.45Å
573	H	92.6	Very high	92.9	Very high	15 Å²	15	48.1 Å²	48.1	7%	0.069	27%	0.268	C	S	.	.			trans	-69.9	139.7	173.5	-72.4	-66.8	0	0	0	111.9	V577 S589 S591 D593 L595	H573-V577 HydrophobicContact CB-CG2 4.16Å; H573-S589 PolarHBondContact CD2-OG 2.94Å; H573-S589 PolarHBondContact NE2-O 2.98Å; H573-S589 PolarHBondContact NE2-OG 2.88Å; H573-S591 WeakPolarHBondContact ND1-CB 3.35Å; H573-D593 WeakPolarHBondContact CA-OD2 3.36Å; H573-D593 WeakPolarHBondContact CB-OD2 3.31Å; H573-D593 IonicContact CG-OD2 3.06Å; H573-D593 IonicContact ND1-OD1 3.54Å; H573-D593 IonicContact ND1-OD2 2.66Å; H573-D593 PolarHBondContact ND1-OD2 2.7Å; H573-L595 PolarHBondContact CE1-O 3.27Å
574	E	90.8	Very high	92.9	Very high	175 Å²	175	48.7 Å²	48.7	82%	0.818	27%	0.27	S	S	*	.	S	Bend	trans	-90.7	-18.4	174.1	-64.8	-176.4	172	0	0	111.7	D593	E574-D593 PolarHBondContact N-OD2 3.33Å
575	G	91.7	Very high	92.9	Very high	13 Å²	13	48.9 Å²	48.9	13%	0.134	26%	0.26	C	S	.	.	S	Bend	trans	-117.9	-179	-178.4	0	0	0	0	0	114	G554 V577 S591 T592	G554-G575 WeakPolarHBondContact CA-O 3.39Å; G554-G575 PolarHBondContact N-O 3.22Å; G575-V577 PolarHBondContact O-N 2.91Å; G575-S591 PolarHBondContact O-OG 2.78Å; G575-T592 WeakPolarHBondContact CA-OG1 3.42Å
576	A	94.7	Very high	93	Very high	14 Å²	14	43.1 Å²	43.1	12%	0.116	23%	0.233	C	C	.	.			trans	-66.2	127.9	177.4	0	0	0	0	0	111.2	L538 E552 K578 S591 T592	L538-A576 HydrophobicContact CD1-CB 3.54Å; E552-A576 HydrophobicContact CG-CB 4.36Å; E552-A576 WeakPolarHBondContact O-CA 3.27Å; E552-A576 WeakPolarHBondContact O-CB 3.43Å; E552-A576 PolarHBondContact O-N 3.32Å; A576-K578 PolarHBondContact O-N 2.9Å; A576-S591 CarbonylContact O-C 3.6Å; A576-S591 VanDerWaalsContact O-CA 3.24Å; A576-S591 WeakPolarHBondContact O-CA 3.23Å; A576-S591 PolarHBondContact O-OG 2.95Å; A576-T592 HydrophobicContact CB-CG2 3.89Å; A576-T592 PolarHBondContact N-OG1 3.19Å; A576-T592 WeakPolarHBondContact O-CG2 3.25Å; A576-T592 PolarHBondContact O-N 2.9Å
577	V	96.6	Very high	93.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114	173.8	179.2	0	0	0	0	108.8	L538 S550 C551 V556 H573 G575 L580 G590	L538-V577 VanDerWaalsContact CB-O 3.28Å; L538-V577 WeakPolarHBondContact CB-O 3.22Å; S550-V577 PolarHBondContact OG-O 2.78Å; C551-V577 PolarHBondContact O-N 2.91Å; V556-V577 HydrophobicContact CG2-CB 4.49Å; V556-V577 HydrophobicContact CG2-CG1 4.21Å; V556-V577 HydrophobicContact CG2-CG2 3.97Å; H573-V577 HydrophobicContact CB-CG2 4.16Å; G575-V577 PolarHBondContact O-N 2.91Å; V577-L580 HydrophobicContact CG1-CD2 3.91Å; V577-L580 HydrophobicContact CG1-CG 4.43Å; V577-G590 CarbonylContact C-O 3.52Å; V577-G590 WeakPolarHBondContact CA-O 3.45Å; V577-G590 WeakPolarHBondContact CG1-O 3.5Å
578	K	94.6	Very high	93.3	Very high	76 Å²	76	37.8 Å²	37.8	33%	0.33	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-23.3	-174.4	-77.5	-173.8	167.8	173	0	114	A539 A576 G590 T592 E617 L619	A539-K578 WeakPolarHBondContact CB-O 3.32Å; A576-K578 PolarHBondContact O-N 2.9Å; K578-G590 PolarHBondContact N-O 3.44Å; K578-T592 HydrophobicContact CD-CG2 3.79Å; K578-T592 HydrophobicContact CG-CG2 4.04Å; K578-E617 IonicContact NZ-OE1 3.3Å; K578-E617 PolarHBondContact NZ-OE1 3.49Å; K578-E617 IonicContact NZ-OE2 2.94Å; K578-E617 PolarHBondContact NZ-OE2 3.28Å; K578-L619 HydrophobicContact CD-CD2 3.72Å
579	C	94.9	Very high	93.6	Very high	6 Å²	6	37.2 Å²	37.2	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	150.5	-177.7	60.2	0	0	0	0	112.4	G590 L619 D620 V621	C579-G590 PolarHBondContact N-O 3.28Å; C579-G590 PolarHBondContact O-N 2.74Å; C579-G590 VanDerWaalsContact SG-CA 3.56Å; C579-L619 VanDerWaalsContact CB-O 3.29Å; C579-L619 WeakPolarHBondContact CB-O 3.38Å; C579-D620 VanDerWaalsContact SG-CA 3.53Å; C579-V621 HydrophobicContact CB-CG1 4.31Å
580	L	97.1	Very high	93.7	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.3	-179.1	-66.6	172.3	0	0	0	110.2	A539 R541 V548 V556 V577 L587 L588	A539-L580 HydrophobicContact CB-CB 4.44Å; A539-L580 HydrophobicContact CB-CD1 4.07Å; A539-L580 HydrophobicContact CB-CG 3.97Å; A539-L580 WeakPolarHBondContact O-CD1 3.18Å; R541-L580 HydrophobicContact CG-CB 3.96Å; R541-L580 WeakPolarHBondContact CG-O 3.41Å; R541-L580 PolarHBondContact NE-O 3.36Å; V548-L580 HydrophobicContact CB-CD1 4.45Å; V548-L580 HydrophobicContact CG1-CD1 3.96Å; V548-L580 HydrophobicContact CG1-CD2 4.44Å; V556-L580 HydrophobicContact CG1-CD2 4Å; V556-L580 HydrophobicContact CG2-CD2 4.23Å; V577-L580 HydrophobicContact CG1-CD2 3.91Å; V577-L580 HydrophobicContact CG1-CG 4.43Å; L580-L587 HydrophobicContact CD2-CD1 4.3Å; L580-L588 WeakPolarHBondContact CA-O 3.46Å
581	F	96.1	Very high	93.8	Very high	47 Å²	47	35 Å²	35	21%	0.206	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	139.8	166.5	174.1	-83	0	0	0	108.5	D583 L587 L588 V621 L623	F581-D583 HydrophobicContact CE1-CB 4.3Å; F581-L587 CarbonylContact O-C 3.59Å; F581-L587 WeakPolarHBondContact O-CD1 3.41Å; F581-L588 HydrophobicContact CB-CB 4.43Å; F581-L588 HydrophobicContact CD1-CD1 4.4Å; F581-L588 PolarHBondContact N-O 2.89Å; F581-L588 VanDerWaalsContact N-O 3.08Å; F581-L588 PolarHBondContact O-N 2.89Å; F581-V621 HydrophobicContact CB-CG1 4.13Å; F581-V621 WeakPolarHBondContact CB-O 3.48Å; F581-L623 HydrophobicContact CD1-CB 3.69Å; F581-L623 HydrophobicContact CE1-CB 3.38Å; F581-L623 HydrophobicContact CZ-CB 4.14Å; F581-L623 WeakPolarHBondContact CZ-O 3.24Å
582	F	95.3	Very high	94	Very high	25 Å²	25	33.5 Å²	33.5	11%	0.11	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.8	171.1	75.2	-82.5	0	0	0	112	R541 N543 V548 H586 L587 M601	R541-F582 HydrophobicContact CB-CD1 3.68Å; R541-F582 HydrophobicContact CB-CE1 3.42Å; R541-F582 VanDerWaalsContact CB-CE1 3.42Å; N543-F582 HydrophobicContact CB-CE2 3.87Å; N543-F582 HydrophobicContact CB-CZ 3.77Å; N543-F582 VanDerWaalsContact CG-CE2 3.45Å; N543-F582 VanDerWaalsContact ND2-CE2 3.34Å; N543-F582 WeakPolarHBondContact ND2-CE2 3.46Å; V548-F582 HydrophobicContact CB-CD1 4.15Å; V548-F582 HydrophobicContact CB-CE1 4.2Å; V548-F582 HydrophobicContact CG2-CD1 3.64Å; V548-F582 HydrophobicContact CG2-CD2 4.25Å; V548-F582 HydrophobicContact CG2-CE1 3.71Å; V548-F582 HydrophobicContact CG2-CE2 4.27Å; V548-F582 HydrophobicContact CG2-CG 3.92Å; V548-F582 HydrophobicContact CG2-CZ 4.03Å; F582-H586 CarbonylContact C-O 3.51Å; F582-H586 VanDerWaalsContact CA-O 3.25Å; F582-H586 WeakPolarHBondContact CA-O 3.46Å; F582-H586 WeakPolarHBondContact CB-O 3.46Å; F582-L587 HydrophobicContact CB-CB 4.02Å; F582-L587 HydrophobicContact CB-CD1 3.75Å; F582-L587 HydrophobicContact CB-CG 4.49Å; F582-M601 HydrophobicContact CB-CG 4.23Å; F582-M601 HydrophobicContact CB-SD 4.21Å; F582-M601 HydrophobicContact CD2-CE 3.59Å; F582-M601 HydrophobicContact CD2-CG 4.3Å; F582-M601 HydrophobicContact CD2-SD 4.14Å; F582-M601 HydrophobicContact CE2-CE 3.87Å; F582-M601 HydrophobicContact CG-CE 4.36Å; F582-M601 HydrophobicContact CG-SD 4.43Å
583	D	91.2	Very high	94.4	Very high	49 Å²	49	33.7 Å²	33.7	26%	0.262	17%	0.166	S	C	.	.			trans	-119.6	-161.9	171.6	68	24.4	0	0	0	109.7	F581 W585 H586 L623	F581-D583 HydrophobicContact CE1-CB 4.3Å; D583-W585 PolarHBondContact O-N 2.82Å; D583-W585 WeakPolarHBondContact OD1-CA 3.42Å; D583-W585 PolarHBondContact OD1-N 2.75Å; D583-H586 PolarHBondContact N-O 2.85Å; D583-H586 IonicContact OD1-CG 3.98Å; D583-H586 PolarHBondContact OD1-N 2.85Å; D583-H586 IonicContact OD1-ND1 2.8Å; D583-H586 IonicContact OD2-ND1 3.54Å; D583-L623 WeakPolarHBondContact OD2-CD2 3.46Å
584	Q	89.8	Confident	94.4	Very high	137 Å²	137	33.1 Å²	33.1	64%	0.64	17%	0.165	S	C	*	.	S	Bend	trans	-63.2	-28	178.3	-175.7	175.1	0.6	0	0	113.6
585	W	90.1	Very high	94.6	Very high	51 Å²	51	26.7 Å²	26.7	19%	0.193	14%	0.135	C	C	.	.	S	Bend	trans	-119	-34.4	-166.1	-53.5	112.6	0	0	0	113.4	V352 V391 M393 D583 M601 V602	V352-W585 HydrophobicContact CB-CE3 4.36Å; V352-W585 HydrophobicContact CG1-CE3 3.52Å; V352-W585 HydrophobicContact CG1-CZ3 3.74Å; V352-W585 HydrophobicContact CG2-CD2 4.46Å; V352-W585 HydrophobicContact CG2-CE3 4.14Å; V391-W585 HydrophobicContact CG1-CZ2 3.97Å; V391-W585 HydrophobicContact CG2-CH2 4.11Å; V391-W585 HydrophobicContact CG2-CZ2 4.3Å; V391-W585 HydrophobicContact CG2-CZ3 4.45Å; M393-W585 HydrophobicContact CE-CB 3.85Å; M393-W585 VanDerWaalsContact CE-CD1 3.43Å; M393-W585 HydrophobicContact CE-CD2 3.98Å; M393-W585 HydrophobicContact CE-CG 3.47Å; M393-W585 VanDerWaalsContact CE-CG 3.47Å; D583-W585 PolarHBondContact O-N 2.82Å; D583-W585 WeakPolarHBondContact OD1-CA 3.42Å; D583-W585 PolarHBondContact OD1-N 2.75Å; W585-M601 PolarHBondContact O-N 2.8Å; W585-V602 HydrophobicContact CE3-CG2 3.56Å; W585-V602 HydrophobicContact CZ3-CG2 3.92Å
586	H	93	Very high	94.8	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	145.6	-169	-51	105.6	0	0	0	111.2	M393 F582 D583 W599 L623 F642	M393-H586 VanDerWaalsContact SD-CE1 3.59Å; F582-H586 CarbonylContact C-O 3.51Å; F582-H586 VanDerWaalsContact CA-O 3.25Å; F582-H586 WeakPolarHBondContact CA-O 3.46Å; F582-H586 WeakPolarHBondContact CB-O 3.46Å; D583-H586 PolarHBondContact N-O 2.85Å; D583-H586 IonicContact OD1-CG 3.98Å; D583-H586 PolarHBondContact OD1-N 2.85Å; D583-H586 IonicContact OD1-ND1 2.8Å; D583-H586 IonicContact OD2-ND1 3.54Å; H586-W599 CarbonylContact C-O 3.53Å; H586-W599 WeakPolarHBondContact CA-O 3.26Å; H586-L623 HydrophobicContact CB-CD2 3.85Å; H586-F642 AromaticContact CD2-CE1 3.8Å; H586-F642 AromaticContact CD2-CZ 3.4Å; H586-F642 WeakPolarHBondContact CD2-CZ 3.42Å; H586-F642 AromaticContact NE2-CE1 3.71Å; H586-F642 AromaticContact NE2-CZ 3.82Å
