A0A096NJV5_PAPAN Loading...

TNF receptor-associated factor

AlphaFold DB (I0FUR9), UniProt , Accession A0A096NJV5, Species PAPAN (Papio anubis, Olive baboon), Gene TRAF3, Length 568 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	29.2	Very low	233 Å²	233	156.6 Å²	156.6	100%	1.148	87%	0.868	S	S	*	*				0	65.7	0	-70.2	177.4	166.4	0	0	106.7
2	E	29.1	Very low	29.3	Very low	199 Å²	199	154.5 Å²	154.5	93%	0.93	87%	0.866	S	S	*	*				59.7	92.2	86.7	-79.9	-171.5	149.8	0	0	112.5
3	S	26.2	Very low	29.5	Very low	120 Å²	120	155.5 Å²	155.5	84%	0.839	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-103.1	120.9	166.5	-48	0	0	0	0	107.7	K5	S3-K5 PolarHBondContact O-N 3.44Å
4	S	28.7	Very low	29.4	Very low	128 Å²	128	157.8 Å²	157.8	90%	0.895	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-55.4	122.4	-169.9	-54.2	0	0	0	0	114.5
5	K	29.9	Very low	29.7	Very low	198 Å²	198	156 Å²	156	86%	0.861	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-77.2	126.6	167	-82.5	178.1	174.5	176.1	0	110.3	S3	S3-K5 PolarHBondContact O-N 3.44Å
6	K	27.7	Very low	30.2	Very low	205 Å²	205	152.8 Å²	152.8	89%	0.891	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.8	160.3	-78.4	177.1	171.8	179.2	0	108.8
7	M	26.4	Very low	30.3	Very low	186 Å²	186	149.3 Å²	149.3	92%	0.916	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-83.1	119.1	167.9	-77.3	-179.5	73	0	0	109
8	D	27.8	Very low	30.4	Very low	155 Å²	155	146.7 Å²	146.7	83%	0.829	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-73	135.5	164.5	-86.6	-47.6	0	0	0	110.3
9	S	29.3	Very low	31.2	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-58.7	143.3	173	21.8	0	0	0	0	113	G11	S9-G11 PolarHBondContact O-N 2.7Å
10	P	31.1	Very low	31.5	Very low	131 Å²	131	145.9 Å²	145.9	85%	0.851	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.6	125.7	176.3	24.7	-23.1	0	0	0	110.6
11	G	30.4	Very low	31.8	Very low	63 Å²	63	144.8 Å²	144.8	65%	0.649	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-62.3	162.1	175.8	0	0	0	0	0	113.5	S9	S9-G11 PolarHBondContact O-N 2.7Å
12	P	30.3	Very low	32	Very low	131 Å²	131	140.1 Å²	140.1	85%	0.851	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-66.7	137	-172.2	26.7	-33.8	0	0	0	112.8	Q14	P12-Q14 PolarHBondContact O-N 3.1Å
13	L	32	Very low	32.2	Very low	167 Å²	167	136.7 Å²	136.7	87%	0.874	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-53.2	129	172.3	-78.3	147.5	0	0	0	111	T15	L13-T15 PolarHBondContact O-N 2.85Å
14	Q	28	Very low	32.6	Very low	188 Å²	188	134.9 Å²	134.9	88%	0.879	75%	0.746	S	S	*	*			trans	-60	101.8	175.9	-72.1	179.8	-6.6	0	0	110.6	P12	P12-Q14 PolarHBondContact O-N 3.1Å
15	T	34.1	Very low	33.2	Very low	131 Å²	131	141 Å²	141	80%	0.804	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-71.8	124.8	169.9	51.4	0	0	0	0	109.5	L13	L13-T15 PolarHBondContact O-N 2.85Å
16	N	38.3	Very low	33.7	Very low	105 Å²	105	135.9 Å²	135.9	56%	0.561	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-67.7	138.4	176.8	-76.2	-54.7	0	0	0	111.3	R118	N16-R118 PolarHBondContact ND2-NH2 2.97Å; N16-R118 PolarHBondContact OD1-NH2 3.26Å
17	P	31.2	Very low	34.3	Very low	93 Å²	93	129.8 Å²	129.8	60%	0.604	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-72.1	168.2	-176.7	28.4	-34	0	0	0	114
18	P	33.3	Very low	35.2	Very low	102 Å²	102	125.1 Å²	125.1	66%	0.662	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-69.4	165.5	-168.3	-13.4	29.2	0	0	0	114.9
19	L	44.3	Very low	36.1	Very low	129 Å²	129	121 Å²	121	68%	0.675	71%	0.706	S	S	*	*			trans	-108.2	142.5	-163.7	-60.8	162.4	0	0	0	112.1	F32	L19-F32 HydrophobicContact CD2-CE2 3.83Å
20	K	38.3	Very low	37.5	Very low	149 Å²	149	118.4 Å²	118.4	65%	0.648	69%	0.687	S	S	*	*			trans	-129.7	135.1	165.7	-76	-173.1	178.2	-179.7	0	112.1
21	L	37.1	Very low	39.2	Very low	123 Å²	123	114.1 Å²	114.1	64%	0.644	66%	0.657	S	S	*	*			trans	-75.3	127.7	165	-96.5	98.1	0	0	0	109.2	P30	L21-P30 HydrophobicContact CD2-CB 4.24Å
22	H	39.7	Very low	41.2	Very low	135 Å²	135	112.4 Å²	112.4	63%	0.625	63%	0.631	S	S	*	*	B	Isolated β-bridge	trans	-107.7	118.5	162.8	-86.5	-76.9	0	0	0	109.3	D24	H22-D24 PolarHBondContact O-N 3.28Å
23	T	32.5	Very low	43.5	Very low	126 Å²	126	107.4 Å²	107.4	77%	0.773	60%	0.601	S	S	*	*			trans	-83.8	105.1	167.7	45.1	0	0	0	0	109
24	D	35.3	Very low	45.9	Very low	82 Å²	82	101 Å²	101	44%	0.439	57%	0.57	S	S	.	*			trans	-86.2	116.9	170.1	-162.9	-14.7	0	0	0	108.9	H22 S26 K107	H22-D24 PolarHBondContact O-N 3.28Å; D24-S26 PolarHBondContact O-N 3.04Å; D24-S26 PolarHBondContact OD1-OG 2.73Å; D24-K107 IonicContact OD2-NZ 2.75Å; D24-K107 PolarHBondContact OD2-NZ 2.93Å
25	R	39.5	Very low	48.3	Very low	258 Å²	258	97 Å²	97	97%	0.974	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	18.4	-176.6	-88.9	-173.8	172.3	-169.8	-0.8	114.3
26	S	41	Very low	50.7	Low	89 Å²	89	98.3 Å²	98.3	62%	0.622	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-4.2	-172	58	0	0	0	0	116.6	D24	D24-S26 PolarHBondContact O-N 3.04Å; D24-S26 PolarHBondContact OD1-OG 2.73Å
27	A	39.9	Very low	53.2	Low	77 Å²	77	93.7 Å²	93.7	64%	0.636	53%	0.525	S	S	*	.	S	Bend	trans	-168	91.4	165.9	0	0	0	0	0	112.5	T29	A27-T29 VanDerWaalsContact C-N 3.3Å; A27-T29 PolarHBondContact O-N 3.1Å
28	G	45.9	Very low	56.1	Low	88 Å²	88	89.3 Å²	89.3	91%	0.907	50%	0.497	S	S	*	.	S	Bend	trans	42.4	-12.4	145.5	0	0	0	0	0	125.3
29	T	47.2	Very low	58.9	Low	69 Å²	69	85 Å²	85	42%	0.423	47%	0.468	S	S	.	.	S	Bend	trans	-141.3	130.5	-174.6	-47.3	0	0	0	0	111	A27 I31 V135	A27-T29 VanDerWaalsContact C-N 3.3Å; A27-T29 PolarHBondContact O-N 3.1Å; T29-I31 PolarHBondContact O-N 3.17Å; T29-V135 HydrophobicContact CG2-CG2 3.78Å
30	P	58.2	Low	61.1	Low	51 Å²	51	86.3 Å²	86.3	33%	0.331	47%	0.468	S	S	.	.			trans	-69.2	127.9	176.1	30.6	-34.3	0	0	0	109.5	L21 L134	L21-P30 HydrophobicContact CD2-CB 4.24Å; P30-L134 HydrophobicContact CB-CD2 3.62Å; P30-L134 HydrophobicContact CG-CD2 4.01Å; P30-L134 WeakPolarHBondContact O-CD2 3.42Å
31	I	66.4	Low	63.6	Low	40 Å²	40	80.3 Å²	80.3	21%	0.205	44%	0.442	C	S	.	.	B	Isolated β-bridge	trans	-107.9	139.3	-175.7	-65.6	160	0	0	0	108.9	T29 A33 L111	T29-I31 PolarHBondContact O-N 3.17Å; I31-A33 PolarHBondContact O-N 2.94Å; I31-L111 HydrophobicContact CD1-CD1 3.67Å; I31-L111 HydrophobicContact CD1-CD2 4.35Å; I31-L111 HydrophobicContact CG2-CD2 3.67Å
32	F	72.8	Confident	66.2	Low	28 Å²	28	79.6 Å²	79.6	12%	0.123	43%	0.434	C	S	.	.			trans	-65.2	123.6	170.1	-178	-97.5	0	0	0	108.8	L19 Y39 E41 L133 L134	L19-F32 HydrophobicContact CD2-CE2 3.83Å; F32-Y39 VanDerWaalsContact O-CE1 3.22Å; F32-Y39 WeakPolarHBondContact O-CE1 3.16Å; F32-Y39 PolarHBondContact O-OH 3.44Å; F32-E41 VanDerWaalsContact CE1-OE1 3.29Å; F32-E41 WeakPolarHBondContact CE1-OE1 3.41Å; F32-L133 HydrophobicContact CB-CD2 4.33Å; F32-L133 HydrophobicContact CD1-CD2 3.93Å; F32-L133 HydrophobicContact CE1-CD2 4.46Å; F32-L133 HydrophobicContact CG-CD2 4.12Å; F32-L134 HydrophobicContact CB-CB 4.21Å; F32-L134 HydrophobicContact CD2-CD1 4.49Å
33	A	78.3	Confident	68.8	Low	26 Å²	26	74.9 Å²	74.9	22%	0.215	41%	0.411	C	S	.	.			trans	-133.1	128.1	178.9	0	0	0	0	0	110.2	I31	I31-A33 PolarHBondContact O-N 2.94Å
34	P	82.4	Confident	71.6	Confident	33 Å²	33	71 Å²	71	21%	0.214	39%	0.387	C	S	.	.			trans	-64.5	141.6	174.3	26.2	-35.1	0	0	0	111.5	Q36 Y39 C61	P34-Q36 PolarHBondContact O-N 2.84Å; P34-Y39 HydrophobicContact CG-CD1 4.5Å; P34-C61 HydrophobicContact CG-CB 3.89Å
35	E	78.8	Confident	74.3	Confident	102 Å²	102	75.2 Å²	75.2	48%	0.477	40%	0.402	S	S	.	.	S	Bend	trans	-60.8	-34.5	177.9	-64.9	-167.5	144.8	0	0	112.4
36	Q	84.2	Confident	76.8	Confident	159 Å²	159	69.7 Å²	69.7	74%	0.743	40%	0.397	S	S	*	.	S	Bend	trans	-140.5	137.6	179.5	-62.7	-176.9	8	0	0	111.1	P34	P34-Q36 PolarHBondContact O-N 2.84Å
37	G	91.1	Very high	79.3	Confident	9 Å²	9	66.3 Å²	66.3	9%	0.093	37%	0.373	C	S	.	.	S	Bend	trans	80.4	-150.5	176	0	0	0	0	0	114	C73 S75	G37-C73 WeakPolarHBondContact O-CB 3.47Å; G37-C73 PolarHBondContact O-SG 3.14Å; G37-S75 PolarHBondContact N-OG 2.86Å
38	G	92	Very high	81.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	-105.2	178.1	-178.7	0	0	0	0	0	112.7	C56 V59 C73	G38-C56 PolarHBondContact N-SG 3.42Å; G38-C56 VanDerWaalsContact N-SG 3.42Å; G38-V59 CarbonylContact C-O 3.58Å; G38-V59 WeakPolarHBondContact CA-O 3.43Å; G38-C73 VanDerWaalsContact CA-SG 3.55Å
39	Y	92.3	Very high	84	Confident	13 Å²	13	69 Å²	69	5%	0.051	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-65.8	136.4	179.8	-64.1	-80.8	0	0	0	111.9	F32 P34 V59 L60 C61 I110 L130	F32-Y39 VanDerWaalsContact O-CE1 3.22Å; F32-Y39 WeakPolarHBondContact O-CE1 3.16Å; F32-Y39 PolarHBondContact O-OH 3.44Å; P34-Y39 HydrophobicContact CG-CD1 4.5Å; Y39-V59 HydrophobicContact CD2-CG1 4.39Å; Y39-V59 PolarHBondContact N-O 2.92Å; Y39-L60 WeakPolarHBondContact CD2-O 3.39Å; Y39-L60 VanDerWaalsContact CE2-O 3.26Å; Y39-L60 WeakPolarHBondContact CE2-O 3.44Å; Y39-C61 HydrophobicContact CD2-CB 4.14Å; Y39-C61 HydrophobicContact CE2-CB 3.8Å; Y39-I110 HydrophobicContact CD2-CG2 4.21Å; Y39-I110 HydrophobicContact CE2-CG2 4.07Å; Y39-L130 HydrophobicContact CD1-CD1 3.75Å; Y39-L130 HydrophobicContact CD1-CD2 3.92Å; Y39-L130 HydrophobicContact CD1-CG 4.24Å; Y39-L130 HydrophobicContact CD2-CD2 3.66Å; Y39-L130 HydrophobicContact CE1-CD1 4.01Å; Y39-L130 HydrophobicContact CE1-CD2 4Å; Y39-L130 HydrophobicContact CE1-CG 4.15Å; Y39-L130 HydrophobicContact CE2-CD2 3.74Å; Y39-L130 HydrophobicContact CG-CD1 4.22Å; Y39-L130 HydrophobicContact CG-CD2 3.74Å
40	K	90.3	Very high	86.2	Confident	156 Å²	156	70.1 Å²	70.1	68%	0.678	35%	0.351	S	S	*	.			trans	-107.5	6.8	177.9	-62.6	-178	-179	-179.8	0	113	L58	K40-L58 HydrophobicContact CG-CD1 3.83Å
41	E	90.9	Very high	88	Confident	22 Å²	22	68.6 Å²	68.6	10%	0.103	34%	0.339	C	S	.	.	S	Bend	trans	-66.8	155.3	-177.8	-58.5	-54.6	151.9	0	0	111.4	F32 F43 I115 L130 L133	F32-E41 VanDerWaalsContact CE1-OE1 3.29Å; F32-E41 WeakPolarHBondContact CE1-OE1 3.41Å; E41-F43 WeakPolarHBondContact O-CD2 3.17Å; E41-F43 VanDerWaalsContact O-CE2 3.28Å; E41-F43 WeakPolarHBondContact O-CE2 3.26Å; E41-F43 PolarHBondContact O-N 3.13Å; E41-I115 HydrophobicContact CB-CB 4.42Å; E41-I115 HydrophobicContact CB-CD1 4.05Å; E41-I115 HydrophobicContact CB-CG2 4.15Å; E41-I115 HydrophobicContact CG-CD1 4.1Å; E41-L130 HydrophobicContact CB-CD1 4.44Å; E41-L130 HydrophobicContact CG-CD1 4.03Å; E41-L133 HydrophobicContact CG-CD2 3.87Å
42	K	91.7	Very high	89.3	Confident	109 Å²	109	69.8 Å²	69.8	47%	0.474	34%	0.342	S	S	.	.			trans	-82.6	104.8	178.7	-172.2	-171.1	177.4	-165.5	0	109.3	I115 Y116 E120	K42-I115 WeakPolarHBondContact O-CA 3.43Å; K42-Y116 HydrophobicContact CB-CD2 4.44Å; K42-Y116 HydrophobicContact CD-CD2 3.83Å; K42-Y116 HydrophobicContact CD-CG 4.37Å; K42-Y116 HydrophobicContact CG-CD2 3.95Å; K42-Y116 PolarHBondContact O-N 2.97Å; K42-E120 WeakPolarHBondContact CD-OE2 3.29Å; K42-E120 IonicContact NZ-OE1 2.71Å; K42-E120 PolarHBondContact NZ-OE1 3.43Å; K42-E120 IonicContact NZ-OE2 3.96Å; K42-E120 PolarHBondContact NZ-OE2 3.03Å
43	F	93.8	Very high	90.5	Very high	35 Å²	35	68.4 Å²	68.4	15%	0.154	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-75.6	140.6	178.9	-66.5	-94.2	0	0	0	111.5	E41 K45 V47 V59 L113 I115 L130	E41-F43 WeakPolarHBondContact O-CD2 3.17Å; E41-F43 VanDerWaalsContact O-CE2 3.28Å; E41-F43 WeakPolarHBondContact O-CE2 3.26Å; E41-F43 PolarHBondContact O-N 3.13Å; F43-K45 WeakPolarHBondContact CB-O 3.44Å; F43-V47 HydrophobicContact CB-CG2 3.67Å; F43-V47 HydrophobicContact CD1-CG2 3.63Å; F43-V47 HydrophobicContact CD2-CG2 3.76Å; F43-V47 HydrophobicContact CE1-CG2 4.22Å; F43-V47 HydrophobicContact CE2-CG2 4.35Å; F43-V47 HydrophobicContact CG-CG2 3.38Å; F43-V59 HydrophobicContact CD2-CG2 4.21Å; F43-V59 HydrophobicContact CE1-CG1 4.39Å; F43-V59 HydrophobicContact CE1-CG2 4.44Å; F43-V59 HydrophobicContact CE2-CB 4.08Å; F43-V59 HydrophobicContact CE2-CG2 3.49Å; F43-V59 VanDerWaalsContact CE2-CG2 3.49Å; F43-V59 HydrophobicContact CZ-CB 3.85Å; F43-V59 HydrophobicContact CZ-CG1 3.86Å; F43-V59 HydrophobicContact CZ-CG2 3.64Å; F43-L113 HydrophobicContact CD1-CB 3.92Å; F43-L113 HydrophobicContact CD1-CD1 4.16Å; F43-L113 HydrophobicContact CE1-CB 3.83Å; F43-L113 HydrophobicContact CE1-CD1 3.79Å; F43-L113 HydrophobicContact CE1-CG 4.48Å; F43-I115 HydrophobicContact CD1-CG2 3.49Å; F43-I115 VanDerWaalsContact CD1-CG2 3.49Å; F43-I115 HydrophobicContact CE1-CG2 3.62Å; F43-I115 HydrophobicContact CG-CG2 3.98Å; F43-I115 HydrophobicContact CZ-CG2 4.19Å; F43-L130 HydrophobicContact CE1-CD2 4.28Å; F43-L130 HydrophobicContact CZ-CD2 4.24Å
44	V	92.4	Very high	91.2	Very high	44 Å²	44	69.7 Å²	69.7	27%	0.267	34%	0.338	S	S	.	.	S	Bend	trans	-68.3	-41.1	179.9	178.1	0	0	0	0	110.9	Q114 Y116 Q127	V44-Q114 HydrophobicContact CB-CB 4.07Å; V44-Q114 HydrophobicContact CG2-CB 3.97Å; V44-Q114 PolarHBondContact N-O 3Å; V44-Y116 HydrophobicContact CB-CE2 4.19Å; V44-Y116 HydrophobicContact CG1-CE2 4.46Å; V44-Y116 HydrophobicContact CG2-CD2 3.98Å; V44-Y116 HydrophobicContact CG2-CE1 4.43Å; V44-Y116 HydrophobicContact CG2-CE2 3.79Å; V44-Y116 HydrophobicContact CG2-CG 4.39Å; V44-Q127 HydrophobicContact CG2-CB 4.46Å; V44-Q127 HydrophobicContact CG2-CG 4.09Å
45	K	91.7	Very high	91.7	Very high	171 Å²	171	71.9 Å²	71.9	74%	0.743	34%	0.344	S	S	*	.	S	Bend	trans	-108.6	151.3	175.8	-63.4	-176.7	-179	-179.9	0	109.9	F43 V47	F43-K45 WeakPolarHBondContact CB-O 3.44Å; K45-V47 PolarHBondContact O-N 3.48Å
46	T	91.6	Very high	92.5	Very high	143 Å²	143	68.9 Å²	68.9	88%	0.877	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-57.3	126	171.7	-52.2	0	0	0	0	109.9
47	V	93.4	Very high	93	Very high	18 Å²	18	69.7 Å²	69.7	11%	0.109	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-82.1	128.2	-177	-175.3	0	0	0	0	110.2	F43 K45 Y51 K52 V59 L113	F43-V47 HydrophobicContact CB-CG2 3.67Å; F43-V47 HydrophobicContact CD1-CG2 3.63Å; F43-V47 HydrophobicContact CD2-CG2 3.76Å; F43-V47 HydrophobicContact CE1-CG2 4.22Å; F43-V47 HydrophobicContact CE2-CG2 4.35Å; F43-V47 HydrophobicContact CG-CG2 3.38Å; K45-V47 PolarHBondContact O-N 3.48Å; V47-Y51 HydrophobicContact CG1-CD2 3.99Å; V47-Y51 HydrophobicContact CG1-CG 4.39Å; V47-K52 WeakPolarHBondContact O-CE 3.48Å; V47-V59 HydrophobicContact CB-CG2 4.19Å; V47-V59 HydrophobicContact CG1-CG2 3.84Å; V47-V59 HydrophobicContact CG2-CG2 4.06Å; V47-L113 HydrophobicContact CG1-CD1 4.09Å; V47-L113 HydrophobicContact CG2-CD1 4.45Å
48	E	92.9	Very high	93.2	Very high	102 Å²	102	72 Å²	72	48%	0.477	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-57.9	144.3	175.3	-62.1	176.4	-103.1	0	0	111.7	K50 Y51	E48-K50 HydrophobicContact CB-CD 4.47Å; E48-K50 HydrophobicContact CB-CG 4.08Å; E48-K50 PolarHBondContact O-N 3.34Å; E48-K50 VanDerWaalsContact O-N 3.17Å; E48-K50 WeakPolarHBondContact OE1-CE 3.33Å; E48-K50 IonicContact OE1-NZ 3.95Å; E48-K50 PolarHBondContact OE1-NZ 3.47Å; E48-K50 VanDerWaalsContact OE2-CE 3.26Å; E48-K50 WeakPolarHBondContact OE2-CE 3.16Å; E48-K50 IonicContact OE2-NZ 2.7Å; E48-K50 PolarHBondContact OE2-NZ 3.4Å; E48-Y51 HydrophobicContact CB-CD2 4.02Å; E48-Y51 HydrophobicContact CB-CE2 4.26Å; E48-Y51 PolarHBondContact O-N 3.41Å; E48-Y51 VanDerWaalsContact O-N 3.1Å
49	D	91.8	Very high	93.3	Very high	118 Å²	118	72.5 Å²	72.5	63%	0.631	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-62.5	-26.6	-176.9	-70.1	-33	0	0	0	113.3	Y51 K52	D49-Y51 PolarHBondContact O-N 3.49Å; D49-Y51 VanDerWaalsContact O-N 3.08Å; D49-K52 WeakPolarHBondContact O-CB 3.35Å; D49-K52 PolarHBondContact O-N 3.27Å; D49-K52 WeakPolarHBondContact OD1-CD 3.37Å; D49-K52 WeakPolarHBondContact OD1-CE 3.33Å; D49-K52 IonicContact OD1-NZ 2.72Å; D49-K52 PolarHBondContact OD1-NZ 3.41Å
50	K	92.8	Very high	93.5	Very high	94 Å²	94	71.9 Å²	71.9	41%	0.409	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-60	-20.3	176.2	75.9	-171.1	-173.1	-154.5	0	114.2	E48 R71	E48-K50 HydrophobicContact CB-CD 4.47Å; E48-K50 HydrophobicContact CB-CG 4.08Å; E48-K50 PolarHBondContact O-N 3.34Å; E48-K50 VanDerWaalsContact O-N 3.17Å; E48-K50 WeakPolarHBondContact OE1-CE 3.33Å; E48-K50 IonicContact OE1-NZ 3.95Å; E48-K50 PolarHBondContact OE1-NZ 3.47Å; E48-K50 VanDerWaalsContact OE2-CE 3.26Å; E48-K50 WeakPolarHBondContact OE2-CE 3.16Å; E48-K50 IonicContact OE2-NZ 2.7Å; E48-K50 PolarHBondContact OE2-NZ 3.4Å; K50-R71 PolarHBondContact O-NH1 2.83Å