587	L	96	Very high	94.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.1	171.4	161.9	66	0	0	0	108.5	V548 V556 V558 L570 L580 F581 F582 A598 W599 M601	V548-L587 HydrophobicContact CB-CD1 4.44Å; V548-L587 HydrophobicContact CG1-CD1 3.75Å; V548-L587 HydrophobicContact CG1-CD2 3.9Å; V548-L587 HydrophobicContact CG2-CD1 4.36Å; V556-L587 HydrophobicContact CG1-CD2 4.1Å; V558-L587 HydrophobicContact CG2-CD2 4.12Å; L570-L587 HydrophobicContact CD1-CD2 3.41Å; L570-L587 VanDerWaalsContact CD1-CD2 3.41Å; L580-L587 HydrophobicContact CD2-CD1 4.3Å; F581-L587 CarbonylContact O-C 3.59Å; F581-L587 WeakPolarHBondContact O-CD1 3.41Å; F582-L587 HydrophobicContact CB-CB 4.02Å; F582-L587 HydrophobicContact CB-CD1 3.75Å; F582-L587 HydrophobicContact CB-CG 4.49Å; L587-A598 CarbonylContact O-C 3.54Å; L587-A598 VanDerWaalsContact O-CA 3.31Å; L587-A598 WeakPolarHBondContact O-CA 3.48Å; L587-W599 HydrophobicContact CB-CB 4.19Å; L587-W599 HydrophobicContact CD2-CB 4.37Å; L587-W599 HydrophobicContact CG-CB 4.38Å; L587-W599 PolarHBondContact N-O 2.87Å; L587-W599 PolarHBondContact O-N 3.27Å; L587-M601 HydrophobicContact CB-CG 3.79Å; L587-M601 HydrophobicContact CB-SD 3.6Å; L587-M601 HydrophobicContact CD2-SD 4Å; L587-M601 HydrophobicContact CG-SD 4.32Å
588	L	97.1	Very high	94.7	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	134.5	174.9	-58.6	-179	0	0	0	109.8	L580 F581 V596 M597 A598 V621 L623 V628 F642	L580-L588 WeakPolarHBondContact CA-O 3.46Å; F581-L588 HydrophobicContact CB-CB 4.43Å; F581-L588 HydrophobicContact CD1-CD1 4.4Å; F581-L588 PolarHBondContact N-O 2.89Å; F581-L588 VanDerWaalsContact N-O 3.08Å; F581-L588 PolarHBondContact O-N 2.89Å; L588-V596 HydrophobicContact CB-CG1 4.39Å; L588-M597 WeakPolarHBondContact CA-O 3.33Å; L588-A598 HydrophobicContact CD2-CB 3.61Å; L588-V621 HydrophobicContact CB-CG1 4.13Å; L588-V621 HydrophobicContact CB-CG2 3.95Å; L588-V621 HydrophobicContact CD1-CG2 3.77Å; L588-L623 HydrophobicContact CD1-CB 3.79Å; L588-L623 HydrophobicContact CD1-CD1 4.36Å; L588-V628 HydrophobicContact CD1-CB 4.49Å; L588-V628 HydrophobicContact CD1-CG1 4.02Å; L588-V628 HydrophobicContact CD1-CG2 4.03Å; L588-V628 HydrophobicContact CD2-CG2 4.2Å; L588-F642 HydrophobicContact CD2-CE2 4.3Å
589	S	97.4	Very high	94.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.3	173.5	55	0	0	0	0	110.5	H573 V596 M597 W599	H573-S589 PolarHBondContact CD2-OG 2.94Å; H573-S589 PolarHBondContact NE2-O 2.98Å; H573-S589 PolarHBondContact NE2-OG 2.88Å; S589-V596 CarbonylContact O-C 3.5Å; S589-V596 VanDerWaalsContact O-CA 3.26Å; S589-V596 WeakPolarHBondContact O-CA 3.49Å; S589-M597 PolarHBondContact N-O 3.2Å; S589-M597 PolarHBondContact O-N 2.8Å; S589-M597 PolarHBondContact OG-O 3.31Å; S589-W599 PolarHBondContact OG-NE1 3.07Å
590	G	96.9	Very high	94.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.1	175.6	0	0	0	0	0	111.1	V577 K578 C579	V577-G590 CarbonylContact C-O 3.52Å; V577-G590 WeakPolarHBondContact CA-O 3.45Å; V577-G590 WeakPolarHBondContact CG1-O 3.5Å; K578-G590 PolarHBondContact N-O 3.44Å; C579-G590 PolarHBondContact N-O 3.28Å; C579-G590 PolarHBondContact O-N 2.74Å; C579-G590 VanDerWaalsContact SG-CA 3.56Å
591	S	96.7	Very high	94.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	164.1	-169.1	167.7	0	0	0	0	113.5	H573 G575 A576 D593 G594 L595 V618	H573-S591 WeakPolarHBondContact ND1-CB 3.35Å; G575-S591 PolarHBondContact O-OG 2.78Å; A576-S591 CarbonylContact O-C 3.6Å; A576-S591 VanDerWaalsContact O-CA 3.24Å; A576-S591 WeakPolarHBondContact O-CA 3.23Å; A576-S591 PolarHBondContact O-OG 2.95Å; S591-D593 WeakPolarHBondContact CB-OD1 3.22Å; S591-D593 PolarHBondContact O-N 3.3Å; S591-D593 PolarHBondContact OG-N 3.15Å; S591-D593 PolarHBondContact OG-OD1 2.85Å; S591-D593 VanDerWaalsContact OG-OD1 3.07Å; S591-D593 PolarHBondContact OG-OD2 2.84Å; S591-G594 PolarHBondContact O-N 3.44Å; S591-L595 PolarHBondContact N-O 2.68Å; S591-L595 VanDerWaalsContact N-O 3.08Å; S591-V618 PolarHBondContact O-N 3.02Å; S591-V618 VanDerWaalsContact O-N 3.1Å
592	T	95.8	Very high	93.9	Very high	51 Å²	51	20.3 Å²	20.3	31%	0.313	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.1	173.5	63.3	0	0	0	0	113.6	G575 A576 K578 G594 E617	G575-T592 WeakPolarHBondContact CA-OG1 3.42Å; A576-T592 HydrophobicContact CB-CG2 3.89Å; A576-T592 PolarHBondContact N-OG1 3.19Å; A576-T592 WeakPolarHBondContact O-CG2 3.25Å; A576-T592 PolarHBondContact O-N 2.9Å; K578-T592 HydrophobicContact CD-CG2 3.79Å; K578-T592 HydrophobicContact CG-CG2 4.04Å; T592-G594 PolarHBondContact O-N 3.34Å; T592-E617 HydrophobicContact CG2-CB 4.3Å; T592-E617 WeakPolarHBondContact CG2-OE2 3.26Å
593	D	93.6	Very high	93.2	Very high	46 Å²	46	20.5 Å²	20.5	25%	0.246	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-3.7	171.1	60.2	19.6	0	0	0	113.5	H573 E574 S591 L595	H573-D593 WeakPolarHBondContact CA-OD2 3.36Å; H573-D593 WeakPolarHBondContact CB-OD2 3.31Å; H573-D593 IonicContact CG-OD2 3.06Å; H573-D593 IonicContact ND1-OD1 3.54Å; H573-D593 IonicContact ND1-OD2 2.66Å; H573-D593 PolarHBondContact ND1-OD2 2.7Å; E574-D593 PolarHBondContact N-OD2 3.33Å; S591-D593 WeakPolarHBondContact CB-OD1 3.22Å; S591-D593 PolarHBondContact O-N 3.3Å; S591-D593 PolarHBondContact OG-N 3.15Å; S591-D593 PolarHBondContact OG-OD1 2.85Å; S591-D593 VanDerWaalsContact OG-OD1 3.07Å; S591-D593 PolarHBondContact OG-OD2 2.84Å; D593-L595 VanDerWaalsContact C-N 3.31Å; D593-L595 WeakPolarHBondContact OD1-CA 3.4Å; D593-L595 VanDerWaalsContact OD1-CB 3.25Å; D593-L595 WeakPolarHBondContact OD1-CB 3.41Å; D593-L595 PolarHBondContact OD1-N 3Å
594	G	92.6	Very high	92.8	Very high	3 Å²	3	24.4 Å²	24.4	3%	0.031	13%	0.125	C	C	.	.	S	Bend	trans	76.9	16.4	-177.9	0	0	0	0	0	113.5	S591 T592 H614 K616	S591-G594 PolarHBondContact O-N 3.44Å; T592-G594 PolarHBondContact O-N 3.34Å; G594-H614 WeakPolarHBondContact O-CA 3.44Å; G594-H614 VanDerWaalsContact O-CB 3.32Å; G594-H614 WeakPolarHBondContact O-CB 3.43Å; G594-H614 PolarHBondContact O-N 3.27Å; G594-K616 VanDerWaalsContact CA-O 3.32Å; G594-K616 WeakPolarHBondContact CA-O 3.32Å
595	L	94.9	Very high	92.6	Very high	39 Å²	39	18.7 Å²	18.7	20%	0.204	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.8	175.6	-57.1	175.1	0	0	0	110.6	H573 S591 D593 M597 F612 K613	H573-L595 PolarHBondContact CE1-O 3.27Å; S591-L595 PolarHBondContact N-O 2.68Å; S591-L595 VanDerWaalsContact N-O 3.08Å; D593-L595 VanDerWaalsContact C-N 3.31Å; D593-L595 WeakPolarHBondContact OD1-CA 3.4Å; D593-L595 VanDerWaalsContact OD1-CB 3.25Å; D593-L595 WeakPolarHBondContact OD1-CB 3.41Å; D593-L595 PolarHBondContact OD1-N 3Å; L595-M597 HydrophobicContact CB-CE 4.43Å; L595-M597 HydrophobicContact CB-CG 4.5Å; L595-M597 HydrophobicContact CD1-CE 3.59Å; L595-F612 WeakPolarHBondContact CA-O 3.46Å; L595-K613 HydrophobicContact CD2-CB 4.39Å; L595-K613 HydrophobicContact CD2-CG 3.67Å
596	V	96.4	Very high	92.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.4	154.2	179.6	0	0	0	0	107.3	L588 S589 A611 F612 V618 V621 V628	L588-V596 HydrophobicContact CB-CG1 4.39Å; S589-V596 CarbonylContact O-C 3.5Å; S589-V596 VanDerWaalsContact O-CA 3.26Å; S589-V596 WeakPolarHBondContact O-CA 3.49Å; V596-A611 CarbonylContact O-C 3.59Å; V596-A611 WeakPolarHBondContact O-CA 3.38Å; V596-F612 HydrophobicContact CB-CB 4.19Å; V596-F612 HydrophobicContact CB-CD2 4.04Å; V596-F612 HydrophobicContact CG1-CD2 4.05Å; V596-F612 PolarHBondContact N-O 2.88Å; V596-F612 WeakPolarHBondContact O-CD2 3.44Å; V596-F612 PolarHBondContact O-N 3.21Å; V596-V618 HydrophobicContact CG2-CB 4.23Å; V596-V618 HydrophobicContact CG2-CG1 3.74Å; V596-V618 HydrophobicContact CG2-CG2 3.82Å; V596-V621 HydrophobicContact CG1-CG2 3.8Å; V596-V621 HydrophobicContact CG2-CG2 4.39Å; V596-V628 HydrophobicContact CG1-CG1 4.15Å
597	M	94.9	Very high	92	Very high	10 Å²	10	23.4 Å²	23.4	5%	0.049	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.5	173.3	-68.1	-173.5	-178	0	0	110.3	G572 L588 S589 L595 W599 M610 A611	G572-M597 WeakPolarHBondContact O-CE 3.45Å; L588-M597 WeakPolarHBondContact CA-O 3.33Å; S589-M597 PolarHBondContact N-O 3.2Å; S589-M597 PolarHBondContact O-N 2.8Å; S589-M597 PolarHBondContact OG-O 3.31Å; L595-M597 HydrophobicContact CB-CE 4.43Å; L595-M597 HydrophobicContact CB-CG 4.5Å; L595-M597 HydrophobicContact CD1-CE 3.59Å; M597-W599 HydrophobicContact CB-CZ2 3.72Å; M597-W599 HydrophobicContact CG-CZ2 4.29Å; M597-W599 HydrophobicContact SD-CH2 4Å; M597-W599 HydrophobicContact SD-CZ2 3.57Å; M597-W599 VanDerWaalsContact SD-CZ2 3.57Å; M597-M610 CarbonylContact C-O 3.52Å; M597-M610 WeakPolarHBondContact CA-O 3.45Å; M597-A611 HydrophobicContact CG-CB 4.43Å
598	A	94.7	Very high	91.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.4	173.1	0	0	0	0	0	110.4	L587 L588 C608 L609 M610 F612 F642	L587-A598 CarbonylContact O-C 3.54Å; L587-A598 VanDerWaalsContact O-CA 3.31Å; L587-A598 WeakPolarHBondContact O-CA 3.48Å; L588-A598 HydrophobicContact CD2-CB 3.61Å; A598-C608 CarbonylContact O-C 3.55Å; A598-L609 HydrophobicContact CB-CB 4.28Å; A598-L609 PolarHBondContact O-N 2.81Å; A598-M610 HydrophobicContact CB-CB 3.95Å; A598-M610 PolarHBondContact N-O 3.42Å; A598-F612 HydrophobicContact CB-CE2 4.36Å; A598-F642 HydrophobicContact CB-CE2 3.6Å; A598-F642 HydrophobicContact CB-CZ 4.05Å