51	Y	95.4	Very high	93.6	Very high	18 Å²	18	65 Å²	65	7%	0.071	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-96.7	1.6	177.5	-59.9	-48.9	0	0	0	113.2	V47 E48 D49 V59 L60 E109 I110 L113	V47-Y51 HydrophobicContact CG1-CD2 3.99Å; V47-Y51 HydrophobicContact CG1-CG 4.39Å; E48-Y51 HydrophobicContact CB-CD2 4.02Å; E48-Y51 HydrophobicContact CB-CE2 4.26Å; E48-Y51 PolarHBondContact O-N 3.41Å; E48-Y51 VanDerWaalsContact O-N 3.1Å; D49-Y51 PolarHBondContact O-N 3.49Å; D49-Y51 VanDerWaalsContact O-N 3.08Å; Y51-V59 CarbonylContact O-C 3.43Å; Y51-V59 WeakPolarHBondContact O-CA 3.36Å; Y51-L60 WeakPolarHBondContact O-CD1 3.26Å; Y51-L60 WeakPolarHBondContact O-CG 3.47Å; Y51-L60 PolarHBondContact O-N 3.3Å; Y51-E109 HydrophobicContact CE1-CB 3.83Å; Y51-E109 VanDerWaalsContact CE1-OE2 3.31Å; Y51-E109 WeakPolarHBondContact CE1-OE2 3.25Å; Y51-E109 PolarHBondContact OH-OE2 3.09Å; Y51-I110 HydrophobicContact CD1-CD1 4.17Å; Y51-I110 HydrophobicContact CD1-CG1 3.7Å; Y51-I110 HydrophobicContact CE1-CG1 4.41Å; Y51-I110 HydrophobicContact CG-CG1 4.03Å; Y51-L113 HydrophobicContact CD2-CD1 4.4Å; Y51-L113 HydrophobicContact CE2-CD2 4.49Å
52	K	95.4	Very high	93.7	Very high	65 Å²	65	65.4 Å²	65.4	28%	0.283	32%	0.317	S	S	.	.	B	Isolated β-bridge	trans	-94.8	147.2	179.1	-62.1	179	-171.3	162.2	0	110.6	V47 D49 L58	V47-K52 WeakPolarHBondContact O-CE 3.48Å; D49-K52 WeakPolarHBondContact O-CB 3.35Å; D49-K52 PolarHBondContact O-N 3.27Å; D49-K52 WeakPolarHBondContact OD1-CD 3.37Å; D49-K52 WeakPolarHBondContact OD1-CE 3.33Å; D49-K52 IonicContact OD1-NZ 2.72Å; D49-K52 PolarHBondContact OD1-NZ 3.41Å; K52-L58 WeakPolarHBondContact CA-O 3.28Å
53	C	96.3	Very high	93.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.			trans	-78.9	131.8	178	178.1	0	0	0	0	111.2	K55 C56 R57 L58 L60 C73	C53-K55 PolarHBondContact O-N 3.21Å; C53-K55 VanDerWaalsContact O-N 3.14Å; C53-K55 PolarHBondContact SG-N 2.68Å; C53-C56 WeakPolarHBondContact CB-SG 3.31Å; C53-R57 WeakPolarHBondContact O-CA 3.1Å; C53-R57 PolarHBondContact O-N 3.37Å; C53-L58 WeakPolarHBondContact CB-O 3.35Å; C53-L58 PolarHBondContact N-O 2.69Å; C53-L60 HydrophobicContact CB-CD2 3.68Å; C53-L60 HydrophobicContact CB-CG 4.31Å; C53-C73 PolarHBondContact SG-N 3.31Å; C53-C73 VanDerWaalsContact SG-N 3.37Å
54	E	94.8	Very high	94	Very high	53 Å²	53	60 Å²	60	25%	0.248	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.7	179.6	-65.6	-56.1	155.3	0	0	114.2	H70 R71 F72 T89 A90	E54-H70 HydrophobicContact CG-CB 4.24Å; E54-R71 PolarHBondContact N-O 3.25Å; E54-R71 VanDerWaalsContact N-O 3.17Å; E54-F72 HydrophobicContact CB-CD1 4.17Å; E54-F72 HydrophobicContact CB-CE1 3.59Å; E54-F72 HydrophobicContact CB-CZ 3.8Å; E54-T89 VanDerWaalsContact C-OG1 3.31Å; E54-T89 PolarHBondContact O-OG1 3.12Å; E54-A90 HydrophobicContact CB-CB 4.28Å; E54-A90 HydrophobicContact CG-CB 4.02Å
55	K	92.9	Very high	94.2	Very high	79 Å²	79	60.8 Å²	60.8	34%	0.343	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-54.1	175.9	-179.1	168.2	179.7	174.7	0	113.5	C53 F72 C76 A79 L80	C53-K55 PolarHBondContact O-N 3.21Å; C53-K55 VanDerWaalsContact O-N 3.14Å; C53-K55 PolarHBondContact SG-N 2.68Å; K55-F72 HydrophobicContact CB-CD1 3.91Å; K55-F72 HydrophobicContact CB-CE1 4.18Å; K55-C76 HydrophobicContact CB-CB 4.07Å; K55-C76 HydrophobicContact CD-CB 3.9Å; K55-C76 WeakPolarHBondContact CD-O 3.43Å; K55-C76 HydrophobicContact CG-CB 4.31Å; K55-C76 PolarHBondContact NZ-O 3.44Å; K55-C76 VanDerWaalsContact NZ-O 3.13Å; K55-A79 VanDerWaalsContact NZ-C 3.34Å; K55-A79 VanDerWaalsContact NZ-CB 3.25Å; K55-L80 HydrophobicContact CD-CD1 4.05Å; K55-L80 HydrophobicContact CD-CD2 3.93Å; K55-L80 HydrophobicContact CD-CG 3.73Å
56	C	94.6	Very high	94.3	Very high	38 Å²	38	53 Å²	53	26%	0.257	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-7.1	-174.7	69.1	0	0	0	0	114.2	G38 C53 L58 C76	G38-C56 PolarHBondContact N-SG 3.42Å; G38-C56 VanDerWaalsContact N-SG 3.42Å; C53-C56 WeakPolarHBondContact CB-SG 3.31Å; C56-L58 PolarHBondContact O-N 2.98Å; C56-C76 VanDerWaalsContact SG-SG 3.68Å
57	R	94.1	Very high	94.4	Very high	176 Å²	176	52.2 Å²	52.2	66%	0.664	25%	0.248	S	C	*	.			trans	59	6.7	-179.1	-54.3	-59.2	-172.2	119.3	-2	115.8	C53	C53-R57 WeakPolarHBondContact O-CA 3.1Å; C53-R57 PolarHBondContact O-N 3.37Å
58	L	94.9	Very high	94.4	Very high	58 Å²	58	52.8 Å²	52.8	30%	0.304	25%	0.252	S	S	.	.	S	Bend	trans	-89.9	165.2	172.4	-61.5	174.8	0	0	0	110.8	K40 K52 C53 C56 L60	K40-L58 HydrophobicContact CG-CD1 3.83Å; K52-L58 WeakPolarHBondContact CA-O 3.28Å; C53-L58 WeakPolarHBondContact CB-O 3.35Å; C53-L58 PolarHBondContact N-O 2.69Å; C56-L58 PolarHBondContact O-N 2.98Å; L58-L60 PolarHBondContact O-N 2.81Å
59	V	95.6	Very high	94.3	Very high	10 Å²	10	49.5 Å²	49.5	6%	0.061	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-62	130.6	177.4	-179	0	0	0	0	110.1	G38 Y39 F43 V47 Y51 C61 I110 L113	G38-V59 CarbonylContact C-O 3.58Å; G38-V59 WeakPolarHBondContact CA-O 3.43Å; Y39-V59 HydrophobicContact CD2-CG1 4.39Å; Y39-V59 PolarHBondContact N-O 2.92Å; F43-V59 HydrophobicContact CD2-CG2 4.21Å; F43-V59 HydrophobicContact CE1-CG1 4.39Å; F43-V59 HydrophobicContact CE1-CG2 4.44Å; F43-V59 HydrophobicContact CE2-CB 4.08Å; F43-V59 HydrophobicContact CE2-CG2 3.49Å; F43-V59 VanDerWaalsContact CE2-CG2 3.49Å; F43-V59 HydrophobicContact CZ-CB 3.85Å; F43-V59 HydrophobicContact CZ-CG1 3.86Å; F43-V59 HydrophobicContact CZ-CG2 3.64Å; V47-V59 HydrophobicContact CB-CG2 4.19Å; V47-V59 HydrophobicContact CG1-CG2 3.84Å; V47-V59 HydrophobicContact CG2-CG2 4.06Å; Y51-V59 CarbonylContact O-C 3.43Å; Y51-V59 WeakPolarHBondContact O-CA 3.36Å; V59-C61 PolarHBondContact O-N 3.22Å; V59-I110 HydrophobicContact CG1-CD1 4.33Å; V59-I110 HydrophobicContact CG1-CG1 4.32Å; V59-I110 HydrophobicContact CG1-CG2 3.72Å; V59-L113 HydrophobicContact CG1-CD1 4.35Å
60	L	95.3	Very high	94.5	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-59.9	132.1	-167.7	-63.6	148	0	0	0	112.6	Y39 Y51 C53 L58 P63 R71 I110	Y39-L60 WeakPolarHBondContact CD2-O 3.39Å; Y39-L60 VanDerWaalsContact CE2-O 3.26Å; Y39-L60 WeakPolarHBondContact CE2-O 3.44Å; Y51-L60 WeakPolarHBondContact O-CD1 3.26Å; Y51-L60 WeakPolarHBondContact O-CG 3.47Å; Y51-L60 PolarHBondContact O-N 3.3Å; C53-L60 HydrophobicContact CB-CD2 3.68Å; C53-L60 HydrophobicContact CB-CG 4.31Å; L58-L60 PolarHBondContact O-N 2.81Å; L60-P63 HydrophobicContact CB-CB 3.91Å; L60-P63 HydrophobicContact CD1-CB 4.16Å; L60-P63 HydrophobicContact CD2-CB 4.39Å; L60-P63 HydrophobicContact CG-CB 4.4Å; L60-R71 HydrophobicContact CD1-CB 3.67Å; L60-R71 HydrophobicContact CD1-CG 4.43Å; L60-R71 HydrophobicContact CD2-CB 3.97Å; L60-I110 HydrophobicContact CB-CD1 3.59Å; L60-I110 HydrophobicContact CD1-CD1 4.12Å; L60-I110 HydrophobicContact CG-CD1 4.38Å
61	C	94.1	Very high	94.6	Very high	10 Å²	10	45.5 Å²	45.5	7%	0.068	22%	0.222	C	C	.	.	S	Bend	trans	-107.7	126.8	168.6	178.5	0	0	0	0	109.7	P34 Y39 V59 C73 E74	P34-C61 HydrophobicContact CG-CB 3.89Å; Y39-C61 HydrophobicContact CD2-CB 4.14Å; Y39-C61 HydrophobicContact CE2-CB 3.8Å; V59-C61 PolarHBondContact O-N 3.22Å; C61-C73 PolarHBondContact N-SG 3.31Å; C61-C73 VanDerWaalsContact O-CA 3.25Å; C61-C73 WeakPolarHBondContact O-CA 2.94Å; C61-C73 WeakPolarHBondContact O-CB 3.39Å; C61-E74 PolarHBondContact O-N 3.08Å
62	S	92.8	Very high	94.7	Very high	32 Å²	32	44.6 Å²	44.6	22%	0.224	22%	0.218	C	C	.	.	S	Bend	trans	46	61.8	-173.3	-65.8	0	0	0	0	112	K64 E74	S62-K64 PolarHBondContact O-N 2.84Å; S62-E74 WeakPolarHBondContact CB-OE2 3.48Å; S62-E74 WeakPolarHBondContact O-CB 3.42Å; S62-E74 PolarHBondContact O-N 2.66Å
63	P	95.6	Very high	94.7	Very high	4 Å²	4	41.5 Å²	41.5	3%	0.026	21%	0.205	C	C	.	.			trans	-57.3	136.4	-169.7	22.1	-33.3	0	0	0	113.1	L60 F72 D103 C106 K107	L60-P63 HydrophobicContact CB-CB 3.91Å; L60-P63 HydrophobicContact CD1-CB 4.16Å; L60-P63 HydrophobicContact CD2-CB 4.39Å; L60-P63 HydrophobicContact CG-CB 4.4Å; P63-F72 CarbonylContact C-O 3.51Å; P63-F72 WeakPolarHBondContact CA-O 3.34Å; P63-D103 HydrophobicContact CB-CB 4.21Å; P63-D103 HydrophobicContact CG-CB 4.35Å; P63-D103 WeakPolarHBondContact CG-O 3.26Å; P63-D103 PolarHBondContact O-N 3.45Å; P63-C106 HydrophobicContact CB-CB 4.49Å; P63-C106 HydrophobicContact CG-CB 4.11Å; P63-K107 HydrophobicContact CG-CB 3.91Å
64	K	95.8	Very high	94.6	Very high	25 Å²	25	45.8 Å²	45.8	11%	0.109	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.5	171.3	-56.8	-64	-178.8	173.7	0	108.8	S62 R71 F72 E74 M77 V100 F101 K102	S62-K64 PolarHBondContact O-N 2.84Å; K64-R71 CarbonylContact O-C 3.54Å; K64-R71 WeakPolarHBondContact O-CA 3.45Å; K64-F72 PolarHBondContact N-O 2.7Å; K64-F72 PolarHBondContact O-N 3.37Å; K64-E74 WeakPolarHBondContact CE-OE1 3.41Å; K64-E74 HydrophobicContact CG-CB 4.39Å; K64-E74 IonicContact NZ-OE1 3.7Å; K64-E74 PolarHBondContact NZ-OE1 3.19Å; K64-M77 HydrophobicContact CB-CB 4.3Å; K64-M77 HydrophobicContact CB-CE 4.41Å; K64-M77 HydrophobicContact CB-CG 4.25Å; K64-M77 HydrophobicContact CG-CB 4.2Å; K64-M77 HydrophobicContact CG-CG 4.33Å; K64-V100 HydrophobicContact CB-CG1 3.82Å; K64-V100 HydrophobicContact CG-CG1 4.4Å; K64-F101 CarbonylContact C-O 3.56Å; K64-F101 VanDerWaalsContact CA-O 3.27Å; K64-F101 WeakPolarHBondContact CA-O 3.44Å; K64-K102 HydrophobicContact CD-CG 4.25Å
65	Q	96.1	Very high	94.6	Very high	62 Å²	62	45 Å²	45	29%	0.29	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.2	176.7	-167.7	177.1	9	0	0	109.9	G69 H70 R71 F101 D103	Q65-G69 PolarHBondContact NE2-O 2.86Å; Q65-H70 WeakPolarHBondContact CA-O 3.48Å; Q65-R71 HydrophobicContact CG-CG 4.42Å; Q65-F101 PolarHBondContact N-O 3.49Å; Q65-F101 PolarHBondContact O-N 3.42Å; Q65-D103 HydrophobicContact CB-CB 4.36Å
66	T	94.3	Very high	94.7	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.037	21%	0.212	C	C	.	.			trans	-85.5	165.2	173.6	54.5	0	0	0	0	111.2	C68 G69 H70 F72 M77 I95	T66-C68 PolarHBondContact O-N 3.31Å; T66-C68 PolarHBondContact OG1-SG 3.42Å; T66-G69 PolarHBondContact O-N 3.17Å; T66-H70 PolarHBondContact N-O 3.03Å; T66-H70 PolarHBondContact OG1-N 3.19Å; T66-H70 PolarHBondContact OG1-O 3.34Å; T66-F72 HydrophobicContact CG2-CD2 4.05Å; T66-F72 HydrophobicContact CG2-CE2 3.84Å; T66-M77 HydrophobicContact CG2-CE 3.39Å; T66-I95 HydrophobicContact CG2-CD1 3.99Å; T66-I95 HydrophobicContact CG2-CG1 4.13Å; T66-I95 HydrophobicContact CG2-CG2 4.08Å
67	E	93.3	Very high	94.7	Very high	128 Å²	128	40.1 Å²	40.1	60%	0.598	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.1	172.5	-174.1	174.8	-141.8	0	0	112.6	G69 K99	E67-G69 PolarHBondContact O-N 3.37Å; E67-G69 VanDerWaalsContact O-N 3.11Å; E67-K99 HydrophobicContact CB-CB 4.22Å; E67-K99 HydrophobicContact CB-CD 4.37Å; E67-K99 HydrophobicContact CG-CD 4.37Å; E67-K99 PolarHBondContact N-O 2.85Å; E67-K99 WeakPolarHBondContact OE1-CD 3.39Å; E67-K99 IonicContact OE1-NZ 2.82Å; E67-K99 PolarHBondContact OE1-NZ 2.77Å; E67-K99 WeakPolarHBondContact OE2-CD 3.43Å; E67-K99 WeakPolarHBondContact OE2-CE 3.47Å; E67-K99 IonicContact OE2-NZ 2.81Å; E67-K99 PolarHBondContact OE2-NZ 2.99Å
68	C	92.8	Very high	94.6	Very high	29 Å²	29	34.2 Å²	34.2	20%	0.196	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	8.6	174.9	70.3	0	0	0	0	114.3	T66 H70 C91 E93	T66-C68 PolarHBondContact O-N 3.31Å; T66-C68 PolarHBondContact OG1-SG 3.42Å; C68-H70 VanDerWaalsContact C-N 3.34Å; C68-H70 PolarHBondContact O-N 2.97Å; C68-H70 PolarHBondContact O-ND1 3.11Å; C68-H70 VanDerWaalsContact O-ND1 3.13Å; C68-H70 PolarHBondContact SG-ND1 2.93Å; C68-H70 VanDerWaalsContact SG-ND1 3.44Å; C68-C91 PolarHBondContact SG-SG 3.46Å; C68-E93 HydrophobicContact CB-CB 4.43Å; C68-E93 WeakPolarHBondContact CB-OE2 3.45Å
69	G	91.6	Very high	94.5	Very high	33 Å²	33	34 Å²	34	34%	0.34	20%	0.197	S	C	.	.	S	Bend	trans	83.7	-5.4	172	0	0	0	0	0	116.3	Q65 T66 E67	Q65-G69 PolarHBondContact NE2-O 2.86Å; T66-G69 PolarHBondContact O-N 3.17Å; E67-G69 PolarHBondContact O-N 3.37Å; E67-G69 VanDerWaalsContact O-N 3.11Å
70	H	95.3	Very high	94.3	Very high	55 Å²	55	34.4 Å²	34.4	26%	0.255	20%	0.198	S	C	.	.			trans	-84.3	148.1	-176.3	-66.9	92.8	0	0	0	112.8	E54 Q65 T66 C68 F72 A90	E54-H70 HydrophobicContact CG-CB 4.24Å; Q65-H70 WeakPolarHBondContact CA-O 3.48Å; T66-H70 PolarHBondContact N-O 3.03Å; T66-H70 PolarHBondContact OG1-N 3.19Å; T66-H70 PolarHBondContact OG1-O 3.34Å; C68-H70 VanDerWaalsContact C-N 3.34Å; C68-H70 PolarHBondContact O-N 2.97Å; C68-H70 PolarHBondContact O-ND1 3.11Å; C68-H70 VanDerWaalsContact O-ND1 3.13Å; C68-H70 PolarHBondContact SG-ND1 2.93Å; C68-H70 VanDerWaalsContact SG-ND1 3.44Å; H70-F72 HydrophobicContact CB-CE2 3.95Å; H70-F72 HydrophobicContact CB-CZ 4.45Å; H70-A90 WeakPolarHBondContact CD2-CB 3.48Å
71	R	96.3	Very high	94.1	Very high	73 Å²	73	36.8 Å²	36.8	28%	0.275	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.5	-173.3	-62.2	-175.6	-177.2	94.7	6.9	113.1	K50 E54 L60 K64 Q65 D103	K50-R71 PolarHBondContact O-NH1 2.83Å; E54-R71 PolarHBondContact N-O 3.25Å; E54-R71 VanDerWaalsContact N-O 3.17Å; L60-R71 HydrophobicContact CD1-CB 3.67Å; L60-R71 HydrophobicContact CD1-CG 4.43Å; L60-R71 HydrophobicContact CD2-CB 3.97Å; K64-R71 CarbonylContact O-C 3.54Å; K64-R71 WeakPolarHBondContact O-CA 3.45Å; Q65-R71 HydrophobicContact CG-CG 4.42Å; R71-D103 IonicContact CZ-OD2 3.04Å; R71-D103 IonicContact NE-OD2 2.69Å; R71-D103 PolarHBondContact NE-OD2 3.27Å; R71-D103 IonicContact NH2-OD2 2.73Å
72	F	96.5	Very high	94	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	151.7	179.6	-60.4	-93	0	0	0	111.3	E54 K55 P63 K64 T66 H70 M77 L80 T89	E54-F72 HydrophobicContact CB-CD1 4.17Å; E54-F72 HydrophobicContact CB-CE1 3.59Å; E54-F72 HydrophobicContact CB-CZ 3.8Å; K55-F72 HydrophobicContact CB-CD1 3.91Å; K55-F72 HydrophobicContact CB-CE1 4.18Å; P63-F72 CarbonylContact C-O 3.51Å; P63-F72 WeakPolarHBondContact CA-O 3.34Å; K64-F72 PolarHBondContact N-O 2.7Å; K64-F72 PolarHBondContact O-N 3.37Å; T66-F72 HydrophobicContact CG2-CD2 4.05Å; T66-F72 HydrophobicContact CG2-CE2 3.84Å; H70-F72 HydrophobicContact CB-CE2 3.95Å; H70-F72 HydrophobicContact CB-CZ 4.45Å; F72-M77 HydrophobicContact CB-CB 4.19Å; F72-M77 HydrophobicContact CB-CE 3.91Å; F72-M77 HydrophobicContact CD2-CE 3.37Å; F72-M77 HydrophobicContact CE2-CE 4.11Å; F72-M77 HydrophobicContact CG-CE 3.8Å; F72-L80 HydrophobicContact CD1-CD1 3.66Å; F72-L80 HydrophobicContact CE1-CD1 3.56Å; F72-L80 HydrophobicContact CG-CD1 4.34Å; F72-L80 HydrophobicContact CZ-CD1 4.2Å; F72-T89 WeakPolarHBondContact CE1-OG1 3.33Å
73	C	96.6	Very high	93.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.249	C	C	.	.			trans	-64.1	152	167	-53.9	0	0	0	0	110.2	G37 G38 C53 C61 S75 C76 M77	G37-C73 WeakPolarHBondContact O-CB 3.47Å; G37-C73 PolarHBondContact O-SG 3.14Å; G38-C73 VanDerWaalsContact CA-SG 3.55Å; C53-C73 PolarHBondContact SG-N 3.31Å; C53-C73 VanDerWaalsContact SG-N 3.37Å; C61-C73 PolarHBondContact N-SG 3.31Å; C61-C73 VanDerWaalsContact O-CA 3.25Å; C61-C73 WeakPolarHBondContact O-CA 2.94Å; C61-C73 WeakPolarHBondContact O-CB 3.39Å; C73-S75 VanDerWaalsContact C-N 3.33Å; C73-S75 PolarHBondContact O-N 2.75Å; C73-C76 HydrophobicContact CB-CB 3.95Å; C73-C76 WeakPolarHBondContact O-CB 3.32Å; C73-C76 PolarHBondContact O-N 3.29Å; C73-C76 VanDerWaalsContact O-N 3.09Å; C73-M77 WeakPolarHBondContact O-CB 3.47Å; C73-M77 PolarHBondContact O-N 3.07Å
74	E	94.5	Very high	93.2	Very high	89 Å²	89	48.3 Å²	48.3	42%	0.416	29%	0.291	S	S	.	.	H	α-helix	trans	-55	-46.8	177.4	179.6	160	-125.3	0	0	112.9	C61 S62 K64 M77 A78	C61-E74 PolarHBondContact O-N 3.08Å; S62-E74 WeakPolarHBondContact CB-OE2 3.48Å; S62-E74 WeakPolarHBondContact O-CB 3.42Å; S62-E74 PolarHBondContact O-N 2.66Å; K64-E74 WeakPolarHBondContact CE-OE1 3.41Å; K64-E74 HydrophobicContact CG-CB 4.39Å; K64-E74 IonicContact NZ-OE1 3.7Å; K64-E74 PolarHBondContact NZ-OE1 3.19Å; E74-M77 PolarHBondContact O-N 2.83Å; E74-A78 WeakPolarHBondContact O-CB 3.35Å; E74-A78 PolarHBondContact O-N 3.27Å