599	W	93.8	Very high	91.2	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.015	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	155.1	-175.6	-48.2	91.4	0	0	0	109.6	L570 H586 L587 S589 M597 E606 C608 L609	L570-W599 HydrophobicContact CB-CD2 4.15Å; L570-W599 HydrophobicContact CB-CE3 4.09Å; L570-W599 HydrophobicContact CB-CH2 4.3Å; L570-W599 HydrophobicContact CB-CZ2 4.36Å; L570-W599 HydrophobicContact CB-CZ3 4.17Å; L570-W599 HydrophobicContact CD1-CB 3.82Å; L570-W599 HydrophobicContact CD1-CD2 3.85Å; L570-W599 HydrophobicContact CD1-CE3 4.27Å; L570-W599 HydrophobicContact CD1-CG 3.64Å; L570-W599 HydrophobicContact CD2-CD2 4.24Å; L570-W599 HydrophobicContact CD2-CE3 3.79Å; L570-W599 HydrophobicContact CD2-CZ3 4.34Å; L570-W599 HydrophobicContact CG-CD2 4.3Å; L570-W599 HydrophobicContact CG-CE3 4.27Å; H586-W599 CarbonylContact C-O 3.53Å; H586-W599 WeakPolarHBondContact CA-O 3.26Å; L587-W599 HydrophobicContact CB-CB 4.19Å; L587-W599 HydrophobicContact CD2-CB 4.37Å; L587-W599 HydrophobicContact CG-CB 4.38Å; L587-W599 PolarHBondContact N-O 2.87Å; L587-W599 PolarHBondContact O-N 3.27Å; S589-W599 PolarHBondContact OG-NE1 3.07Å; M597-W599 HydrophobicContact CB-CZ2 3.72Å; M597-W599 HydrophobicContact CG-CZ2 4.29Å; M597-W599 HydrophobicContact SD-CH2 4Å; M597-W599 HydrophobicContact SD-CZ2 3.57Å; M597-W599 VanDerWaalsContact SD-CZ2 3.57Å; W599-E606 WeakPolarHBondContact CZ3-O 3.19Å; W599-C608 HydrophobicContact CE3-CB 4.06Å; W599-C608 HydrophobicContact CH2-CB 3.94Å; W599-C608 HydrophobicContact CZ3-CB 3.68Å; W599-L609 VanDerWaalsContact C-CD1 3.44Å
600	S	92	Very high	90.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	133.7	170.2	-175.5	0	0	0	0	109.6	K568 V602	K568-S600 WeakPolarHBondContact CE-O 3.31Å; K568-S600 PolarHBondContact NZ-O 2.9Å; S600-V602 PolarHBondContact OG-N 3.17Å
601	M	91.6	Very high	90.6	Very high	8 Å²	8	25.6 Å²	25.6	4%	0.039	14%	0.136	C	C	.	.			trans	-79.3	-22.6	166.5	-79.8	-60.6	-67.3	0	0	112.2	Y546 V548 V558 K568 F582 W585 L587	Y546-M601 HydrophobicContact CD2-CE 4.22Å; Y546-M601 HydrophobicContact CG-CE 4.32Å; V548-M601 HydrophobicContact CG2-CE 4.07Å; V548-M601 HydrophobicContact CG2-SD 4.22Å; V558-M601 HydrophobicContact CG1-CE 3.92Å; V558-M601 HydrophobicContact CG2-SD 4.3Å; K568-M601 VanDerWaalsContact NZ-C 3.25Å; K568-M601 PolarHBondContact NZ-O 3.22Å; F582-M601 HydrophobicContact CB-CG 4.23Å; F582-M601 HydrophobicContact CB-SD 4.21Å; F582-M601 HydrophobicContact CD2-CE 3.59Å; F582-M601 HydrophobicContact CD2-CG 4.3Å; F582-M601 HydrophobicContact CD2-SD 4.14Å; F582-M601 HydrophobicContact CE2-CE 3.87Å; F582-M601 HydrophobicContact CG-CE 4.36Å; F582-M601 HydrophobicContact CG-SD 4.43Å; W585-M601 PolarHBondContact O-N 2.8Å; L587-M601 HydrophobicContact CB-CG 3.79Å; L587-M601 HydrophobicContact CB-SD 3.6Å; L587-M601 HydrophobicContact CD2-SD 4Å; L587-M601 HydrophobicContact CG-SD 4.32Å
602	V	88	Confident	90.4	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.018	14%	0.136	C	C	.	.	S	Bend	trans	-73.4	130.4	-176.7	-177.1	0	0	0	0	112.2	V352 P353 M355 W585 S600	V352-V602 HydrophobicContact CG1-CB 4.13Å; V352-V602 HydrophobicContact CG1-CG1 4.43Å; V352-V602 HydrophobicContact CG1-CG2 3.51Å; P353-V602 HydrophobicContact CB-CG1 4.35Å; P353-V602 VanDerWaalsContact O-CG1 3.31Å; P353-V602 WeakPolarHBondContact O-CG1 3.26Å; M355-V602 HydrophobicContact CE-CB 4.41Å; M355-V602 HydrophobicContact CE-CG1 3.74Å; M355-V602 HydrophobicContact CG-CG1 3.63Å; W585-V602 HydrophobicContact CE3-CG2 3.56Å; W585-V602 HydrophobicContact CZ3-CG2 3.92Å; S600-V602 PolarHBondContact OG-N 3.17Å
603	G	81.6	Confident	90.2	Very high	29 Å²	29	29.3 Å²	29.3	30%	0.299	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	-156	173.3	0	0	0	0	0	114.4	K568 Y605	K568-G603 PolarHBondContact NZ-O 2.78Å; G603-Y605 VanDerWaalsContact C-N 3.26Å; G603-Y605 PolarHBondContact O-N 3.34Å
604	K	83.1	Confident	90.2	Very high	130 Å²	130	28 Å²	28	57%	0.565	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	10.3	177.8	-64.5	-178.7	-178.7	171.3	0	113.3	E606	K604-E606 PolarHBondContact O-N 3.49Å
605	Y	84.2	Confident	90.2	Very high	18 Å²	18	32 Å²	32	7%	0.071	17%	0.165	C	C	.	.			trans	-63	119.6	-179.3	-171.9	-89.2	0	0	0	110.4	P353 A382 Y383 E386 K568 G603 R607 L609	P353-Y605 HydrophobicContact CG-CG 4.38Å; A382-Y605 PolarHBondContact O-OH 3.31Å; Y383-Y605 HydrophobicContact CD1-CE1 4.24Å; Y383-Y605 AromaticContact CD1-CE2 3.96Å; Y383-Y605 HydrophobicContact CD1-CE2 3.96Å; Y383-Y605 AromaticContact CD1-CZ 3.76Å; Y383-Y605 HydrophobicContact CE1-CD1 4.12Å; Y383-Y605 HydrophobicContact CE1-CD2 4.49Å; Y383-Y605 AromaticContact CE1-CE1 3.77Å; Y383-Y605 HydrophobicContact CE1-CE1 3.77Å; Y383-Y605 HydrophobicContact CE1-CE2 4.18Å; Y383-Y605 HydrophobicContact CE1-CG 4.44Å; Y383-Y605 AromaticContact CE1-CZ 3.78Å; E386-Y605 HydrophobicContact CG-CD2 3.85Å; E386-Y605 HydrophobicContact CG-CE2 3.66Å; K568-Y605 WeakPolarHBondContact CD-O 3.28Å; G603-Y605 VanDerWaalsContact C-N 3.26Å; G603-Y605 PolarHBondContact O-N 3.34Å; Y605-R607 HydrophobicContact CE1-CB 3.73Å; Y605-R607 WeakPolarHBondContact CE1-O 3.31Å; Y605-R607 HydrophobicContact CE2-CB 4.47Å; Y605-R607 WeakPolarHBondContact OH-CB 3.44Å; Y605-L609 HydrophobicContact CD1-CD2 4.48Å; Y605-L609 HydrophobicContact CE1-CD2 3.69Å
606	E	85.6	Confident	90.2	Very high	100 Å²	100	35.7 Å²	35.7	47%	0.467	18%	0.18	S	C	.	.			trans	-114	-5.3	-168.9	64.8	179.1	-176	0	0	114.4	L570 W599 K604	L570-E606 HydrophobicContact CD2-CB 4.02Å; W599-E606 WeakPolarHBondContact CZ3-O 3.19Å; K604-E606 PolarHBondContact O-N 3.49Å
607	R	85.1	Confident	90.1	Very high	50 Å²	50	38.6 Å²	38.6	19%	0.189	19%	0.193	C	C	.	.	S	Bend	trans	-76	147	-179.2	-65.5	-176.5	-179.8	144.2	7.1	111.5	H366 Y605 L609	H366-R607 PolarHBondContact CE1-NH2 2.61Å; H366-R607 PolarHBondContact ND1-NH2 3.11Å; H366-R607 PolarHBondContact NE2-NH2 3.01Å; Y605-R607 HydrophobicContact CE1-CB 3.73Å; Y605-R607 WeakPolarHBondContact CE1-O 3.31Å; Y605-R607 HydrophobicContact CE2-CB 4.47Å; Y605-R607 WeakPolarHBondContact OH-CB 3.44Å; R607-L609 PolarHBondContact O-N 3.06Å
608	C	88.8	Confident	90.2	Very high	28 Å²	28	38.1 Å²	38.1	19%	0.189	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	124.5	172.7	-177.1	0	0	0	0	109.4	A598 W599 M610	A598-C608 CarbonylContact O-C 3.55Å; W599-C608 HydrophobicContact CE3-CB 4.06Å; W599-C608 HydrophobicContact CH2-CB 3.94Å; W599-C608 HydrophobicContact CZ3-CB 3.68Å; C608-M610 PolarHBondContact SG-O 3.44Å
609	L	88.1	Confident	90.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-44.2	177.8	-59	-179.5	0	0	0	111.4	L379 A382 Y383 A598 W599 Y605 R607 F642	L379-L609 HydrophobicContact CD1-CB 3.87Å; L379-L609 HydrophobicContact CD1-CD1 3.95Å; L379-L609 HydrophobicContact CD1-CD2 4.16Å; L379-L609 HydrophobicContact CD1-CG 4.21Å; A382-L609 HydrophobicContact CB-CD2 3.91Å; Y383-L609 HydrophobicContact CD1-CD2 4.48Å; Y383-L609 HydrophobicContact CE1-CD2 3.66Å; Y383-L609 HydrophobicContact CE2-CD2 3.87Å; Y383-L609 WeakPolarHBondContact OH-CD1 3.21Å; Y383-L609 VanDerWaalsContact OH-CD2 3.31Å; Y383-L609 WeakPolarHBondContact OH-CD2 3.39Å; A598-L609 HydrophobicContact CB-CB 4.28Å; A598-L609 PolarHBondContact O-N 2.81Å; W599-L609 VanDerWaalsContact C-CD1 3.44Å; Y605-L609 HydrophobicContact CD1-CD2 4.48Å; Y605-L609 HydrophobicContact CE1-CD2 3.69Å; R607-L609 PolarHBondContact O-N 3.06Å; L609-F642 HydrophobicContact CD1-CZ 4.37Å
610	M	89	Confident	90.1	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	147	-172.7	-155.5	64	64.4	0	0	110.7	Y377 L379 M597 A598 C608 F612 F642 F643	Y377-M610 VanDerWaalsContact C-SD 3.53Å; L379-M610 HydrophobicContact CB-CE 3.97Å; M597-M610 CarbonylContact C-O 3.52Å; M597-M610 WeakPolarHBondContact CA-O 3.45Å; A598-M610 HydrophobicContact CB-CB 3.95Å; A598-M610 PolarHBondContact N-O 3.42Å; C608-M610 PolarHBondContact SG-O 3.44Å; M610-F612 HydrophobicContact CB-CE2 4.02Å; M610-F612 HydrophobicContact CB-CZ 3.94Å; M610-F612 HydrophobicContact CG-CE1 3.93Å; M610-F612 HydrophobicContact CG-CE2 3.99Å; M610-F612 HydrophobicContact CG-CZ 3.51Å; M610-F642 WeakPolarHBondContact CE-O 3.39Å; M610-F643 WeakPolarHBondContact CE-O 3.42Å
611	A	91.5	Very high	90.3	Very high	17 Å²	17	40 Å²	40	14%	0.14	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.4	175	0	0	0	0	0	111.5	Y377 V596 M597	Y377-A611 HydrophobicContact CD1-CB 4.38Å; Y377-A611 HydrophobicContact CD2-CB 4.07Å; Y377-A611 HydrophobicContact CE1-CB 4.39Å; Y377-A611 HydrophobicContact CE2-CB 4.07Å; Y377-A611 HydrophobicContact CG-CB 4.23Å; V596-A611 CarbonylContact O-C 3.59Å; V596-A611 WeakPolarHBondContact O-CA 3.38Å; M597-A611 HydrophobicContact CG-CB 4.43Å
612	F	92.7	Very high	90.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.8	-178.5	-46.9	-90.8	0	0	0	110.5	L595 V596 A598 M610 H614 V628 Y640 F642	L595-F612 WeakPolarHBondContact CA-O 3.46Å; V596-F612 HydrophobicContact CB-CB 4.19Å; V596-F612 HydrophobicContact CB-CD2 4.04Å; V596-F612 HydrophobicContact CG1-CD2 4.05Å; V596-F612 PolarHBondContact N-O 2.88Å; V596-F612 WeakPolarHBondContact O-CD2 3.44Å; V596-F612 PolarHBondContact O-N 3.21Å; A598-F612 HydrophobicContact CB-CE2 4.36Å; M610-F612 HydrophobicContact CB-CE2 4.02Å; M610-F612 HydrophobicContact CB-CZ 3.94Å; M610-F612 HydrophobicContact CG-CE1 3.93Å; M610-F612 HydrophobicContact CG-CE2 3.99Å; M610-F612 HydrophobicContact CG-CZ 3.51Å; F612-H614 PolarHBondContact O-ND1 3.45Å; F612-V628 HydrophobicContact CD2-CG1 4.19Å; F612-V628 HydrophobicContact CD2-CG2 4.44Å; F612-V628 HydrophobicContact CE1-CG2 4.3Å; F612-V628 HydrophobicContact CE2-CB 4.27Å; F612-V628 HydrophobicContact CE2-CG1 4.25Å; F612-V628 HydrophobicContact CE2-CG2 3.7Å; F612-V628 HydrophobicContact CZ-CB 4.24Å; F612-V628 HydrophobicContact CZ-CG2 3.62Å; F612-Y640 HydrophobicContact CB-CD1 4.2Å; F612-Y640 HydrophobicContact CB-CD2 4.31Å; F612-Y640 HydrophobicContact CB-CE1 4.18Å; F612-Y640 HydrophobicContact CB-CE2 4.33Å; F612-Y640 HydrophobicContact CB-CG 4.26Å; F612-Y640 VanDerWaalsContact CD1-CB 3.49Å; F612-Y640 AromaticContact CD1-CD1 3.67Å; F612-Y640 HydrophobicContact CD1-CD1 3.67Å; F612-Y640 HydrophobicContact CD1-CD2 4.32Å; F612-Y640 HydrophobicContact CD1-CE1 4.44Å; F612-Y640 AromaticContact CD1-CG 3.58Å; F612-Y640 HydrophobicContact CD1-CG 3.58Å; F612-Y640 HydrophobicContact CE1-CG 4.31Å; F612-Y640 HydrophobicContact CG-CD1 4.37Å; F612-Y640 HydrophobicContact CG-CG 4.2Å; F612-F642 HydrophobicContact CZ-CD2 4.26Å