75	S	94.4	Very high	92.8	Very high	38 Å²	38	50.6 Å²	50.6	27%	0.266	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-37.8	176.6	54	0	0	0	0	112.5	G37 C73 A79	G37-S75 PolarHBondContact N-OG 2.86Å; C73-S75 VanDerWaalsContact C-N 3.33Å; C73-S75 PolarHBondContact O-N 2.75Å; S75-A79 WeakPolarHBondContact O-CB 3.26Å; S75-A79 PolarHBondContact O-N 2.84Å; S75-A79 VanDerWaalsContact O-N 3.08Å
76	C	94.7	Very high	92.5	Very high	9 Å²	9	48.9 Å²	48.9	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-43.5	175.4	-74.7	0	0	0	0	112.1	K55 C56 C73 A79 L80	K55-C76 HydrophobicContact CB-CB 4.07Å; K55-C76 HydrophobicContact CD-CB 3.9Å; K55-C76 WeakPolarHBondContact CD-O 3.43Å; K55-C76 HydrophobicContact CG-CB 4.31Å; K55-C76 PolarHBondContact NZ-O 3.44Å; K55-C76 VanDerWaalsContact NZ-O 3.13Å; C56-C76 VanDerWaalsContact SG-SG 3.68Å; C73-C76 HydrophobicContact CB-CB 3.95Å; C73-C76 WeakPolarHBondContact O-CB 3.32Å; C73-C76 PolarHBondContact O-N 3.29Å; C73-C76 VanDerWaalsContact O-N 3.09Å; C76-A79 PolarHBondContact O-N 2.94Å; C76-L80 WeakPolarHBondContact O-CG 3.34Å; C76-L80 PolarHBondContact O-N 3.37Å
77	M	94.3	Very high	92.4	Very high	4 Å²	4	53.7 Å²	53.7	2%	0.02	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-46.5	177.8	-179.4	55.2	75.5	0	0	111.2	K64 T66 F72 C73 E74 A79 L80 L81 I95 V100	K64-M77 HydrophobicContact CB-CB 4.3Å; K64-M77 HydrophobicContact CB-CE 4.41Å; K64-M77 HydrophobicContact CB-CG 4.25Å; K64-M77 HydrophobicContact CG-CB 4.2Å; K64-M77 HydrophobicContact CG-CG 4.33Å; T66-M77 HydrophobicContact CG2-CE 3.39Å; F72-M77 HydrophobicContact CB-CB 4.19Å; F72-M77 HydrophobicContact CB-CE 3.91Å; F72-M77 HydrophobicContact CD2-CE 3.37Å; F72-M77 HydrophobicContact CE2-CE 4.11Å; F72-M77 HydrophobicContact CG-CE 3.8Å; C73-M77 WeakPolarHBondContact O-CB 3.47Å; C73-M77 PolarHBondContact O-N 3.07Å; E74-M77 PolarHBondContact O-N 2.83Å; M77-A79 VanDerWaalsContact C-N 3.28Å; M77-A79 PolarHBondContact O-N 3.23Å; M77-L80 WeakPolarHBondContact O-CB 3.22Å; M77-L80 PolarHBondContact O-N 3.45Å; M77-L81 HydrophobicContact CG-CD1 3.97Å; M77-L81 HydrophobicContact CG-CG 4.4Å; M77-L81 WeakPolarHBondContact O-CG 3.31Å; M77-L81 PolarHBondContact O-N 3.11Å; M77-L81 HydrophobicContact SD-CD1 4.13Å; M77-L81 HydrophobicContact SD-CG 4.03Å; M77-I95 HydrophobicContact CE-CD1 4.5Å; M77-I95 HydrophobicContact SD-CD1 4.49Å; M77-I95 HydrophobicContact SD-CG2 4.3Å; M77-V100 HydrophobicContact CE-CG1 4.05Å; M77-V100 HydrophobicContact CE-CG2 4.35Å; M77-V100 HydrophobicContact CG-CG1 3.94Å; M77-V100 HydrophobicContact SD-CG1 4.23Å; M77-V100 HydrophobicContact SD-CG2 4.16Å
78	A	92.9	Very high	92.4	Very high	53 Å²	53	47.6 Å²	47.6	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-54	-47.2	174.1	0	0	0	0	0	111.1	E74 L80 L81 S82	E74-A78 WeakPolarHBondContact O-CB 3.35Å; E74-A78 PolarHBondContact O-N 3.27Å; A78-L80 VanDerWaalsContact C-N 3.28Å; A78-L80 PolarHBondContact O-N 3.03Å; A78-L81 PolarHBondContact O-N 3.11Å; A78-S82 PolarHBondContact O-N 2.9Å; A78-S82 PolarHBondContact O-OG 3.39Å
79	A	91.9	Very high	92.3	Very high	54 Å²	54	48.9 Å²	48.9	45%	0.446	30%	0.304	S	S	.	.	H	α-helix	trans	-67.5	-21.2	176.9	0	0	0	0	0	114.4	K55 S75 C76 M77	K55-A79 VanDerWaalsContact NZ-C 3.34Å; K55-A79 VanDerWaalsContact NZ-CB 3.25Å; S75-A79 WeakPolarHBondContact O-CB 3.26Å; S75-A79 PolarHBondContact O-N 2.84Å; S75-A79 VanDerWaalsContact O-N 3.08Å; C76-A79 PolarHBondContact O-N 2.94Å; M77-A79 VanDerWaalsContact C-N 3.28Å; M77-A79 PolarHBondContact O-N 3.23Å
80	L	91.5	Very high	92.3	Very high	18 Å²	18	49.5 Å²	49.5	9%	0.094	31%	0.306	C	S	.	.	H	α-helix	trans	-78	-44.6	170.9	-74	170.2	0	0	0	110.8	K55 F72 C76 M77 A78 S82 S83 T89 I95	K55-L80 HydrophobicContact CD-CD1 4.05Å; K55-L80 HydrophobicContact CD-CD2 3.93Å; K55-L80 HydrophobicContact CD-CG 3.73Å; F72-L80 HydrophobicContact CD1-CD1 3.66Å; F72-L80 HydrophobicContact CE1-CD1 3.56Å; F72-L80 HydrophobicContact CG-CD1 4.34Å; F72-L80 HydrophobicContact CZ-CD1 4.2Å; C76-L80 WeakPolarHBondContact O-CG 3.34Å; C76-L80 PolarHBondContact O-N 3.37Å; M77-L80 WeakPolarHBondContact O-CB 3.22Å; M77-L80 PolarHBondContact O-N 3.45Å; A78-L80 VanDerWaalsContact C-N 3.28Å; A78-L80 PolarHBondContact O-N 3.03Å; L80-S82 PolarHBondContact O-N 3.13Å; L80-S83 WeakPolarHBondContact O-CB 3.49Å; L80-S83 PolarHBondContact O-N 3.45Å; L80-S83 VanDerWaalsContact O-N 3.07Å; L80-S83 PolarHBondContact O-OG 2.91Å; L80-T89 HydrophobicContact CD2-CG2 4.02Å; L80-I95 HydrophobicContact CD1-CD1 4.38Å
81	L	91.6	Very high	92.2	Very high	50 Å²	50	48.9 Å²	48.9	26%	0.262	31%	0.307	S	S	.	.	H	α-helix	trans	-66.8	-21	179.5	-67.1	172.7	0	0	0	113.3	M77 A78 S83 P86 I95 K97	M77-L81 HydrophobicContact CG-CD1 3.97Å; M77-L81 HydrophobicContact CG-CG 4.4Å; M77-L81 WeakPolarHBondContact O-CG 3.31Å; M77-L81 PolarHBondContact O-N 3.11Å; M77-L81 HydrophobicContact SD-CD1 4.13Å; M77-L81 HydrophobicContact SD-CG 4.03Å; A78-L81 PolarHBondContact O-N 3.11Å; L81-S83 PolarHBondContact O-N 2.83Å; L81-P86 HydrophobicContact CD2-CB 4.23Å; L81-P86 HydrophobicContact CD2-CG 4.47Å; L81-I95 HydrophobicContact CD2-CG2 3.95Å; L81-K97 HydrophobicContact CD1-CG 4.16Å; L81-K97 HydrophobicContact CD2-CB 4.17Å
82	S	90.9	Very high	91.9	Very high	105 Å²	105	51.2 Å²	51.2	73%	0.734	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.1	171.9	-58.1	0	0	0	0	114.4	A78 L80	A78-S82 PolarHBondContact O-N 2.9Å; A78-S82 PolarHBondContact O-OG 3.39Å; L80-S82 PolarHBondContact O-N 3.13Å
83	S	87.4	Confident	91.7	Very high	53 Å²	53	56.4 Å²	56.4	37%	0.371	35%	0.345	S	S	.	.	S	Bend	trans	-81.3	155.5	176	70	0	0	0	0	111.9	L80 L81 S85 P86	L80-S83 WeakPolarHBondContact O-CB 3.49Å; L80-S83 PolarHBondContact O-N 3.45Å; L80-S83 VanDerWaalsContact O-N 3.07Å; L80-S83 PolarHBondContact O-OG 2.91Å; L81-S83 PolarHBondContact O-N 2.83Å; S83-S85 PolarHBondContact O-N 2.88Å; S83-P86 WeakPolarHBondContact OG-CA 3.31Å
84	S	84.1	Confident	91.5	Very high	130 Å²	130	60.8 Å²	60.8	91%	0.909	38%	0.376	S	S	*	.	S	Bend	trans	-65.8	-21.6	-178.3	54	0	0	0	0	114.3
85	S	87.4	Confident	91.3	Very high	73 Å²	73	57 Å²	57	51%	0.51	36%	0.359	S	S	.	.	S	Bend	trans	-143.2	85	174.7	53.1	0	0	0	0	109.7	S83 K87	S83-S85 PolarHBondContact O-N 2.88Å; S85-K87 PolarHBondContact O-N 3.48Å
86	P	90.3	Very high	91.1	Very high	27 Å²	27	58.7 Å²	58.7	18%	0.175	37%	0.367	C	S	.	.			trans	-66.7	118.5	-175.1	27.3	-34.8	0	0	0	110.6	L81 S83 I95	L81-P86 HydrophobicContact CD2-CB 4.23Å; L81-P86 HydrophobicContact CD2-CG 4.47Å; S83-P86 WeakPolarHBondContact OG-CA 3.31Å; P86-I95 HydrophobicContact CB-CB 4.31Å; P86-I95 WeakPolarHBondContact CG-O 3.38Å; P86-I95 PolarHBondContact O-N 3.13Å
87	K	92.8	Very high	90.8	Very high	106 Å²	106	65.5 Å²	65.5	46%	0.461	40%	0.396	S	S	.	.	B	Isolated β-bridge	trans	-123.7	147.7	177.9	-67.9	-177.8	-179.3	-175.9	0	111.4	S85 T89 E93	S85-K87 PolarHBondContact O-N 3.48Å; K87-T89 PolarHBondContact O-N 3.47Å; K87-E93 CarbonylContact C-O 3.55Å; K87-E93 WeakPolarHBondContact CA-O 3.27Å
88	C	92.8	Very high	90.7	Very high	0 Å²	0	72 Å²	72	0%	0	43%	0.431	C	S	.	.			trans	-64.3	125.6	172.5	-179.3	0	0	0	0	110.1	A90 Q92 E93 I95	C88-A90 PolarHBondContact O-N 3.38Å; C88-A90 PolarHBondContact SG-N 3.1Å; C88-Q92 WeakPolarHBondContact O-CA 3.21Å; C88-Q92 PolarHBondContact O-N 3.21Å; C88-E93 PolarHBondContact N-O 3.23Å; C88-I95 HydrophobicContact CB-CD1 4.29Å; C88-I95 HydrophobicContact CB-CG1 4.29Å
89	T	91.8	Very high	90.6	Very high	56 Å²	56	73.4 Å²	73.4	34%	0.344	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.7	179.2	55.7	0	0	0	0	113.2	E54 F72 L80 K87	E54-T89 VanDerWaalsContact C-OG1 3.31Å; E54-T89 PolarHBondContact O-OG1 3.12Å; F72-T89 WeakPolarHBondContact CE1-OG1 3.33Å; L80-T89 HydrophobicContact CD2-CG2 4.02Å; K87-T89 PolarHBondContact O-N 3.47Å