613	K	91.9	Very high	90.6	Very high	126 Å²	126	41 Å²	41	55%	0.548	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	137.5	-173.1	-61.2	-171.4	175.9	178.7	0	112.8	L595 Y640	L595-K613 HydrophobicContact CD2-CB 4.39Å; L595-K613 HydrophobicContact CD2-CG 3.67Å; K613-Y640 PolarHBondContact O-OH 3.35Å
614	H	93.8	Very high	91	Very high	18 Å²	18	41.8 Å²	41.8	8%	0.083	21%	0.205	C	C	.	.			trans	-126.9	152.6	177.6	-63.6	76	0	0	0	110.4	G594 F612 K616 V618 S630 Y640	G594-H614 WeakPolarHBondContact O-CA 3.44Å; G594-H614 VanDerWaalsContact O-CB 3.32Å; G594-H614 WeakPolarHBondContact O-CB 3.43Å; G594-H614 PolarHBondContact O-N 3.27Å; F612-H614 PolarHBondContact O-ND1 3.45Å; H614-K616 VanDerWaalsContact C-N 3.31Å; H614-K616 WeakPolarHBondContact CB-O 3.47Å; H614-K616 PolarHBondContact O-N 3.32Å; H614-V618 HydrophobicContact CB-CG2 4.05Å; H614-S630 PolarHBondContact CE1-OG 3.49Å; H614-S630 VanDerWaalsContact CE1-OG 3.31Å; H614-S630 WeakPolarHBondContact NE2-CB 3.29Å; H614-S630 PolarHBondContact NE2-OG 3.03Å; H614-Y640 AromaticContact CE1-CE2 3.57Å; H614-Y640 AromaticContact CE1-CZ 3.84Å; H614-Y640 AromaticContact NE2-CE2 3.37Å; H614-Y640 WeakPolarHBondContact NE2-CE2 3.03Å; H614-Y640 AromaticContact NE2-CZ 3.8Å; H614-Y640 PolarHBondContact NE2-OH 2.98Å
615	P	92.6	Very high	91.3	Very high	88 Å²	88	38.9 Å²	38.9	57%	0.571	19%	0.193	S	C	*	.	S	Bend	trans	-74.7	-20	-179.9	29.6	-35.6	0	0	0	113.8	D634	P615-D634 HydrophobicContact CG-CB 4.09Å; P615-D634 VanDerWaalsContact CG-OD2 3.23Å; P615-D634 WeakPolarHBondContact CG-OD2 3.39Å
616	K	94.3	Very high	91.5	Very high	117 Å²	117	38.4 Å²	38.4	51%	0.509	19%	0.191	S	C	.	.	S	Bend	trans	-139.2	177.6	178	-67	-170.1	179	-180	0	109.3	G594 H614 C632 A633 D634	G594-K616 VanDerWaalsContact CA-O 3.32Å; G594-K616 WeakPolarHBondContact CA-O 3.32Å; H614-K616 VanDerWaalsContact C-N 3.31Å; H614-K616 WeakPolarHBondContact CB-O 3.47Å; H614-K616 PolarHBondContact O-N 3.32Å; K616-C632 PolarHBondContact O-SG 3.02Å; K616-A633 HydrophobicContact CB-CB 4.1Å; K616-A633 HydrophobicContact CD-CB 4.38Å; K616-D634 HydrophobicContact CD-CB 4.17Å; K616-D634 HydrophobicContact CG-CB 4.36Å
617	E	95	Very high	91.7	Very high	61 Å²	61	33.9 Å²	33.9	29%	0.285	17%	0.17	S	C	.	.			trans	-53.1	143	176.1	60.1	178.1	-156.3	0	0	113.3	K578 T592 L619 A633	K578-E617 IonicContact NZ-OE1 3.3Å; K578-E617 PolarHBondContact NZ-OE1 3.49Å; K578-E617 IonicContact NZ-OE2 2.94Å; K578-E617 PolarHBondContact NZ-OE2 3.28Å; T592-E617 HydrophobicContact CG2-CB 4.3Å; T592-E617 WeakPolarHBondContact CG2-OE2 3.26Å; E617-L619 HydrophobicContact CG-CD2 4.12Å; E617-A633 HydrophobicContact CG-CB 3.53Å; E617-A633 PolarHBondContact O-N 3.06Å
618	V	96.3	Very high	92.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.1	176.5	-174.1	0	0	0	0	108.2	S591 V596 H614 A631	S591-V618 PolarHBondContact O-N 3.02Å; S591-V618 VanDerWaalsContact O-N 3.1Å; V596-V618 HydrophobicContact CG2-CB 4.23Å; V596-V618 HydrophobicContact CG2-CG1 3.74Å; V596-V618 HydrophobicContact CG2-CG2 3.82Å; H614-V618 HydrophobicContact CB-CG2 4.05Å; V618-A631 WeakPolarHBondContact CG1-O 3.16Å
619	L	93.5	Very high	92.4	Very high	24 Å²	24	30.3 Å²	30.3	13%	0.126	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-28.3	-172.6	-62.8	179.4	0	0	0	112.7	K578 C579 E617 A631 A633 P659 V660 L661	K578-L619 HydrophobicContact CD-CD2 3.72Å; C579-L619 VanDerWaalsContact CB-O 3.29Å; C579-L619 WeakPolarHBondContact CB-O 3.38Å; E617-L619 HydrophobicContact CG-CD2 4.12Å; L619-A631 PolarHBondContact N-O 3.35Å; L619-A633 HydrophobicContact CD1-CB 4Å; L619-A633 HydrophobicContact CG-CB 4.35Å; L619-P659 HydrophobicContact CD1-CB 3.98Å; L619-V660 WeakPolarHBondContact CB-O 3.26Å; L619-V660 WeakPolarHBondContact CD1-O 3.45Å; L619-L661 HydrophobicContact CD1-CD2 3.79Å
620	D	93.9	Very high	92.7	Very high	17 Å²	17	30.3 Å²	30.3	9%	0.091	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	153.2	175.2	-162.3	11.9	0	0	0	111.6	C579 S630 A631 S662 F663	C579-D620 VanDerWaalsContact SG-CA 3.53Å; D620-S630 WeakPolarHBondContact O-CA 3.21Å; D620-A631 HydrophobicContact CB-CB 4.1Å; D620-A631 PolarHBondContact O-N 2.83Å; D620-S662 VanDerWaalsContact OD2-CA 3.28Å; D620-S662 WeakPolarHBondContact OD2-CA 3.44Å; D620-F663 HydrophobicContact CB-CD1 3.89Å; D620-F663 HydrophobicContact CB-CE1 3.83Å; D620-F663 PolarHBondContact OD2-N 3.28Å
621	V	95.9	Very high	92.9	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	144.6	-175.5	70.3	0	0	0	0	111.4	C579 F581 L588 V596 V628 I629	C579-V621 HydrophobicContact CB-CG1 4.31Å; F581-V621 HydrophobicContact CB-CG1 4.13Å; F581-V621 WeakPolarHBondContact CB-O 3.48Å; L588-V621 HydrophobicContact CB-CG1 4.13Å; L588-V621 HydrophobicContact CB-CG2 3.95Å; L588-V621 HydrophobicContact CD1-CG2 3.77Å; V596-V621 HydrophobicContact CG1-CG2 3.8Å; V596-V621 HydrophobicContact CG2-CG2 4.39Å; V621-V628 HydrophobicContact CG2-CG1 4.21Å; V621-I629 CarbonylContact C-O 3.58Å; V621-I629 WeakPolarHBondContact CA-O 3.44Å
622	S	93.4	Very high	93.1	Very high	21 Å²	21	29.4 Å²	29.4	15%	0.147	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.1	173.8	-170.8	0	0	0	0	110.6	I629	S622-I629 PolarHBondContact N-O 2.74Å; S622-I629 PolarHBondContact O-N 3.44Å
623	L	92.2	Very high	93.1	Very high	12 Å²	12	30 Å²	30	6%	0.063	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.8	168.7	-169.6	61.4	0	0	0	108.9	F581 D583 H586 L588 R627 V628 F642	F581-L623 HydrophobicContact CD1-CB 3.69Å; F581-L623 HydrophobicContact CE1-CB 3.38Å; F581-L623 HydrophobicContact CZ-CB 4.14Å; F581-L623 WeakPolarHBondContact CZ-O 3.24Å; D583-L623 WeakPolarHBondContact OD2-CD2 3.46Å; H586-L623 HydrophobicContact CB-CD2 3.85Å; L588-L623 HydrophobicContact CD1-CB 3.79Å; L588-L623 HydrophobicContact CD1-CD1 4.36Å; L623-R627 WeakPolarHBondContact CA-O 3.38Å; L623-V628 HydrophobicContact CD1-CG2 3.76Å; L623-F642 HydrophobicContact CD1-CD2 4.09Å
624	L	89.9	Confident	93	Very high	45 Å²	45	25 Å²	25	24%	0.236	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	123.3	172.1	-176	62.4	0	0	0	110	V398 L626 R627 I629 I665	V398-L624 HydrophobicContact CG1-CD2 3.66Å; V398-L624 HydrophobicContact CG1-CG 4.44Å; V398-L624 HydrophobicContact CG2-CB 4.23Å; V398-L624 HydrophobicContact CG2-CD2 4.24Å; V398-L624 HydrophobicContact CG2-CG 4.16Å; V398-L624 WeakPolarHBondContact CG2-O 3.25Å; L624-L626 VanDerWaalsContact C-N 3.26Å; L624-L626 PolarHBondContact O-N 2.86Å; L624-R627 PolarHBondContact N-O 2.88Å; L624-R627 WeakPolarHBondContact O-CA 3.46Å; L624-R627 VanDerWaalsContact O-CB 3.26Å; L624-R627 WeakPolarHBondContact O-CB 3.11Å; L624-R627 PolarHBondContact O-N 3.47Å; L624-I629 HydrophobicContact CB-CD1 4.48Å; L624-I665 HydrophobicContact CD2-CG2 3.55Å
625	F	88.9	Confident	92.8	Very high	69 Å²	69	24.1 Å²	24.1	30%	0.303	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	47.5	-177.6	-48.6	-61.9	0	0	0	113.3	E394 E395 R396 V398 R627	E394-F625 CarbonylContact O-C 3.58Å; E394-F625 VanDerWaalsContact O-C 3.26Å; E394-F625 VanDerWaalsContact O-CA 3.26Å; E394-F625 WeakPolarHBondContact O-CA 3.34Å; E395-F625 WeakPolarHBondContact CA-O 3.43Å; R396-F625 HydrophobicContact CB-CB 3.64Å; R396-F625 HydrophobicContact CB-CD1 4.48Å; R396-F625 HydrophobicContact CB-CD2 3.71Å; R396-F625 HydrophobicContact CB-CG 3.71Å; R396-F625 HydrophobicContact CG-CB 3.96Å; R396-F625 HydrophobicContact CG-CD1 4.04Å; R396-F625 HydrophobicContact CG-CD2 4.05Å; R396-F625 HydrophobicContact CG-CG 3.77Å; R396-F625 PolarHBondContact N-O 3.19Å; V398-F625 HydrophobicContact CG2-CD2 4.09Å; F625-R627 PolarHBondContact O-N 3.02Å; F625-R627 VanDerWaalsContact O-N 3.15Å
626	L	88.9	Confident	92.7	Very high	8 Å²	8	23.4 Å²	23.4	4%	0.042	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	26.3	-178.3	-54.8	161.2	0	0	0	113.9	I350 M393 E395 L624 F642 F643	I350-L626 HydrophobicContact CD1-CD1 3.63Å; I350-L626 HydrophobicContact CD1-CD2 3.52Å; I350-L626 HydrophobicContact CD1-CG 4.21Å; M393-L626 HydrophobicContact CB-CD1 3.9Å; M393-L626 HydrophobicContact CB-CD2 4.49Å; M393-L626 HydrophobicContact SD-CD2 4.19Å; E395-L626 HydrophobicContact CB-CD1 4.24Å; L624-L626 VanDerWaalsContact C-N 3.26Å; L624-L626 PolarHBondContact O-N 2.86Å; L626-F642 HydrophobicContact CB-CB 4.28Å; L626-F642 HydrophobicContact CD2-CD1 4.48Å; L626-F642 WeakPolarHBondContact O-CB 3.42Å; L626-F642 PolarHBondContact O-N 3.23Å; L626-F642 VanDerWaalsContact O-N 3.12Å; L626-F643 HydrophobicContact CB-CE2 4.41Å; L626-F643 HydrophobicContact CD1-CE2 3.93Å; L626-F643 HydrophobicContact CD1-CZ 3.68Å
627	R	90.6	Very high	92.6	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.015	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.5	166.7	-59.3	-67.8	178.9	-107.1	6.2	109.1	E395 R396 N397 V398 L623 L624 F625 I629 I639 Y640 N641 M648	E395-R627 IonicContact OE1-CZ 3.38Å; E395-R627 IonicContact OE1-NH1 3.78Å; E395-R627 PolarHBondContact OE1-NH1 2.85Å; E395-R627 IonicContact OE1-NH2 3.96Å; E395-R627 PolarHBondContact OE1-NH2 2.79Å; R396-R627 WeakPolarHBondContact O-CG 3.46Å; R396-R627 PolarHBondContact O-NE 2.94Å; N397-R627 PolarHBondContact OD1-NH2 2.82Å; V398-R627 HydrophobicContact CG2-CB 3.84Å; V398-R627 HydrophobicContact CG2-CG 3.71Å; L623-R627 WeakPolarHBondContact CA-O 3.38Å; L624-R627 PolarHBondContact N-O 2.88Å; L624-R627 WeakPolarHBondContact O-CA 3.46Å; L624-R627 VanDerWaalsContact O-CB 3.26Å; L624-R627 WeakPolarHBondContact O-CB 3.11Å; L624-R627 PolarHBondContact O-N 3.47Å; F625-R627 PolarHBondContact O-N 3.02Å; F625-R627 VanDerWaalsContact O-N 3.15Å; R627-I629 PolarHBondContact O-N 2.76Å; R627-I639 HydrophobicContact CB-CG2 3.93Å; R627-I639 HydrophobicContact CG-CG2 4.34Å; R627-Y640 CarbonylContact C-O 3.54Å; R627-Y640 VanDerWaalsContact CA-O 3.3Å; R627-Y640 WeakPolarHBondContact CA-O 3.34Å; R627-N641 PolarHBondContact NH1-ND2 3.43Å; R627-M648 PolarHBondContact NE-SD 2.79Å
628	V	93.4	Very high	92.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.2	172.3	175.9	0	0	0	0	107.4	L588 V596 F612 V621 L623 I639 Y640 F642	L588-V628 HydrophobicContact CD1-CB 4.49Å; L588-V628 HydrophobicContact CD1-CG1 4.02Å; L588-V628 HydrophobicContact CD1-CG2 4.03Å; L588-V628 HydrophobicContact CD2-CG2 4.2Å; V596-V628 HydrophobicContact CG1-CG1 4.15Å; F612-V628 HydrophobicContact CD2-CG1 4.19Å; F612-V628 HydrophobicContact CD2-CG2 4.44Å; F612-V628 HydrophobicContact CE1-CG2 4.3Å; F612-V628 HydrophobicContact CE2-CB 4.27Å; F612-V628 HydrophobicContact CE2-CG1 4.25Å; F612-V628 HydrophobicContact CE2-CG2 3.7Å; F612-V628 HydrophobicContact CZ-CB 4.24Å; F612-V628 HydrophobicContact CZ-CG2 3.62Å; V621-V628 HydrophobicContact CG2-CG1 4.21Å; L623-V628 HydrophobicContact CD1-CG2 3.76Å; V628-I639 CarbonylContact O-C 3.6Å; V628-I639 WeakPolarHBondContact O-CA 3.28Å; V628-Y640 PolarHBondContact N-O 3.2Å; V628-Y640 PolarHBondContact O-N 3.05Å; V628-F642 HydrophobicContact CG2-CB 4.5Å; V628-F642 HydrophobicContact CG2-CD2 3.73Å
629	I	94.1	Very high	92.1	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.021	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.8	176.7	-58.2	169.9	0	0	0	106.5	V398 F399 V621 S622 L624 R627 I637 R638 I639 F663 I665	V398-I629 HydrophobicContact CB-CD1 4.47Å; V398-I629 HydrophobicContact CG1-CD1 4Å; F399-I629 HydrophobicContact CE2-CD1 4.39Å; V621-I629 CarbonylContact C-O 3.58Å; V621-I629 WeakPolarHBondContact CA-O 3.44Å; S622-I629 PolarHBondContact N-O 2.74Å; S622-I629 PolarHBondContact O-N 3.44Å; L624-I629 HydrophobicContact CB-CD1 4.48Å; R627-I629 PolarHBondContact O-N 2.76Å; I629-I637 HydrophobicContact CG2-CG2 3.66Å; I629-R638 WeakPolarHBondContact CA-O 3.42Å; I629-I639 HydrophobicContact CG1-CG1 4.25Å; I629-I639 HydrophobicContact CG1-CG2 4.31Å; I629-F663 HydrophobicContact CB-CE2 4.13Å; I629-F663 HydrophobicContact CB-CZ 4.07Å; I629-F663 HydrophobicContact CG2-CD2 4.3Å; I629-F663 HydrophobicContact CG2-CE1 4.42Å; I629-F663 HydrophobicContact CG2-CE2 3.59Å; I629-F663 HydrophobicContact CG2-CZ 3.64Å; I629-F663 WeakPolarHBondContact O-CZ 3.49Å; I629-I665 HydrophobicContact CB-CD1 4.35Å; I629-I665 HydrophobicContact CD1-CD1 3.46Å; I629-I665 VanDerWaalsContact CD1-CD1 3.46Å; I629-I665 HydrophobicContact CD1-CG1 4.4Å; I629-I665 HydrophobicContact CG1-CD1 4.44Å
630	S	95.3	Very high	92	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	137.4	-175.3	52.1	0	0	0	0	110.9	H614 D620 I637 R638	H614-S630 PolarHBondContact CE1-OG 3.49Å; H614-S630 VanDerWaalsContact CE1-OG 3.31Å; H614-S630 WeakPolarHBondContact NE2-CB 3.29Å; H614-S630 PolarHBondContact NE2-OG 3.03Å; D620-S630 WeakPolarHBondContact O-CA 3.21Å; S630-I637 CarbonylContact O-C 3.54Å; S630-I637 VanDerWaalsContact O-CA 3.27Å; S630-I637 WeakPolarHBondContact O-CA 3.36Å; S630-R638 PolarHBondContact N-O 3.48Å; S630-R638 PolarHBondContact O-N 2.84Å; S630-R638 PolarHBondContact OG-O 2.66Å
631	A	93.8	Very high	91.7	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	128.6	173.3	0	0	0	0	0	109.9	V618 L619 D620 I637 V660 F663	V618-A631 WeakPolarHBondContact CG1-O 3.16Å; L619-A631 PolarHBondContact N-O 3.35Å; D620-A631 HydrophobicContact CB-CB 4.1Å; D620-A631 PolarHBondContact O-N 2.83Å; A631-I637 HydrophobicContact CB-CG1 4.45Å; A631-V660 HydrophobicContact CB-CB 3.79Å; A631-V660 HydrophobicContact CB-CG1 3.54Å; A631-F663 HydrophobicContact CB-CD1 3.48Å; A631-F663 VanDerWaalsContact CB-CD1 3.48Å; A631-F663 HydrophobicContact CB-CE1 3.71Å
632	C	94	Very high	91.4	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	150.6	-175.6	179.6	0	0	0	0	110.4	K616 D634 G635 K636 V660	K616-C632 PolarHBondContact O-SG 3.02Å; C632-D634 WeakPolarHBondContact CB-OD1 3.48Å; C632-D634 PolarHBondContact O-N 3.25Å; C632-D634 PolarHBondContact SG-OD1 3.23Å; C632-G635 PolarHBondContact O-N 3.13Å; C632-G635 VanDerWaalsContact O-N 3.08Å; C632-K636 PolarHBondContact N-O 2.87Å; C632-V660 PolarHBondContact O-N 3.04Å
633	A	92.5	Very high	90.9	Very high	13 Å²	13	16.6 Å²	16.6	11%	0.107	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-1.1	174.6	0	0	0	0	0	114.1	K616 E617 L619 G635 P659	K616-A633 HydrophobicContact CB-CB 4.1Å; K616-A633 HydrophobicContact CD-CB 4.38Å; E617-A633 HydrophobicContact CG-CB 3.53Å; E617-A633 PolarHBondContact O-N 3.06Å; L619-A633 HydrophobicContact CD1-CB 4Å; L619-A633 HydrophobicContact CG-CB 4.35Å; A633-G635 VanDerWaalsContact C-N 3.25Å; A633-P659 HydrophobicContact CB-CB 4.07Å
634	D	91.2	Very high	90.4	Very high	21 Å²	21	19.4 Å²	19.4	11%	0.112	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	4.2	170.4	80.4	-27.7	0	0	0	114	P615 K616 C632 K636 R638	P615-D634 HydrophobicContact CG-CB 4.09Å; P615-D634 VanDerWaalsContact CG-OD2 3.23Å; P615-D634 WeakPolarHBondContact CG-OD2 3.39Å; K616-D634 HydrophobicContact CD-CB 4.17Å; K616-D634 HydrophobicContact CG-CB 4.36Å; C632-D634 WeakPolarHBondContact CB-OD1 3.48Å; C632-D634 PolarHBondContact O-N 3.25Å; C632-D634 PolarHBondContact SG-OD1 3.23Å; D634-K636 VanDerWaalsContact C-N 3.34Å; D634-K636 WeakPolarHBondContact OD1-CB 3.34Å; D634-K636 PolarHBondContact OD1-N 2.93Å; D634-K636 VanDerWaalsContact OD1-N 3.15Å; D634-R638 IonicContact OD1-CZ 3.67Å; D634-R638 IonicContact OD1-NH1 2.82Å; D634-R638 PolarHBondContact OD1-NH1 3.5Å; D634-R638 IonicContact OD1-NH2 2.71Å; D634-R638 IonicContact OD2-CZ 2.64Å; D634-R638 VanDerWaalsContact OD2-CZ 3.3Å; D634-R638 IonicContact OD2-NH1 2.7Å; D634-R638 PolarHBondContact OD2-NH1 2.87Å; D634-R638 IonicContact OD2-NH2 3.75Å; D634-R638 PolarHBondContact OD2-NH2 2.58Å
635	G	88.4	Confident	90.1	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.01	10%	0.095	C	C	.	.	S	Bend	trans	79	16.4	177.7	0	0	0	0	0	115.4	C632 A633 A653 D658	C632-G635 PolarHBondContact O-N 3.13Å; C632-G635 VanDerWaalsContact O-N 3.08Å; A633-G635 VanDerWaalsContact C-N 3.25Å; G635-A653 PolarHBondContact O-N 2.82Å; G635-A653 VanDerWaalsContact O-N 3.16Å; G635-D658 WeakPolarHBondContact CA-O 3.37Å
636	K	91	Very high	89.9	Confident	72 Å²	72	17.4 Å²	17.4	31%	0.313	9%	0.093	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.4	179.2	-56.9	175.6	-169.8	168.3	0	110.7	C632 D634 V650 I651 K652	C632-K636 PolarHBondContact N-O 2.87Å; D634-K636 VanDerWaalsContact C-N 3.34Å; D634-K636 WeakPolarHBondContact OD1-CB 3.34Å; D634-K636 PolarHBondContact OD1-N 2.93Å; D634-K636 VanDerWaalsContact OD1-N 3.15Å; K636-V650 HydrophobicContact CB-CG1 3.84Å; K636-V650 HydrophobicContact CD-CG1 3.68Å; K636-V650 HydrophobicContact CG-CG1 4.16Å; K636-I651 CarbonylContact C-O 3.47Å; K636-I651 VanDerWaalsContact CA-O 3.26Å; K636-I651 WeakPolarHBondContact CA-O 3.43Å; K636-K652 HydrophobicContact CG-CG 4.36Å
637	I	91.8	Very high	89.9	Confident	10 Å²	10	18.5 Å²	18.5	5%	0.051	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.2	167	-58.7	171.4	0	0	0	107.2	I629 S630 A631 I651 V660 F663	I629-I637 HydrophobicContact CG2-CG2 3.66Å; S630-I637 CarbonylContact O-C 3.54Å; S630-I637 VanDerWaalsContact O-CA 3.27Å; S630-I637 WeakPolarHBondContact O-CA 3.36Å; A631-I637 HydrophobicContact CB-CG1 4.45Å; I637-I651 HydrophobicContact CB-CB 4.23Å; I637-I651 PolarHBondContact N-O 3.29Å; I637-I651 PolarHBondContact O-N 3.4Å; I637-V660 HydrophobicContact CD1-CG1 4.18Å; I637-V660 HydrophobicContact CG1-CG1 4.04Å; I637-V660 HydrophobicContact CG1-CG2 4.21Å; I637-F663 HydrophobicContact CD1-CB 4.41Å
638	R	90.9	Very high	89.5	Confident	25 Å²	25	20.1 Å²	20.1	9%	0.094	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142.1	-179.7	-67.4	-177.6	176.2	68.8	-1.7	110.2	I629 S630 D634 Y640 K649 V650	I629-R638 WeakPolarHBondContact CA-O 3.42Å; S630-R638 PolarHBondContact N-O 3.48Å; S630-R638 PolarHBondContact O-N 2.84Å; S630-R638 PolarHBondContact OG-O 2.66Å; D634-R638 IonicContact OD1-CZ 3.67Å; D634-R638 IonicContact OD1-NH1 2.82Å; D634-R638 PolarHBondContact OD1-NH1 3.5Å; D634-R638 IonicContact OD1-NH2 2.71Å; D634-R638 IonicContact OD2-CZ 2.64Å; D634-R638 VanDerWaalsContact OD2-CZ 3.3Å; D634-R638 IonicContact OD2-NH1 2.7Å; D634-R638 PolarHBondContact OD2-NH1 2.87Å; D634-R638 IonicContact OD2-NH2 3.75Å; D634-R638 PolarHBondContact OD2-NH2 2.58Å; R638-Y640 HydrophobicContact CB-CD2 4.08Å; R638-Y640 HydrophobicContact CB-CE2 3.37Å; R638-Y640 WeakPolarHBondContact CD-OH 3.43Å; R638-Y640 HydrophobicContact CG-CE2 4.34Å; R638-K649 WeakPolarHBondContact CA-O 3.46Å; R638-V650 HydrophobicContact CG-CG1 4.25Å; R638-V650 HydrophobicContact CG-CG2 4.25Å