90	A	90.9	Very high	90.7	Very high	46 Å²	46	72.2 Å²	72.2	38%	0.38	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-51.4	177.8	0	0	0	0	0	112.8	E54 H70 C88	E54-A90 HydrophobicContact CB-CB 4.28Å; E54-A90 HydrophobicContact CG-CB 4.02Å; H70-A90 WeakPolarHBondContact CD2-CB 3.48Å; C88-A90 PolarHBondContact O-N 3.38Å; C88-A90 PolarHBondContact SG-N 3.1Å
91	C	92.3	Very high	90.8	Very high	43 Å²	43	77.2 Å²	77.2	29%	0.291	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-0.8	-175	67.6	0	0	0	0	115.5	C68 E93	C68-C91 PolarHBondContact SG-SG 3.46Å; C91-E93 PolarHBondContact O-N 3.3Å; C91-E93 VanDerWaalsContact O-N 3.1Å; C91-E93 PolarHBondContact SG-OE1 2.95Å; C91-E93 VanDerWaalsContact SG-OE1 3.4Å
92	Q	90.9	Very high	90.9	Very high	121 Å²	121	81.7 Å²	81.7	57%	0.565	45%	0.453	S	S	*	.			trans	63.4	6.5	-179.3	-58.3	-63.3	-38	0	0	116.2	C88	C88-Q92 WeakPolarHBondContact O-CA 3.21Å; C88-Q92 PolarHBondContact O-N 3.21Å
93	E	91.9	Very high	91.1	Very high	109 Å²	109	77.4 Å²	77.4	51%	0.509	42%	0.422	S	S	.	.			trans	-65.5	147.6	172.5	-70.7	175.2	-131.2	0	0	112.2	C68 K87 C88 C91	C68-E93 HydrophobicContact CB-CB 4.43Å; C68-E93 WeakPolarHBondContact CB-OE2 3.45Å; K87-E93 CarbonylContact C-O 3.55Å; K87-E93 WeakPolarHBondContact CA-O 3.27Å; C88-E93 PolarHBondContact N-O 3.23Å; C91-E93 PolarHBondContact O-N 3.3Å; C91-E93 VanDerWaalsContact O-N 3.1Å; C91-E93 PolarHBondContact SG-OE1 2.95Å; C91-E93 VanDerWaalsContact SG-OE1 3.4Å
94	S	91.5	Very high	91.3	Very high	93 Å²	93	79 Å²	79	65%	0.65	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-67.2	130.6	177.5	-169.3	0	0	0	0	110.7
95	I	92.2	Very high	91.8	Very high	10 Å²	10	75.9 Å²	75.9	5%	0.051	40%	0.403	C	S	.	.			trans	-96.3	114.8	178.5	-58	174.4	0	0	0	108.9	T66 M77 L80 L81 P86 C88 V100	T66-I95 HydrophobicContact CG2-CD1 3.99Å; T66-I95 HydrophobicContact CG2-CG1 4.13Å; T66-I95 HydrophobicContact CG2-CG2 4.08Å; M77-I95 HydrophobicContact CE-CD1 4.5Å; M77-I95 HydrophobicContact SD-CD1 4.49Å; M77-I95 HydrophobicContact SD-CG2 4.3Å; L80-I95 HydrophobicContact CD1-CD1 4.38Å; L81-I95 HydrophobicContact CD2-CG2 3.95Å; P86-I95 HydrophobicContact CB-CB 4.31Å; P86-I95 WeakPolarHBondContact CG-O 3.38Å; P86-I95 PolarHBondContact O-N 3.13Å; C88-I95 HydrophobicContact CB-CD1 4.29Å; C88-I95 HydrophobicContact CB-CG1 4.29Å; I95-V100 HydrophobicContact CG2-CG2 3.68Å
96	V	89.7	Confident	92	Very high	72 Å²	72	72.5 Å²	72.5	44%	0.436	38%	0.38	S	S	.	.			trans	-89.2	125.4	171	-176.5	0	0	0	0	109.1	D98 K99	V96-D98 VanDerWaalsContact C-N 3.27Å; V96-D98 PolarHBondContact O-N 3.29Å; V96-K99 HydrophobicContact CB-CB 4.35Å; V96-K99 HydrophobicContact CB-CD 4.37Å; V96-K99 HydrophobicContact CB-CG 4.15Å; V96-K99 HydrophobicContact CG1-CG 4.3Å; V96-K99 PolarHBondContact O-N 3.1Å
97	K	88.8	Confident	92.2	Very high	152 Å²	152	73.1 Å²	73.1	66%	0.661	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-53.2	-41.6	-176	-179.3	176.3	175.9	-171	0	113.3	L81 K99 V100	L81-K97 HydrophobicContact CD1-CG 4.16Å; L81-K97 HydrophobicContact CD2-CB 4.17Å; K97-K99 PolarHBondContact O-N 3.29Å; K97-V100 PolarHBondContact O-N 3.39Å
98	D	90.7	Very high	92.2	Very high	142 Å²	142	76.1 Å²	76.1	76%	0.759	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-73.1	-11.4	-177.8	-59.3	-28.8	0	0	0	113.3	V96	V96-D98 VanDerWaalsContact C-N 3.27Å; V96-D98 PolarHBondContact O-N 3.29Å
99	K	90.4	Very high	92.3	Very high	81 Å²	81	80.3 Å²	80.3	35%	0.352	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-104.8	22.5	177.2	-56.1	-166	-179.3	-172	0	112.9	E67 V96 K97 F101	E67-K99 HydrophobicContact CB-CB 4.22Å; E67-K99 HydrophobicContact CB-CD 4.37Å; E67-K99 HydrophobicContact CG-CD 4.37Å; E67-K99 PolarHBondContact N-O 2.85Å; E67-K99 WeakPolarHBondContact OE1-CD 3.39Å; E67-K99 IonicContact OE1-NZ 2.82Å; E67-K99 PolarHBondContact OE1-NZ 2.77Å; E67-K99 WeakPolarHBondContact OE2-CD 3.43Å; E67-K99 WeakPolarHBondContact OE2-CE 3.47Å; E67-K99 IonicContact OE2-NZ 2.81Å; E67-K99 PolarHBondContact OE2-NZ 2.99Å; V96-K99 HydrophobicContact CB-CB 4.35Å; V96-K99 HydrophobicContact CB-CD 4.37Å; V96-K99 HydrophobicContact CB-CG 4.15Å; V96-K99 HydrophobicContact CG1-CG 4.3Å; V96-K99 PolarHBondContact O-N 3.1Å; K97-K99 PolarHBondContact O-N 3.29Å; K99-F101 WeakPolarHBondContact O-CD2 3.43Å; K99-F101 VanDerWaalsContact O-CE2 3.28Å; K99-F101 WeakPolarHBondContact O-CE2 2.98Å
100	V	94	Very high	92.4	Very high	30 Å²	30	77.8 Å²	77.8	18%	0.182	39%	0.392	C	S	.	.			trans	-105	119	174.5	179.5	0	0	0	0	109.4	K64 M77 I95 K97	K64-V100 HydrophobicContact CB-CG1 3.82Å; K64-V100 HydrophobicContact CG-CG1 4.4Å; M77-V100 HydrophobicContact CE-CG1 4.05Å; M77-V100 HydrophobicContact CE-CG2 4.35Å; M77-V100 HydrophobicContact CG-CG1 3.94Å; M77-V100 HydrophobicContact SD-CG1 4.23Å; M77-V100 HydrophobicContact SD-CG2 4.16Å; I95-V100 HydrophobicContact CG2-CG2 3.68Å; K97-V100 PolarHBondContact O-N 3.39Å
101	F	94.1	Very high	92.5	Very high	123 Å²	123	76.9 Å²	76.9	54%	0.539	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.7	-173.7	-54.3	-80.7	0	0	0	111.6	K64 Q65 K99	K64-F101 CarbonylContact C-O 3.56Å; K64-F101 VanDerWaalsContact CA-O 3.27Å; K64-F101 WeakPolarHBondContact CA-O 3.44Å; Q65-F101 PolarHBondContact N-O 3.49Å; Q65-F101 PolarHBondContact O-N 3.42Å; K99-F101 WeakPolarHBondContact O-CD2 3.43Å; K99-F101 VanDerWaalsContact O-CE2 3.28Å; K99-F101 WeakPolarHBondContact O-CE2 2.98Å
102	K	94.9	Very high	92.6	Very high	144 Å²	144	77.8 Å²	77.8	63%	0.626	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	124.6	170.1	-69	-177.6	-176.4	-178.3	0	109.1	K64 N104	K64-K102 HydrophobicContact CD-CG 4.25Å; K102-N104 PolarHBondContact O-N 3.33Å
103	D	95	Very high	92.8	Very high	15 Å²	15	73.9 Å²	73.9	8%	0.08	37%	0.374	C	S	.	.			trans	-93.6	77.4	177.4	-168.2	-17.6	0	0	0	110.5	P63 Q65 R71 C105 C106 K107	P63-D103 HydrophobicContact CB-CB 4.21Å; P63-D103 HydrophobicContact CG-CB 4.35Å; P63-D103 WeakPolarHBondContact CG-O 3.26Å; P63-D103 PolarHBondContact O-N 3.45Å; Q65-D103 HydrophobicContact CB-CB 4.36Å; R71-D103 IonicContact CZ-OD2 3.04Å; R71-D103 IonicContact NE-OD2 2.69Å; R71-D103 PolarHBondContact NE-OD2 3.27Å; R71-D103 IonicContact NH2-OD2 2.73Å; D103-C105 PolarHBondContact O-N 2.88Å; D103-C105 PolarHBondContact OD1-N 3.32Å; D103-C106 HydrophobicContact CB-CB 4.09Å; D103-C106 PolarHBondContact O-N 3.33Å; D103-C106 VanDerWaalsContact OD1-CB 3.27Å; D103-C106 WeakPolarHBondContact OD1-CB 3.43Å; D103-C106 PolarHBondContact OD1-N 2.96Å; D103-C106 WeakPolarHBondContact OD2-CB 3.42Å; D103-K107 WeakPolarHBondContact O-CB 3.39Å; D103-K107 PolarHBondContact O-N 3.31Å
104	N	91.7	Very high	93	Very high	87 Å²	87	72.7 Å²	72.7	47%	0.465	37%	0.368	S	S	.	.	H	α-helix	trans	-65.7	-24.7	179.5	-70.3	-34	0	0	0	112.8	K102 R108	K102-N104 PolarHBondContact O-N 3.33Å; N104-R108 WeakPolarHBondContact O-CG 3.38Å; N104-R108 PolarHBondContact O-N 3.18Å
105	C	93.3	Very high	93.1	Very high	64 Å²	64	68.3 Å²	68.3	43%	0.432	34%	0.337	S	S	.	.	H	α-helix	trans	-67.3	-56.6	177.1	-166.1	0	0	0	0	110	D103 K107 R108 E109	D103-C105 PolarHBondContact O-N 2.88Å; D103-C105 PolarHBondContact OD1-N 3.32Å; C105-K107 VanDerWaalsContact C-N 3.26Å; C105-K107 PolarHBondContact O-N 2.79Å; C105-R108 PolarHBondContact O-N 3.4Å; C105-R108 VanDerWaalsContact O-N 3.1Å; C105-E109 PolarHBondContact O-N 3.22Å
106	C	93.1	Very high	93.2	Very high	2 Å²	2	70.6 Å²	70.6	1%	0.014	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-38.2	176.1	-176.5	0	0	0	0	111.7	P63 D103 R108 E109 I110	P63-C106 HydrophobicContact CB-CB 4.49Å; P63-C106 HydrophobicContact CG-CB 4.11Å; D103-C106 HydrophobicContact CB-CB 4.09Å; D103-C106 PolarHBondContact O-N 3.33Å; D103-C106 VanDerWaalsContact OD1-CB 3.27Å; D103-C106 WeakPolarHBondContact OD1-CB 3.43Å; D103-C106 PolarHBondContact OD1-N 2.96Å; D103-C106 WeakPolarHBondContact OD2-CB 3.42Å; C106-R108 PolarHBondContact O-N 3.47Å; C106-E109 PolarHBondContact O-N 2.83Å; C106-I110 WeakPolarHBondContact O-CB 3.41Å; C106-I110 WeakPolarHBondContact O-CG1 3.4Å; C106-I110 PolarHBondContact O-N 2.77Å; C106-I110 VanDerWaalsContact SG-CD1 3.6Å