639	I	91.3	Very high	89	Confident	7 Å²	7	20.3 Å²	20.3	4%	0.036	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	116.5	176.2	-51.8	-176.9	0	0	0	107.1	F399 R627 V628 I629 M648 K649 I651	F399-I639 HydrophobicContact CB-CD1 3.93Å; F399-I639 HydrophobicContact CD2-CD1 3.46Å; F399-I639 VanDerWaalsContact CD2-CD1 3.46Å; F399-I639 HydrophobicContact CE2-CD1 4.34Å; F399-I639 HydrophobicContact CG-CD1 4.01Å; R627-I639 HydrophobicContact CB-CG2 3.93Å; R627-I639 HydrophobicContact CG-CG2 4.34Å; V628-I639 CarbonylContact O-C 3.6Å; V628-I639 WeakPolarHBondContact O-CA 3.28Å; I629-I639 HydrophobicContact CG1-CG1 4.25Å; I629-I639 HydrophobicContact CG1-CG2 4.31Å; I639-M648 PolarHBondContact O-N 3.38Å; I639-K649 HydrophobicContact CB-CB 4.31Å; I639-K649 HydrophobicContact CD1-CB 4.33Å; I639-K649 HydrophobicContact CG1-CB 4.46Å; I639-K649 PolarHBondContact N-O 3.17Å; I639-K649 PolarHBondContact O-N 3.45Å; I639-I651 HydrophobicContact CD1-CD1 4.08Å
640	Y	90.5	Very high	88.7	Confident	12 Å²	12	22.3 Å²	22.3	5%	0.047	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.8	176.8	-62.1	-99	0	0	0	110.4	F612 K613 H614 R627 V628 R638 G645 N646 C647	F612-Y640 HydrophobicContact CB-CD1 4.2Å; F612-Y640 HydrophobicContact CB-CD2 4.31Å; F612-Y640 HydrophobicContact CB-CE1 4.18Å; F612-Y640 HydrophobicContact CB-CE2 4.33Å; F612-Y640 HydrophobicContact CB-CG 4.26Å; F612-Y640 VanDerWaalsContact CD1-CB 3.49Å; F612-Y640 AromaticContact CD1-CD1 3.67Å; F612-Y640 HydrophobicContact CD1-CD1 3.67Å; F612-Y640 HydrophobicContact CD1-CD2 4.32Å; F612-Y640 HydrophobicContact CD1-CE1 4.44Å; F612-Y640 AromaticContact CD1-CG 3.58Å; F612-Y640 HydrophobicContact CD1-CG 3.58Å; F612-Y640 HydrophobicContact CE1-CG 4.31Å; F612-Y640 HydrophobicContact CG-CD1 4.37Å; F612-Y640 HydrophobicContact CG-CG 4.2Å; K613-Y640 PolarHBondContact O-OH 3.35Å; H614-Y640 AromaticContact CE1-CE2 3.57Å; H614-Y640 AromaticContact CE1-CZ 3.84Å; H614-Y640 AromaticContact NE2-CE2 3.37Å; H614-Y640 WeakPolarHBondContact NE2-CE2 3.03Å; H614-Y640 AromaticContact NE2-CZ 3.8Å; H614-Y640 PolarHBondContact NE2-OH 2.98Å; R627-Y640 CarbonylContact C-O 3.54Å; R627-Y640 VanDerWaalsContact CA-O 3.3Å; R627-Y640 WeakPolarHBondContact CA-O 3.34Å; V628-Y640 PolarHBondContact N-O 3.2Å; V628-Y640 PolarHBondContact O-N 3.05Å; R638-Y640 HydrophobicContact CB-CD2 4.08Å; R638-Y640 HydrophobicContact CB-CE2 3.37Å; R638-Y640 WeakPolarHBondContact CD-OH 3.43Å; R638-Y640 HydrophobicContact CG-CE2 4.34Å; Y640-G645 WeakPolarHBondContact CD1-O 3.37Å; Y640-N646 VanDerWaalsContact CA-O 3.3Å; Y640-N646 WeakPolarHBondContact CA-O 3.45Å; Y640-C647 HydrophobicContact CD1-CB 3.74Å; Y640-C647 HydrophobicContact CE1-CB 3.52Å
641	N	88.1	Confident	88.3	Confident	13 Å²	13	22.4 Å²	22.4	7%	0.07	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	128.4	163.8	178.6	-40.9	0	0	0	108.5	E395 R627 F643 N644 G645 N646 M648	E395-N641 PolarHBondContact OE1-ND2 3.27Å; R627-N641 PolarHBondContact NH1-ND2 3.43Å; N641-F643 VanDerWaalsContact C-N 3.29Å; N641-F643 PolarHBondContact O-N 3.4Å; N641-F643 WeakPolarHBondContact OD1-CB 3.21Å; N641-F643 WeakPolarHBondContact OD1-CD2 3.25Å; N641-F643 PolarHBondContact OD1-N 3.48Å; N641-N644 VanDerWaalsContact CB-OD1 3.27Å; N641-N644 WeakPolarHBondContact CB-OD1 3.37Å; N641-G645 PolarHBondContact O-N 2.87Å; N641-G645 VanDerWaalsContact O-N 3.16Å; N641-N646 PolarHBondContact N-O 3.08Å; N641-M648 HydrophobicContact CB-CG 4.16Å; N641-M648 HydrophobicContact CB-SD 3.81Å
642	F	89.1	Confident	87.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.7	-175.2	-175.3	-98.8	0	0	0	113.3	L379 H586 L588 A598 L609 M610 F612 L623 L626 V628	L379-F642 HydrophobicContact CD1-CE1 3.88Å; L379-F642 HydrophobicContact CD1-CZ 4.43Å; L379-F642 HydrophobicContact CD2-CD1 4.08Å; L379-F642 HydrophobicContact CD2-CE1 3.71Å; L379-F642 HydrophobicContact CG-CE1 4.42Å; H586-F642 AromaticContact CD2-CE1 3.8Å; H586-F642 AromaticContact CD2-CZ 3.4Å; H586-F642 WeakPolarHBondContact CD2-CZ 3.42Å; H586-F642 AromaticContact NE2-CE1 3.71Å; H586-F642 AromaticContact NE2-CZ 3.82Å; L588-F642 HydrophobicContact CD2-CE2 4.3Å; A598-F642 HydrophobicContact CB-CE2 3.6Å; A598-F642 HydrophobicContact CB-CZ 4.05Å; L609-F642 HydrophobicContact CD1-CZ 4.37Å; M610-F642 WeakPolarHBondContact CE-O 3.39Å; F612-F642 HydrophobicContact CZ-CD2 4.26Å; L623-F642 HydrophobicContact CD1-CD2 4.09Å; L626-F642 HydrophobicContact CB-CB 4.28Å; L626-F642 HydrophobicContact CD2-CD1 4.48Å; L626-F642 WeakPolarHBondContact O-CB 3.42Å; L626-F642 PolarHBondContact O-N 3.23Å; L626-F642 VanDerWaalsContact O-N 3.12Å; V628-F642 HydrophobicContact CG2-CB 4.5Å; V628-F642 HydrophobicContact CG2-CD2 3.73Å
643	F	83.4	Confident	87.2	Confident	33 Å²	33	29.1 Å²	29.1	15%	0.145	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-42.2	-171.1	-61.8	-67.7	0	0	0	114.3	V348 I350 L379 W380 M610 L626 N641	V348-F643 HydrophobicContact CB-CE2 4.39Å; V348-F643 HydrophobicContact CB-CZ 4.02Å; V348-F643 HydrophobicContact CG1-CE1 4.28Å; V348-F643 HydrophobicContact CG1-CE2 4.17Å; V348-F643 HydrophobicContact CG1-CZ 3.64Å; V348-F643 HydrophobicContact CG2-CE2 4.35Å; V348-F643 HydrophobicContact CG2-CZ 4.47Å; I350-F643 HydrophobicContact CD1-CE1 3.48Å; I350-F643 VanDerWaalsContact CD1-CE1 3.48Å; I350-F643 HydrophobicContact CD1-CZ 3.47Å; I350-F643 VanDerWaalsContact CD1-CZ 3.47Å; I350-F643 HydrophobicContact CG1-CE1 3.77Å; I350-F643 HydrophobicContact CG1-CZ 3.89Å; L379-F643 HydrophobicContact CD2-CD1 3.85Å; L379-F643 HydrophobicContact CD2-CE1 3.97Å; W380-F643 HydrophobicContact CH2-CD1 4.16Å; W380-F643 AromaticContact CH2-CE1 3.99Å; W380-F643 HydrophobicContact CH2-CE1 3.99Å; W380-F643 HydrophobicContact CZ2-CD1 4.41Å; W380-F643 HydrophobicContact CZ2-CE1 4.47Å; M610-F643 WeakPolarHBondContact CE-O 3.42Å; L626-F643 HydrophobicContact CB-CE2 4.41Å; L626-F643 HydrophobicContact CD1-CE2 3.93Å; L626-F643 HydrophobicContact CD1-CZ 3.68Å; N641-F643 VanDerWaalsContact C-N 3.29Å; N641-F643 PolarHBondContact O-N 3.4Å; N641-F643 WeakPolarHBondContact OD1-CB 3.21Å; N641-F643 WeakPolarHBondContact OD1-CD2 3.25Å; N641-F643 PolarHBondContact OD1-N 3.48Å
644	N	81.2	Confident	86.4	Confident	71 Å²	71	29.8 Å²	29.8	38%	0.38	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	-2.3	-170.4	61.6	21	0	0	0	112.7	N641 N646	N641-N644 VanDerWaalsContact CB-OD1 3.27Å; N641-N644 WeakPolarHBondContact CB-OD1 3.37Å; N644-N646 PolarHBondContact ND2-ND2 3.41Å; N644-N646 PolarHBondContact O-N 3.02Å; N644-N646 VanDerWaalsContact O-N 3.09Å; N644-N646 WeakPolarHBondContact OD1-CB 3.4Å; N644-N646 PolarHBondContact OD1-N 2.9Å; N644-N646 PolarHBondContact OD1-ND2 3.47Å
645	G	84.1	Confident	85.5	Confident	24 Å²	24	32.6 Å²	32.6	25%	0.247	19%	0.19	C	C	.	.			trans	68	5.2	-178.4	0	0	0	0	0	114.6	Y640 N641 C647	Y640-G645 WeakPolarHBondContact CD1-O 3.37Å; N641-G645 PolarHBondContact O-N 2.87Å; N641-G645 VanDerWaalsContact O-N 3.16Å; G645-C647 PolarHBondContact O-N 3.35Å
646	N	85.3	Confident	84.8	Confident	48 Å²	48	38.1 Å²	38.1	26%	0.257	21%	0.21	S	C	.	.			trans	-74.5	128.7	-175.5	-68.3	-42	0	0	0	110.2	R338 Y640 N641 N644 M648	R338-N646 PolarHBondContact NH1-ND2 3.1Å; R338-N646 VanDerWaalsContact NH1-ND2 3.15Å; R338-N646 PolarHBondContact NH1-OD1 3.34Å; Y640-N646 VanDerWaalsContact CA-O 3.3Å; Y640-N646 WeakPolarHBondContact CA-O 3.45Å; N641-N646 PolarHBondContact N-O 3.08Å; N644-N646 PolarHBondContact ND2-ND2 3.41Å; N644-N646 PolarHBondContact O-N 3.02Å; N644-N646 VanDerWaalsContact O-N 3.09Å; N644-N646 WeakPolarHBondContact OD1-CB 3.4Å; N644-N646 PolarHBondContact OD1-N 2.9Å; N644-N646 PolarHBondContact OD1-ND2 3.47Å; N646-M648 PolarHBondContact O-N 3.48Å
647	C	87.6	Confident	84.2	Confident	30 Å²	30	36.3 Å²	36.3	20%	0.203	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	112.7	169.2	-171.2	0	0	0	0	108.4	T337 Y640 G645	T337-C647 PolarHBondContact OG1-O 2.88Å; Y640-C647 HydrophobicContact CD1-CB 3.74Å; Y640-C647 HydrophobicContact CE1-CB 3.52Å; G645-C647 PolarHBondContact O-N 3.35Å
648	M	81.9	Confident	83.8	Confident	38 Å²	38	36.9 Å²	36.9	19%	0.187	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-42.9	-178	-60.3	179.9	73.3	0	0	111.6	T337 R627 I639 N641 N646	T337-M648 PolarHBondContact N-O 3.19Å; T337-M648 PolarHBondContact OG1-O 3.45Å; R627-M648 PolarHBondContact NE-SD 2.79Å; I639-M648 PolarHBondContact O-N 3.38Å; N641-M648 HydrophobicContact CB-CG 4.16Å; N641-M648 HydrophobicContact CB-SD 3.81Å; N646-M648 PolarHBondContact O-N 3.48Å
649	K	83.3	Confident	83.6	Confident	5 Å²	5	38.5 Å²	38.5	2%	0.022	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	143	-173.8	-167.2	169.3	-171.1	165.6	0	111.2	Y336 F399 G401 R638 I639 I651	Y336-K649 HydrophobicContact CD1-CB 4.34Å; Y336-K649 HydrophobicContact CE1-CB 4.26Å; Y336-K649 HydrophobicContact CE1-CD 3.89Å; Y336-K649 HydrophobicContact CE1-CG 4.35Å; Y336-K649 PolarHBondContact OH-NZ 3.03Å; F399-K649 HydrophobicContact CB-CD 4.33Å; G401-K649 PolarHBondContact O-NZ 3.11Å; R638-K649 WeakPolarHBondContact CA-O 3.46Å; I639-K649 HydrophobicContact CB-CB 4.31Å; I639-K649 HydrophobicContact CD1-CB 4.33Å; I639-K649 HydrophobicContact CG1-CB 4.46Å; I639-K649 PolarHBondContact N-O 3.17Å; I639-K649 PolarHBondContact O-N 3.45Å; K649-I651 HydrophobicContact CD-CG1 4.35Å; K649-I651 HydrophobicContact CG-CG1 4.23Å
650	V	88	Confident	83.5	Confident	45 Å²	45	39 Å²	39	27%	0.273	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	115.9	174.1	-173.5	0	0	0	0	108.1	T337 K636 R638	T337-V650 HydrophobicContact CG2-CG2 4.27Å; K636-V650 HydrophobicContact CB-CG1 3.84Å; K636-V650 HydrophobicContact CD-CG1 3.68Å; K636-V650 HydrophobicContact CG-CG1 4.16Å; R638-V650 HydrophobicContact CG-CG1 4.25Å; R638-V650 HydrophobicContact CG-CG2 4.25Å
651	I	86.2	Confident	83.4	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.015	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.4	-179.9	-59.6	173.2	0	0	0	107.2	Y403 K636 I637 I639 K649	Y403-I651 HydrophobicContact CD1-CG2 4.14Å; Y403-I651 HydrophobicContact CD2-CG2 4.09Å; Y403-I651 HydrophobicContact CE1-CG2 3.83Å; Y403-I651 HydrophobicContact CE2-CG2 3.76Å; Y403-I651 HydrophobicContact CG-CG2 4.28Å; K636-I651 CarbonylContact C-O 3.47Å; K636-I651 VanDerWaalsContact CA-O 3.26Å; K636-I651 WeakPolarHBondContact CA-O 3.43Å; I637-I651 HydrophobicContact CB-CB 4.23Å; I637-I651 PolarHBondContact N-O 3.29Å; I637-I651 PolarHBondContact O-N 3.4Å; I639-I651 HydrophobicContact CD1-CD1 4.08Å; K649-I651 HydrophobicContact CD-CG1 4.35Å; K649-I651 HydrophobicContact CG-CG1 4.23Å
652	K	85.9	Confident	83.4	Confident	127 Å²	127	45 Å²	45	55%	0.552	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.6	173.6	-67.6	-179.9	-179.3	177.8	0	107.3	Y403 K636	Y403-K652 WeakPolarHBondContact CE2-O 3.45Å; Y403-K652 PolarHBondContact OH-N 3.4Å; Y403-K652 PolarHBondContact OH-O 3.21Å; K636-K652 HydrophobicContact CG-CG 4.36Å
653	A	79.6	Confident	83.4	Confident	14 Å²	14	46.9 Å²	46.9	12%	0.116	28%	0.276	C	S	.	.	S	Bend	trans	-68.4	-40.8	179.2	0	0	0	0	0	110.9	G635 V660 P678	G635-A653 PolarHBondContact O-N 2.82Å; G635-A653 VanDerWaalsContact O-N 3.16Å; A653-V660 HydrophobicContact CB-CG2 3.46Å; A653-V660 VanDerWaalsContact CB-CG2 3.46Å; A653-P678 WeakPolarHBondContact O-CB 2.99Å; A653-P678 WeakPolarHBondContact O-CG 3.37Å
654	N	75.1	Confident	83.5	Confident	27 Å²	27	50.3 Å²	50.3	14%	0.144	29%	0.291	C	S	.	.			trans	-136.7	156.7	177.1	-161.1	3.1	0	0	0	111.3	R656 D658 P678	N654-R656 PolarHBondContact O-N 2.95Å; N654-D658 PolarHBondContact ND2-OD2 3.19Å; N654-P678 HydrophobicContact CB-CB 3.9Å
655	G	73.3	Confident	83.5	Confident	80 Å²	80	48.8 Å²	48.8	83%	0.825	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.8	173.9	0	0	0	0	0	113.7
656	R	73.7	Confident	83	Confident	117 Å²	117	52.2 Å²	52.2	44%	0.442	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-17.4	-176.7	-57.4	-170.9	-174.2	165.3	7.9	114.6	N654 E680 W681	N654-R656 PolarHBondContact O-N 2.95Å; R656-E680 IonicContact CZ-OE1 3.49Å; R656-E680 IonicContact CZ-OE2 3.82Å; R656-E680 IonicContact NE-OE1 3.54Å; R656-E680 IonicContact NE-OE2 3.3Å; R656-E680 IonicContact NH1-OE1 3.37Å; R656-E680 IonicContact NH1-OE2 2.79Å; R656-E680 PolarHBondContact NH1-OE2 2.78Å; R656-E680 IonicContact NH2-OE1 2.71Å; R656-E680 PolarHBondContact NH2-OE1 3.26Å; R656-E680 IonicContact NH2-OE2 2.98Å; R656-E680 PolarHBondContact NH2-OE2 3.07Å; R656-W681 WeakPolarHBondContact CD-O 3.44Å
657	G	78.2	Confident	81.7	Confident	34 Å²	34	53 Å²	53	35%	0.351	31%	0.311	S	S	.	.			trans	82.4	24.9	179.8	0	0	0	0	0	115.2
658	D	83.2	Confident	79.9	Confident	21 Å²	21	56.3 Å²	56.3	11%	0.112	33%	0.327	C	S	.	.			trans	-68.4	144.8	179.4	-54.3	-42.6	0	0	0	112.2	G635 N654 V660 E680 W681	G635-D658 WeakPolarHBondContact CA-O 3.37Å; N654-D658 PolarHBondContact ND2-OD2 3.19Å; D658-V660 PolarHBondContact O-N 2.76Å; D658-E680 WeakPolarHBondContact OD2-CA 3.41Å; D658-W681 WeakPolarHBondContact OD1-CB 3.26Å; D658-W681 PolarHBondContact OD1-N 2.75Å; D658-W681 PolarHBondContact OD2-N 3.11Å
659	P	87.8	Confident	77.5	Confident	60 Å²	60	59.9 Å²	59.9	39%	0.39	36%	0.356	S	S	.	.			trans	-60.8	135.1	-174.9	26.6	-35.6	0	0	0	112.2	L619 A633 L661	L619-P659 HydrophobicContact CD1-CB 3.98Å; A633-P659 HydrophobicContact CB-CB 4.07Å; P659-L661 PolarHBondContact O-N 2.99Å
660	V	88.5	Confident	74.8	Confident	16 Å²	16	67.2 Å²	67.2	10%	0.097	40%	0.395	C	S	.	.			trans	-87	103.5	173.5	-176.2	0	0	0	0	108.4	L619 A631 C632 I637 A653 D658	L619-V660 WeakPolarHBondContact CB-O 3.26Å; L619-V660 WeakPolarHBondContact CD1-O 3.45Å; A631-V660 HydrophobicContact CB-CB 3.79Å; A631-V660 HydrophobicContact CB-CG1 3.54Å; C632-V660 PolarHBondContact O-N 3.04Å; I637-V660 HydrophobicContact CD1-CG1 4.18Å; I637-V660 HydrophobicContact CG1-CG1 4.04Å; I637-V660 HydrophobicContact CG1-CG2 4.21Å; A653-V660 HydrophobicContact CB-CG2 3.46Å; A653-V660 VanDerWaalsContact CB-CG2 3.46Å; D658-V660 PolarHBondContact O-N 2.76Å
661	L	88	Confident	71.8	Confident	106 Å²	106	73.1 Å²	73.1	56%	0.555	42%	0.42	S	S	*	.			trans	-71.7	-42.4	-175.4	-60.1	-178.1	0	0	0	113.1	L619 P659	L619-L661 HydrophobicContact CD1-CD2 3.79Å; P659-L661 PolarHBondContact O-N 2.99Å
662	S	87.3	Confident	69.1	Low	46 Å²	46	79.3 Å²	79.3	32%	0.322	45%	0.452	S	S	.	.			trans	-154.4	155	-178.6	59.7	0	0	0	0	110.2	I418 D620	I418-S662 WeakPolarHBondContact CG1-OG 3.47Å; D620-S662 VanDerWaalsContact OD2-CA 3.28Å; D620-S662 WeakPolarHBondContact OD2-CA 3.44Å
663	F	89.1	Confident	66.1	Low	39 Å²	39	80.5 Å²	80.5	17%	0.171	45%	0.453	C	S	.	.			trans	-141.5	158.4	170.4	65.8	-86.5	0	0	0	110.3	D620 I629 A631 I637 I665	D620-F663 HydrophobicContact CB-CD1 3.89Å; D620-F663 HydrophobicContact CB-CE1 3.83Å; D620-F663 PolarHBondContact OD2-N 3.28Å; I629-F663 HydrophobicContact CB-CE2 4.13Å; I629-F663 HydrophobicContact CB-CZ 4.07Å; I629-F663 HydrophobicContact CG2-CD2 4.3Å; I629-F663 HydrophobicContact CG2-CE1 4.42Å; I629-F663 HydrophobicContact CG2-CE2 3.59Å; I629-F663 HydrophobicContact CG2-CZ 3.64Å; I629-F663 WeakPolarHBondContact O-CZ 3.49Å; A631-F663 HydrophobicContact CB-CD1 3.48Å; A631-F663 VanDerWaalsContact CB-CD1 3.48Å; A631-F663 HydrophobicContact CB-CE1 3.71Å; I637-F663 HydrophobicContact CD1-CB 4.41Å; F663-I665 HydrophobicContact CD2-CD1 4.32Å; F663-I665 HydrophobicContact CD2-CG1 3.94Å; F663-I665 HydrophobicContact CE2-CD1 3.73Å; F663-I665 HydrophobicContact CE2-CG1 3.88Å
664	F	85.9	Confident	63.9	Low	105 Å²	105	83.9 Å²	83.9	46%	0.461	47%	0.465	S	S	.	.			trans	-124.8	146.5	175.1	-175.4	-95.3	0	0	0	109.6	Y420 Q666	Y420-F664 HydrophobicContact CD1-CB 3.78Å; Y420-F664 AromaticContact CD1-CD1 3.33Å; Y420-F664 HydrophobicContact CD1-CD1 3.33Å; Y420-F664 HydrophobicContact CD1-CD2 4.39Å; Y420-F664 AromaticContact CD1-CE1 3.94Å; Y420-F664 HydrophobicContact CD1-CE1 3.94Å; Y420-F664 AromaticContact CD1-CG 3.58Å; Y420-F664 HydrophobicContact CD1-CG 3.58Å; Y420-F664 AromaticContact CE1-CD1 3.44Å; Y420-F664 HydrophobicContact CE1-CD1 3.44Å; Y420-F664 VanDerWaalsContact CE1-CD1 3.44Å; Y420-F664 AromaticContact CE1-CE1 3.78Å; Y420-F664 HydrophobicContact CE1-CE1 3.78Å; Y420-F664 HydrophobicContact CE1-CG 4.18Å; Y420-F664 WeakPolarHBondContact O-CD2 3.23Å; F664-Q666 HydrophobicContact CD1-CB 4.35Å; F664-Q666 HydrophobicContact CE1-CB 3.94Å
665	I	82.7	Confident	61.5	Low	40 Å²	40	84.8 Å²	84.8	21%	0.205	47%	0.472	C	S	.	.			trans	-119.2	120.4	177.2	-53.9	161.1	0	0	0	108.2	L624 I629 F663	L624-I665 HydrophobicContact CD2-CG2 3.55Å; I629-I665 HydrophobicContact CB-CD1 4.35Å; I629-I665 HydrophobicContact CD1-CD1 3.46Å; I629-I665 VanDerWaalsContact CD1-CD1 3.46Å; I629-I665 HydrophobicContact CD1-CG1 4.4Å; I629-I665 HydrophobicContact CG1-CD1 4.44Å; F663-I665 HydrophobicContact CD2-CD1 4.32Å; F663-I665 HydrophobicContact CD2-CG1 3.94Å; F663-I665 HydrophobicContact CE2-CD1 3.73Å; F663-I665 HydrophobicContact CE2-CG1 3.88Å
666	Q	72.6	Confident	59.7	Low	96 Å²	96	82.8 Å²	82.8	45%	0.449	44%	0.44	S	S	.	.			trans	-106.1	127.5	171.3	-166.4	161.8	2.9	0	0	109	Y420 G422 F664	Y420-Q666 PolarHBondContact OH-OE1 3.03Å; G422-Q666 PolarHBondContact O-NE2 3.04Å; G422-Q666 PolarHBondContact O-OE1 3.25Å; F664-Q666 HydrophobicContact CD1-CB 4.35Å; F664-Q666 HydrophobicContact CE1-CB 3.94Å
667	G	58.2	Low	57.5	Low	63 Å²	63	79.7 Å²	79.7	65%	0.649	43%	0.432	S	S	*	.			trans	-69.3	134.3	172.5	0	0	0	0	0	110.4	S669	G667-S669 PolarHBondContact O-N 2.71Å
668	N	49.7	Very low	54.9	Low	100 Å²	100	78.3 Å²	78.3	54%	0.535	42%	0.416	S	S	.	.			trans	-68.3	114.5	178.6	-83.1	-3.9	0	0	0	110.8
669	S	30.9	Very low	52.2	Low	114 Å²	114	79.4 Å²	79.4	80%	0.797	42%	0.424	S	S	*	.	S	Bend	trans	-105.1	101.4	147.6	-59.9	0	0	0	0	106.9	G667 H671	G667-S669 PolarHBondContact O-N 2.71Å; S669-H671 VanDerWaalsContact C-N 3.33Å; S669-H671 PolarHBondContact O-N 2.91Å
670	D	27.2	Very low	49.5	Very low	158 Å²	158	77.9 Å²	77.9	85%	0.845	41%	0.412	S	S	*	.	S	Bend	trans	53	-11.4	166.9	-68.5	-21.4	0	0	0	123.5
671	H	24.6	Very low	46.7	Very low	169 Å²	169	80.9 Å²	80.9	78%	0.782	42%	0.421	S	S	*	.			trans	-134.2	114.3	175	-69.6	-48.6	0	0	0	113.6	S669 R673	S669-H671 VanDerWaalsContact C-N 3.33Å; S669-H671 PolarHBondContact O-N 2.91Å; H671-R673 PolarHBondContact O-N 3Å; H671-R673 VanDerWaalsContact O-N 3.12Å
672	L	29.5	Very low	43.6	Very low	133 Å²	133	84 Å²	84	70%	0.696	43%	0.43	S	S	*	.			trans	-67.2	102.9	178.9	-85.1	155.8	0	0	0	111.6
673	R	24.1	Very low	40.6	Very low	153 Å²	153	87.5 Å²	87.5	58%	0.577	45%	0.45	S	S	*	.			trans	-129.1	111.1	148.2	-78.7	-176	177.5	165.2	-0.9	108.9	I440 H671	I440-R673 VanDerWaalsContact CG2-NH1 3.31Å; H671-R673 PolarHBondContact O-N 3Å; H671-R673 VanDerWaalsContact O-N 3.12Å
674	K	31.4	Very low	37.7	Very low	84 Å²	84	93 Å²	93	37%	0.365	48%	0.481	S	S	.	.			trans	-104.7	106.9	169	-73.1	178.8	176.7	174.8	0	107.2	F399 Y676	F399-K674 HydrophobicContact CE1-CD 3.92Å; K674-Y676 HydrophobicContact CB-CD2 4.27Å; K674-Y676 HydrophobicContact CB-CE2 3.82Å; K674-Y676 HydrophobicContact CD-CE2 4.34Å; K674-Y676 PolarHBondContact O-N 2.96Å
675	T	25.7	Very low	34.8	Very low	46 Å²	46	91.6 Å²	91.6	28%	0.282	50%	0.496	S	S	.	.			trans	-91	95.3	174.2	-41.2	0	0	0	0	107.5	L408 I439	L408-T675 HydrophobicContact CD1-CG2 4Å; L408-T675 HydrophobicContact CD2-CG2 4.24Å; L408-T675 HydrophobicContact CG-CG2 4.28Å; I439-T675 HydrophobicContact CG2-CG2 3.88Å; I439-T675 WeakPolarHBondContact CG2-OG1 3.49Å