107	K	93.8	Very high	93.3	Very high	39 Å²	39	67.3 Å²	67.3	17%	0.17	33%	0.326	C	S	.	.	H	α-helix	trans	-55.9	-46.7	175.1	-174.5	179.7	176.2	-178.6	0	112	D24 P63 D103 C105 L111	D24-K107 IonicContact OD2-NZ 2.75Å; D24-K107 PolarHBondContact OD2-NZ 2.93Å; P63-K107 HydrophobicContact CG-CB 3.91Å; D103-K107 WeakPolarHBondContact O-CB 3.39Å; D103-K107 PolarHBondContact O-N 3.31Å; C105-K107 VanDerWaalsContact C-N 3.26Å; C105-K107 PolarHBondContact O-N 2.79Å; K107-L111 HydrophobicContact CG-CD1 4.03Å; K107-L111 VanDerWaalsContact O-CG 3.23Å; K107-L111 WeakPolarHBondContact O-CG 3.27Å; K107-L111 PolarHBondContact O-N 2.85Å; K107-L111 VanDerWaalsContact O-N 3.1Å
108	R	92.7	Very high	93.4	Very high	170 Å²	170	64.2 Å²	64.2	64%	0.642	31%	0.31	S	S	*	.	H	α-helix	trans	-65.2	-42.3	179.7	-73.4	-173.6	-61.9	-120.2	1	112	N104 C105 C106 L111 A112	N104-R108 WeakPolarHBondContact O-CG 3.38Å; N104-R108 PolarHBondContact O-N 3.18Å; C105-R108 PolarHBondContact O-N 3.4Å; C105-R108 VanDerWaalsContact O-N 3.1Å; C106-R108 PolarHBondContact O-N 3.47Å; R108-L111 PolarHBondContact O-N 2.88Å; R108-A112 PolarHBondContact O-N 3.42Å
109	E	94.4	Very high	93.4	Very high	88 Å²	88	58.1 Å²	58.1	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-44.6	178.6	-67.3	177.8	168.1	0	0	111.5	Y51 C105 C106 L111 A112 L113	Y51-E109 HydrophobicContact CE1-CB 3.83Å; Y51-E109 VanDerWaalsContact CE1-OE2 3.31Å; Y51-E109 WeakPolarHBondContact CE1-OE2 3.25Å; Y51-E109 PolarHBondContact OH-OE2 3.09Å; C105-E109 PolarHBondContact O-N 3.22Å; C106-E109 PolarHBondContact O-N 2.83Å; E109-L111 PolarHBondContact O-N 2.96Å; E109-A112 PolarHBondContact O-N 3.34Å; E109-L113 PolarHBondContact O-N 3.13Å
110	I	94.1	Very high	93.5	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-42.7	177.5	-71.8	173.7	0	0	0	111.8	Y39 Y51 V59 L60 C106 A112 L113 L130	Y39-I110 HydrophobicContact CD2-CG2 4.21Å; Y39-I110 HydrophobicContact CE2-CG2 4.07Å; Y51-I110 HydrophobicContact CD1-CD1 4.17Å; Y51-I110 HydrophobicContact CD1-CG1 3.7Å; Y51-I110 HydrophobicContact CE1-CG1 4.41Å; Y51-I110 HydrophobicContact CG-CG1 4.03Å; V59-I110 HydrophobicContact CG1-CD1 4.33Å; V59-I110 HydrophobicContact CG1-CG1 4.32Å; V59-I110 HydrophobicContact CG1-CG2 3.72Å; L60-I110 HydrophobicContact CB-CD1 3.59Å; L60-I110 HydrophobicContact CD1-CD1 4.12Å; L60-I110 HydrophobicContact CG-CD1 4.38Å; C106-I110 WeakPolarHBondContact O-CB 3.41Å; C106-I110 WeakPolarHBondContact O-CG1 3.4Å; C106-I110 PolarHBondContact O-N 2.77Å; C106-I110 VanDerWaalsContact SG-CD1 3.6Å; I110-A112 PolarHBondContact O-N 3.46Å; I110-L113 VanDerWaalsContact O-CB 3.31Å; I110-L113 WeakPolarHBondContact O-CB 3.28Å; I110-L113 WeakPolarHBondContact O-CG 3.46Å; I110-L113 PolarHBondContact O-N 3.06Å; I110-L113 VanDerWaalsContact O-N 3.13Å; I110-L130 HydrophobicContact CG2-CD2 3.81Å
111	L	93	Very high	93.1	Very high	27 Å²	27	61.6 Å²	61.6	14%	0.141	31%	0.305	C	S	.	.	H	α-helix	trans	-68	-21	179.5	-67.7	171.7	0	0	0	113.2	I31 K107 R108 E109 T129 L130 G131	I31-L111 HydrophobicContact CD1-CD1 3.67Å; I31-L111 HydrophobicContact CD1-CD2 4.35Å; I31-L111 HydrophobicContact CG2-CD2 3.67Å; K107-L111 HydrophobicContact CG-CD1 4.03Å; K107-L111 VanDerWaalsContact O-CG 3.23Å; K107-L111 WeakPolarHBondContact O-CG 3.27Å; K107-L111 PolarHBondContact O-N 2.85Å; K107-L111 VanDerWaalsContact O-N 3.1Å; R108-L111 PolarHBondContact O-N 2.88Å; E109-L111 PolarHBondContact O-N 2.96Å; L111-T129 WeakPolarHBondContact O-CB 3.47Å; L111-L130 PolarHBondContact O-N 3.37Å; L111-G131 PolarHBondContact O-N 3.1Å
112	A	93.9	Very high	92.8	Very high	62 Å²	62	60.9 Å²	60.9	51%	0.512	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.4	174.9	0	0	0	0	0	113.5	R108 E109 I110	R108-A112 PolarHBondContact O-N 3.42Å; E109-A112 PolarHBondContact O-N 3.34Å; I110-A112 PolarHBondContact O-N 3.46Å
113	L	94.9	Very high	92.5	Very high	39 Å²	39	56.1 Å²	56.1	20%	0.204	29%	0.291	C	S	.	.	S	Bend	trans	-65	139.4	178	-64	175.3	0	0	0	111.3	F43 V47 Y51 V59 E109 I110 T129 L130	F43-L113 HydrophobicContact CD1-CB 3.92Å; F43-L113 HydrophobicContact CD1-CD1 4.16Å; F43-L113 HydrophobicContact CE1-CB 3.83Å; F43-L113 HydrophobicContact CE1-CD1 3.79Å; F43-L113 HydrophobicContact CE1-CG 4.48Å; V47-L113 HydrophobicContact CG1-CD1 4.09Å; V47-L113 HydrophobicContact CG2-CD1 4.45Å; Y51-L113 HydrophobicContact CD2-CD1 4.4Å; Y51-L113 HydrophobicContact CE2-CD2 4.49Å; V59-L113 HydrophobicContact CG1-CD1 4.35Å; E109-L113 PolarHBondContact O-N 3.13Å; I110-L113 VanDerWaalsContact O-CB 3.31Å; I110-L113 WeakPolarHBondContact O-CB 3.28Å; I110-L113 WeakPolarHBondContact O-CG 3.46Å; I110-L113 PolarHBondContact O-N 3.06Å; I110-L113 VanDerWaalsContact O-N 3.13Å; L113-T129 CarbonylContact O-C 3.55Å; L113-T129 WeakPolarHBondContact O-CA 3.49Å; L113-L130 PolarHBondContact O-N 3.08Å
114	Q	95.9	Very high	92.4	Very high	85 Å²	85	55.7 Å²	55.7	40%	0.397	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.1	179.2	-67.6	-70.2	-25.8	0	0	111.1	V44 L128	V44-Q114 HydrophobicContact CB-CB 4.07Å; V44-Q114 HydrophobicContact CG2-CB 3.97Å; V44-Q114 PolarHBondContact N-O 3Å; Q114-L128 WeakPolarHBondContact CA-O 3.47Å; Q114-L128 VanDerWaalsContact OE1-C 3.28Å; Q114-L128 PolarHBondContact OE1-O 2.9Å
115	I	95	Very high	92.5	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.9	178.5	61.2	162.3	0	0	0	110.7	E41 K42 F43 Q127 L128 L130 L133	E41-I115 HydrophobicContact CB-CB 4.42Å; E41-I115 HydrophobicContact CB-CD1 4.05Å; E41-I115 HydrophobicContact CB-CG2 4.15Å; E41-I115 HydrophobicContact CG-CD1 4.1Å; K42-I115 WeakPolarHBondContact O-CA 3.43Å; F43-I115 HydrophobicContact CD1-CG2 3.49Å; F43-I115 VanDerWaalsContact CD1-CG2 3.49Å; F43-I115 HydrophobicContact CE1-CG2 3.62Å; F43-I115 HydrophobicContact CG-CG2 3.98Å; F43-I115 HydrophobicContact CZ-CG2 4.19Å; I115-Q127 WeakPolarHBondContact O-CA 3.02Å; I115-L128 HydrophobicContact CG1-CG 4.45Å; I115-L128 VanDerWaalsContact CG1-O 3.31Å; I115-L128 WeakPolarHBondContact CG1-O 3.42Å; I115-L128 PolarHBondContact N-O 2.92Å; I115-L128 PolarHBondContact O-N 3.17Å; I115-L130 HydrophobicContact CD1-CD1 3.87Å; I115-L130 HydrophobicContact CG2-CB 4.37Å; I115-L130 HydrophobicContact CG2-CD1 4.35Å; I115-L133 HydrophobicContact CD1-CB 4.08Å; I115-L133 HydrophobicContact CD1-CD1 3.93Å; I115-L133 HydrophobicContact CD1-CD2 3.73Å; I115-L133 HydrophobicContact CD1-CG 4.11Å
116	Y	94.2	Very high	92.5	Very high	59 Å²	59	58.1 Å²	58.1	23%	0.231	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	145.3	164	-65.1	-81.9	0	0	0	110	K42 V44 E120 Q127	K42-Y116 HydrophobicContact CB-CD2 4.44Å; K42-Y116 HydrophobicContact CD-CD2 3.83Å; K42-Y116 HydrophobicContact CD-CG 4.37Å; K42-Y116 HydrophobicContact CG-CD2 3.95Å; K42-Y116 PolarHBondContact O-N 2.97Å; V44-Y116 HydrophobicContact CB-CE2 4.19Å; V44-Y116 HydrophobicContact CG1-CE2 4.46Å; V44-Y116 HydrophobicContact CG2-CD2 3.98Å; V44-Y116 HydrophobicContact CG2-CE1 4.43Å; V44-Y116 HydrophobicContact CG2-CE2 3.79Å; V44-Y116 HydrophobicContact CG2-CG 4.39Å; Y116-E120 WeakPolarHBondContact CD1-OE1 3.42Å; Y116-Q127 HydrophobicContact CD1-CG 3.84Å; Y116-Q127 HydrophobicContact CE1-CG 3.79Å
117	C	92.4	Very high	92.5	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.014	33%	0.327	C	S	.	.			trans	-55.4	140.4	172.8	-178.7	0	0	0	0	111.4	N119 E120 C124 E126 L128 H136	C117-N119 PolarHBondContact O-N 3.33Å; C117-N119 VanDerWaalsContact O-N 3.11Å; C117-N119 PolarHBondContact SG-N 3.36Å; C117-E120 VanDerWaalsContact O-CB 3.22Å; C117-E120 WeakPolarHBondContact O-CB 3.47Å; C117-E120 PolarHBondContact O-N 3.19Å; C117-C124 HydrophobicContact CB-CB 4.1Å; C117-E126 PolarHBondContact N-O 2.87Å; C117-E126 VanDerWaalsContact N-O 3.1Å; C117-L128 HydrophobicContact CB-CD2 4.13Å; C117-H136 VanDerWaalsContact SG-CD2 3.57Å; C117-H136 PolarHBondContact SG-NE2 3.3Å
118	R	89.9	Confident	92.6	Very high	88 Å²	88	61.7 Å²	61.7	33%	0.332	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-59.9	-25.1	178.1	-167.2	171.4	-171.6	177.8	5.7	113.6	N16 E120	N16-R118 PolarHBondContact ND2-NH2 2.97Å; N16-R118 PolarHBondContact OD1-NH2 3.26Å; R118-E120 VanDerWaalsContact C-N 3.25Å; R118-E120 PolarHBondContact O-N 3.36Å