676	Y	35.9	Very low	32.1	Very low	38 Å²	38	100.6 Å²	100.6	15%	0.149	53%	0.527	C	S	.	.			trans	-82.2	125.7	161	-65.7	-82.1	0	0	0	106.9	F399 N404 K674 P678	F399-Y676 WeakPolarHBondContact CE1-OH 3.19Å; F399-Y676 WeakPolarHBondContact CZ-OH 3.49Å; N404-Y676 WeakPolarHBondContact O-CD2 3.4Å; K674-Y676 HydrophobicContact CB-CD2 4.27Å; K674-Y676 HydrophobicContact CB-CE2 3.82Å; K674-Y676 HydrophobicContact CD-CE2 4.34Å; K674-Y676 PolarHBondContact O-N 2.96Å; Y676-P678 WeakPolarHBondContact O-CD 3.36Å
677	L	26.4	Very low	29.9	Very low	52 Å²	52	108.2 Å²	108.2	27%	0.272	55%	0.552	S	S	.	*			trans	-98.6	95.2	168.3	-87.9	174.9	0	0	0	108.9	L408 I418 I426	L408-L677 HydrophobicContact CB-CD2 3.54Å; L408-L677 HydrophobicContact CD1-CD1 4.02Å; L408-L677 HydrophobicContact CD1-CD2 3.56Å; L408-L677 HydrophobicContact CD1-CG 3.91Å; L408-L677 HydrophobicContact CG-CD2 3.35Å; L408-L677 HydrophobicContact CG-CG 4.17Å; I418-L677 HydrophobicContact CD1-CD1 4.48Å; I426-L677 HydrophobicContact CD1-CD1 3.6Å; I426-L677 HydrophobicContact CD1-CG 4.48Å; I426-L677 HydrophobicContact CG2-CD1 4.47Å
678	P	23.4	Very low	28.5	Very low	5 Å²	5	111.4 Å²	111.4	3%	0.032	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-77	126.2	157.7	11.2	5.8	0	0	0	107.5	V405 I407 A653 N654 Y676	V405-P678 HydrophobicContact CG1-CB 4.47Å; V405-P678 HydrophobicContact CG1-CG 3.11Å; I407-P678 HydrophobicContact CG1-CG 4.2Å; A653-P678 WeakPolarHBondContact O-CB 2.99Å; A653-P678 WeakPolarHBondContact O-CG 3.37Å; N654-P678 HydrophobicContact CB-CB 3.9Å; Y676-P678 WeakPolarHBondContact O-CD 3.36Å
679	V	28.4	Very low	27.3	Very low	44 Å²	44	118.2 Å²	118.2	27%	0.267	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-99.5	120.7	163.9	-178.2	0	0	0	0	106.2
680	E	30.4	Very low	27	Very low	29 Å²	29	122.7 Å²	122.7	14%	0.136	58%	0.582	C	S	.	*	P	Polyproline II helix	trans	-72.6	151.5	-178.6	-56.3	-163.3	135.3	0	0	112.9	D410 R656 D658	D410-E680 WeakPolarHBondContact OD1-CB 3.46Å; D410-E680 VanDerWaalsContact OD1-CG 3.28Å; D410-E680 WeakPolarHBondContact OD1-CG 3.38Å; D410-E680 VanDerWaalsContact OD1-OE2 3.08Å; R656-E680 IonicContact CZ-OE1 3.49Å; R656-E680 IonicContact CZ-OE2 3.82Å; R656-E680 IonicContact NE-OE1 3.54Å; R656-E680 IonicContact NE-OE2 3.3Å; R656-E680 IonicContact NH1-OE1 3.37Å; R656-E680 IonicContact NH1-OE2 2.79Å; R656-E680 PolarHBondContact NH1-OE2 2.78Å; R656-E680 IonicContact NH2-OE1 2.71Å; R656-E680 PolarHBondContact NH2-OE1 3.26Å; R656-E680 IonicContact NH2-OE2 2.98Å; R656-E680 PolarHBondContact NH2-OE2 3.07Å; D658-E680 WeakPolarHBondContact OD2-CA 3.41Å
681	W	30.3	Very low	27	Very low	78 Å²	78	125.1 Å²	125.1	30%	0.295	59%	0.585	S	S	.	*			trans	-127.1	139.8	152.5	-78.5	101.3	0	0	0	113.1	W412 R656 D658	W412-W681 HydrophobicContact CB-CE3 4.46Å; W412-W681 HydrophobicContact CB-CH2 2.93Å; W412-W681 HydrophobicContact CB-CZ2 3.51Å; W412-W681 HydrophobicContact CB-CZ3 3.48Å; W412-W681 VanDerWaalsContact CB-CZ3 3.48Å; W412-W681 AromaticContact CD1-CD2 3.46Å; W412-W681 VanDerWaalsContact CD1-CD2 3.46Å; W412-W681 AromaticContact CD1-CE2 3.54Å; W412-W681 AromaticContact CD1-CE3 2.84Å; W412-W681 AromaticContact CD1-CH2 2.92Å; W412-W681 AromaticContact CD1-CZ2 3.22Å; W412-W681 AromaticContact CD1-CZ3 2.69Å; W412-W681 HydrophobicContact CD2-CH2 4.05Å; W412-W681 AromaticContact CD2-CZ2 3.8Å; W412-W681 HydrophobicContact CD2-CZ2 3.8Å; W412-W681 HydrophobicContact CD2-CZ3 4.43Å; W412-W681 AromaticContact CE2-CE2 3.96Å; W412-W681 AromaticContact CE2-CZ2 3.93Å; W412-W681 HydrophobicContact CG-CD2 4.18Å; W412-W681 AromaticContact CG-CE2 3.81Å; W412-W681 AromaticContact CG-CE3 3.75Å; W412-W681 HydrophobicContact CG-CE3 3.75Å; W412-W681 AromaticContact CG-CH2 2.88Å; W412-W681 HydrophobicContact CG-CH2 2.88Å; W412-W681 AromaticContact CG-CZ2 3.06Å; W412-W681 HydrophobicContact CG-CZ2 3.06Å; W412-W681 AromaticContact CG-CZ3 3.23Å; W412-W681 HydrophobicContact CG-CZ3 3.23Å; W412-W681 AromaticContact NE1-CD2 3.11Å; W412-W681 AromaticContact NE1-CE2 3.19Å; W412-W681 AromaticContact NE1-CE3 2.96Å; W412-W681 AromaticContact NE1-CH2 3.54Å; W412-W681 AromaticContact NE1-CZ2 3.33Å; W412-W681 VanDerWaalsContact NE1-CZ2 3.33Å; W412-W681 AromaticContact NE1-CZ3 3.36Å; R656-W681 WeakPolarHBondContact CD-O 3.44Å; D658-W681 WeakPolarHBondContact OD1-CB 3.26Å; D658-W681 PolarHBondContact OD1-N 2.75Å; D658-W681 PolarHBondContact OD2-N 3.11Å
682	K	22.6	Very low	27.1	Very low	173 Å²	173	121.7 Å²	121.7	75%	0.752	59%	0.586	S	S	*	*			trans	-121.2	123.3	160.5	-152.2	-178.8	-176.1	-179.4	0	107.7
683	T	24.6	Very low	27	Very low	119 Å²	119	124.6 Å²	124.6	73%	0.73	60%	0.596	S	S	*	*			trans	-78.9	145.6	160.5	51.8	0	0	0	0	107.1
684	D	28.2	Very low	27.1	Very low	154 Å²	154	127.3 Å²	127.3	82%	0.824	61%	0.612	S	S	*	*			cis	-167.3	159.2	47	-131.6	-27.9	0	0	0	110.4
685	G	23.3	Very low	26.9	Very low	75 Å²	75	129 Å²	129	77%	0.773	63%	0.634	S	S	*	*			trans	-168.4	31.1	179.3	0	0	0	0	0	115.7
686	R	26.3	Very low	27.1	Very low	230 Å²	230	131.6 Å²	131.6	87%	0.868	66%	0.66	S	S	*	*			trans	-96	115.7	157.9	-85.6	-172.1	-174.1	-177.2	3	109.6	V688	R686-V688 PolarHBondContact O-N 3.33Å
687	R	27.2	Very low	26.7	Very low	255 Å²	255	133.4 Å²	133.4	96%	0.962	69%	0.691	S	S	*	*			trans	-48.5	108.1	165.6	-76.7	176	171.7	174.9	-2.9	109.7
688	V	27.7	Very low	26.7	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	72%	0.722	S	S	*	*			trans	-107.5	119.4	156.5	179	0	0	0	0	106.7	R686 K690	R686-V688 PolarHBondContact O-N 3.33Å; V688-K690 PolarHBondContact O-N 3.44Å
689	R	25.2	Very low	26.8	Very low	242 Å²	242	144.8 Å²	144.8	91%	0.913	76%	0.755	S	S	*	*			trans	-52.7	124.9	171.5	-83.5	173.4	163.2	166.9	-6.2	108.9	K691	R689-K691 PolarHBondContact O-N 2.73Å
690	K	25.8	Very low	26.6	Very low	209 Å²	209	147.9 Å²	147.9	91%	0.909	78%	0.777	S	S	*	*			trans	-54.5	116.2	168.4	-74.9	178.1	173.9	177.7	0	109.6	V688	V688-K690 PolarHBondContact O-N 3.44Å
691	K	25.3	Very low	26.5	Very low	208 Å²	208	153.9 Å²	153.9	90%	0.904	81%	0.811	S	S	*	*			trans	-106.5	112.8	144.7	-113.3	-176.6	176.8	-175.3	0	105.6	R689	R689-K691 PolarHBondContact O-N 2.73Å
692	A	27.2	Very low	26.3	Very low	97 Å²	97	157.5 Å²	157.5	80%	0.802	84%	0.836	S	S	*	*			trans	-80.4	114.4	179	0	0	0	0	0	108.9
693	E	26.9	Very low	27.1	Very low	194 Å²	194	153.9 Å²	153.9	91%	0.907	83%	0.83	S	S	*	*			trans	-113.8	112.7	158	-85.6	177.1	174.3	0	0	107.5
694	K	26.2	Very low	27.2	Very low	210 Å²	210	158.7 Å²	158.7	91%	0.913	84%	0.835	S	S	*	*			trans	-76.8	123.1	173.5	-75.9	175.2	172.1	178.5	0	108.2
695	S	27.7	Very low	27.3	Very low	120 Å²	120	159.6 Å²	159.6	84%	0.839	83%	0.831	S	S	*	*			trans	-121.8	99.4	152.4	59.5	0	0	0	0	107.5
696	A	29.4	Very low	27.5	Very low	100 Å²	100	161.2 Å²	161.2	83%	0.826	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-72.8	140.6	176.6	0	0	0	0	0	110.4
697	G	28.2	Very low	27.6	Very low	76 Å²	76	156.3 Å²	156.3	78%	0.784	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66	140.6	166.6	0	0	0	0	0	111.7	C699	G697-C699 PolarHBondContact O-N 3.07Å
698	M	26.6	Very low	27.7	Very low	188 Å²	188	151.7 Å²	151.7	93%	0.926	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-47.3	119.4	155.3	-99.9	157.6	120	0	0	110.8
699	C	24.7	Very low	27.7	Very low	109 Å²	109	148.2 Å²	148.2	74%	0.736	80%	0.802	S	S	*	*				166	138.4	105.8	-95.9	0	0	0	0	112.3	G697	G697-C699 PolarHBondContact O-N 3.07Å
700	C	24.8	Very low	27.9	Very low	108 Å²	108	144.4 Å²	144.4	73%	0.73	80%	0.799	S	S	*	*			trans	90.3	110.8	156.4	-61	0	0	0	0	120
701	N	27.6	Very low	27.9	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	80%	0.795	S	S	*	*			trans	93.5	101.7	137.4	-60.4	-9.9	0	0	0	120.2
702	N	27	Very low	28.1	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	79%	0.787	S	S	*	*			trans	-47.6	173.2	148.2	-98.7	-12.7	0	0	0	113.9
703	P	39	Very low	28.2	Very low	97 Å²	97	144.3 Å²	144.3	63%	0.63	79%	0.787	S	S	*	*			cis	-138.5	176.3	-27.7	33.5	-13.6	0	0	0	114.1
704	R	27.5	Very low	28.9	Very low	220 Å²	220	147.5 Å²	147.5	83%	0.83	80%	0.801	S	S	*	*			trans	116.4	115	143.9	-70.5	178.4	178.2	-178.3	0.4	118.3
705	K	29	Very low	29	Very low	172 Å²	172	144.4 Å²	144.4	75%	0.748	80%	0.795	S	S	*	*				77	113.4	127.7	-73.8	-168.3	172.5	-170.5	0	118.3
706	T	28	Very low	29.1	Very low	109 Å²	109	145.6 Å²	145.6	67%	0.669	79%	0.793	S	S	*	*				77.5	137.9	114.8	58.1	0	0	0	0	112.6
707	D	28	Very low	29.1	Very low	127 Å²	127	148.2 Å²	148.2	68%	0.679	79%	0.791	S	S	*	*			cis	-170.6	161.2	1.4	-100.9	-25.7	0	0	0	104.6
708	D	29.6	Very low	29.1	Very low	159 Å²	159	152.4 Å²	152.4	85%	0.85	79%	0.792	S	S	*	*			trans	61	140.2	153.5	-58	-27.8	0	0	0	119.3
709	G	27.4	Very low	29.3	Very low	58 Å²	58	150.2 Å²	150.2	60%	0.598	78%	0.783	S	S	*	*			cis	158.1	157.5	12.3	0	0	0	0	0	107.9
710	L	29.9	Very low	29.6	Very low	161 Å²	161	152.9 Å²	152.9	84%	0.843	79%	0.786	S	S	*	*			trans	74	109.3	166.2	-64.7	123.9	0	0	0	117.5
711	K	27	Very low	29.9	Very low	190 Å²	190	156.1 Å²	156.1	83%	0.826	79%	0.79	S	S	*	*				66.7	124.5	65.6	-77.6	-173.7	175.5	173.2	0	115.1
712	L	29.1	Very low	30.1	Very low	142 Å²	142	156.2 Å²	156.2	74%	0.743	79%	0.787	S	S	*	*			trans	125.4	103	143.9	-77.8	129.3	0	0	0	111.3
713	K	29.7	Very low	30.4	Very low	180 Å²	180	156.3 Å²	156.3	78%	0.783	78%	0.784	S	S	*	*				61.6	100.3	87.9	-76	-172.7	174.1	-178.1	0	111.6
714	H	40.4	Very low	29.6	Very low	261 Å²	261	161.7 Å²	161.7	100%	1.208	80%	0.798	S	S	*	*				-154.5	0	99.1	-105.5	-66	0	0	0	110.6

Retrieved 714 of 714 residues in 420.3 ms (Link to these results)

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