119	N	91.6	Very high	92.6	Very high	13 Å²	13	55 Å²	55	7%	0.07	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-87.5	17.9	175.2	-64.8	-35.9	0	0	0	112.9	C117 S121 R122 G123 C124 C141 F143 E144	C117-N119 PolarHBondContact O-N 3.33Å; C117-N119 VanDerWaalsContact O-N 3.11Å; C117-N119 PolarHBondContact SG-N 3.36Å; N119-S121 PolarHBondContact O-N 3.22Å; N119-R122 HydrophobicContact CB-CB 4.33Å; N119-R122 CarbonylContact O-C 3.58Å; N119-R122 WeakPolarHBondContact O-CA 3.5Å; N119-R122 WeakPolarHBondContact O-CB 3.42Å; N119-R122 PolarHBondContact O-N 2.99Å; N119-G123 PolarHBondContact O-N 3.03Å; N119-G123 VanDerWaalsContact O-N 3.16Å; N119-C124 HydrophobicContact CB-CB 3.97Å; N119-C124 WeakPolarHBondContact O-CB 3.35Å; N119-C124 PolarHBondContact O-N 3.47Å; N119-C141 PolarHBondContact ND2-SG 3.3Å; N119-F143 HydrophobicContact CB-CB 4.04Å; N119-E144 PolarHBondContact ND2-OE2 3.41Å
120	E	90.6	Very high	92.6	Very high	71 Å²	71	50.9 Å²	50.9	33%	0.332	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-52.7	-44	172.5	-176.4	-168.3	-134.8	0	0	111.4	K42 Y116 C117 R118 R122 G123 C124	K42-E120 WeakPolarHBondContact CD-OE2 3.29Å; K42-E120 IonicContact NZ-OE1 2.71Å; K42-E120 PolarHBondContact NZ-OE1 3.43Å; K42-E120 IonicContact NZ-OE2 3.96Å; K42-E120 PolarHBondContact NZ-OE2 3.03Å; Y116-E120 WeakPolarHBondContact CD1-OE1 3.42Å; C117-E120 VanDerWaalsContact O-CB 3.22Å; C117-E120 WeakPolarHBondContact O-CB 3.47Å; C117-E120 PolarHBondContact O-N 3.19Å; R118-E120 VanDerWaalsContact C-N 3.25Å; R118-E120 PolarHBondContact O-N 3.36Å; E120-R122 PolarHBondContact O-N 3.22Å; E120-R122 VanDerWaalsContact O-N 3.13Å; E120-G123 PolarHBondContact O-N 3.17Å; E120-C124 VanDerWaalsContact CA-O 3.26Å; E120-C124 WeakPolarHBondContact CA-O 3.42Å
121	S	87.3	Confident	92.4	Very high	113 Å²	113	51.3 Å²	51.3	79%	0.79	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-63.2	-18.6	176	59.5	0	0	0	0	114.1	N119	N119-S121 PolarHBondContact O-N 3.22Å
122	R	87.2	Confident	92.3	Very high	108 Å²	108	55.2 Å²	55.2	41%	0.408	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-100.7	-1	178	-64.4	177.9	169.4	-168.6	-11	112.8	N119 E120 F143 E145	N119-R122 HydrophobicContact CB-CB 4.33Å; N119-R122 CarbonylContact O-C 3.58Å; N119-R122 WeakPolarHBondContact O-CA 3.5Å; N119-R122 WeakPolarHBondContact O-CB 3.42Å; N119-R122 PolarHBondContact O-N 2.99Å; E120-R122 PolarHBondContact O-N 3.22Å; E120-R122 VanDerWaalsContact O-N 3.13Å; R122-F143 HydrophobicContact CB-CB 4.33Å; R122-F143 WeakPolarHBondContact O-CD1 3.22Å; R122-F143 WeakPolarHBondContact O-CE1 3.45Å; R122-E145 VanDerWaalsContact CZ-CD 3.43Å; R122-E145 IonicContact CZ-OE1 3.72Å; R122-E145 IonicContact CZ-OE2 3.69Å; R122-E145 IonicContact NH1-OE1 3.93Å; R122-E145 IonicContact NH1-OE2 3.59Å; R122-E145 PolarHBondContact NH1-OE2 2.98Å; R122-E145 IonicContact NH2-OE1 2.7Å; R122-E145 PolarHBondContact NH2-OE1 3.25Å; R122-E145 IonicContact NH2-OE2 2.77Å; R122-E145 PolarHBondContact NH2-OE2 3.31Å
123	G	88.7	Confident	92.2	Very high	44 Å²	44	52.3 Å²	52.3	45%	0.454	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.4	5.2	175.8	0	0	0	0	0	115.7	N119 E120 A125 F143	N119-G123 PolarHBondContact O-N 3.03Å; N119-G123 VanDerWaalsContact O-N 3.16Å; E120-G123 PolarHBondContact O-N 3.17Å; G123-A125 PolarHBondContact O-N 3.34Å; G123-F143 WeakPolarHBondContact O-CE2 3.14Å; G123-F143 VanDerWaalsContact O-CZ 3.29Å; G123-F143 WeakPolarHBondContact O-CZ 3.45Å
124	C	93.5	Very high	91.8	Very high	6 Å²	6	52 Å²	52	4%	0.041	28%	0.279	C	S	.	.			trans	-79.8	110.4	174.6	-170.4	0	0	0	0	111.4	C117 N119 E120 H136 F143	C117-C124 HydrophobicContact CB-CB 4.1Å; N119-C124 HydrophobicContact CB-CB 3.97Å; N119-C124 WeakPolarHBondContact O-CB 3.35Å; N119-C124 PolarHBondContact O-N 3.47Å; E120-C124 VanDerWaalsContact CA-O 3.26Å; E120-C124 WeakPolarHBondContact CA-O 3.42Å; C124-H136 PolarHBondContact SG-NE2 2.97Å; C124-F143 HydrophobicContact CB-CB 4.25Å; C124-F143 HydrophobicContact CB-CD2 3.67Å; C124-F143 HydrophobicContact CB-CE2 4.37Å; C124-F143 HydrophobicContact CB-CG 4.21Å
125	A	92.3	Very high	91.5	Very high	88 Å²	88	50 Å²	50	73%	0.727	27%	0.272	S	S	*	.			trans	-89.7	3.7	-178.6	0	0	0	0	0	114.6	G123	G123-A125 PolarHBondContact O-N 3.34Å
126	E	93	Very high	91.3	Very high	114 Å²	114	50.9 Å²	50.9	53%	0.533	28%	0.277	S	S	.	.			trans	-68.6	137	-174.7	-72.3	-64.6	155.1	0	0	112.5	C117 L128	C117-E126 PolarHBondContact N-O 2.87Å; C117-E126 VanDerWaalsContact N-O 3.1Å; E126-L128 HydrophobicContact CB-CD2 4.32Å
127	Q	94.9	Very high	91.1	Very high	98 Å²	98	48.9 Å²	48.9	46%	0.458	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133	169.4	-65.2	-179.7	26.4	0	0	108.9	V44 I115 Y116	V44-Q127 HydrophobicContact CG2-CB 4.46Å; V44-Q127 HydrophobicContact CG2-CG 4.09Å; I115-Q127 WeakPolarHBondContact O-CA 3.02Å; Y116-Q127 HydrophobicContact CD1-CG 3.84Å; Y116-Q127 HydrophobicContact CE1-CG 3.79Å
128	L	94.1	Very high	90.9	Very high	19 Å²	19	55.7 Å²	55.7	10%	0.099	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	165.1	-174.5	55.7	150.2	0	0	0	111.1	Q114 I115 C117 E126 H132 L133 H136	Q114-L128 WeakPolarHBondContact CA-O 3.47Å; Q114-L128 VanDerWaalsContact OE1-C 3.28Å; Q114-L128 PolarHBondContact OE1-O 2.9Å; I115-L128 HydrophobicContact CG1-CG 4.45Å; I115-L128 VanDerWaalsContact CG1-O 3.31Å; I115-L128 WeakPolarHBondContact CG1-O 3.42Å; I115-L128 PolarHBondContact N-O 2.92Å; I115-L128 PolarHBondContact O-N 3.17Å; C117-L128 HydrophobicContact CB-CD2 4.13Å; E126-L128 HydrophobicContact CB-CD2 4.32Å; L128-H132 HydrophobicContact CD1-CB 4.47Å; L128-L133 VanDerWaalsContact CD1-CA 3.44Å; L128-L133 HydrophobicContact CD1-CB 4.23Å; L128-L133 HydrophobicContact CD1-CD1 4.11Å; L128-H136 HydrophobicContact CD1-CB 3.58Å
129	T	94.6	Very high	90.7	Very high	30 Å²	30	55.9 Å²	55.9	18%	0.184	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	146.2	172.7	63.6	0	0	0	0	110.5	L111 L113 G131 H132 L133	L111-T129 WeakPolarHBondContact O-CB 3.47Å; L113-T129 CarbonylContact O-C 3.55Å; L113-T129 WeakPolarHBondContact O-CA 3.49Å; T129-G131 PolarHBondContact O-N 3.04Å; T129-H132 PolarHBondContact O-N 3.45Å; T129-H132 PolarHBondContact OG1-ND1 3.01Å; T129-L133 PolarHBondContact O-N 3.46Å
130	L	92.9	Very high	90.6	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-54.1	-37	177.9	-179.1	64.1	0	0	0	112.3	Y39 E41 F43 I110 L111 L113 I115 H132 L133	Y39-L130 HydrophobicContact CD1-CD1 3.75Å; Y39-L130 HydrophobicContact CD1-CD2 3.92Å; Y39-L130 HydrophobicContact CD1-CG 4.24Å; Y39-L130 HydrophobicContact CD2-CD2 3.66Å; Y39-L130 HydrophobicContact CE1-CD1 4.01Å; Y39-L130 HydrophobicContact CE1-CD2 4Å; Y39-L130 HydrophobicContact CE1-CG 4.15Å; Y39-L130 HydrophobicContact CE2-CD2 3.74Å; Y39-L130 HydrophobicContact CG-CD1 4.22Å; Y39-L130 HydrophobicContact CG-CD2 3.74Å; E41-L130 HydrophobicContact CB-CD1 4.44Å; E41-L130 HydrophobicContact CG-CD1 4.03Å; F43-L130 HydrophobicContact CE1-CD2 4.28Å; F43-L130 HydrophobicContact CZ-CD2 4.24Å; I110-L130 HydrophobicContact CG2-CD2 3.81Å; L111-L130 PolarHBondContact O-N 3.37Å; L113-L130 PolarHBondContact O-N 3.08Å; I115-L130 HydrophobicContact CD1-CD1 3.87Å; I115-L130 HydrophobicContact CG2-CB 4.37Å; I115-L130 HydrophobicContact CG2-CD1 4.35Å; L130-H132 VanDerWaalsContact C-N 3.3Å; L130-H132 PolarHBondContact O-N 3.16Å; L130-L133 WeakPolarHBondContact O-CB 3.48Å; L130-L133 PolarHBondContact O-N 3.34Å
131	G	90.5	Very high	90.8	Very high	11 Å²	11	56.2 Å²	56.2	11%	0.113	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-64	-28.2	175.8	0	0	0	0	0	114.9	L111 T129	L111-G131 PolarHBondContact O-N 3.1Å; T129-G131 PolarHBondContact O-N 3.04Å
132	H	91.3	Very high	91	Very high	110 Å²	110	56.2 Å²	56.2	51%	0.509	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-92.7	-1.1	179.6	-69.7	132.3	0	0	0	113.9	L128 T129 L130 L134 V135 H136	L128-H132 HydrophobicContact CD1-CB 4.47Å; T129-H132 PolarHBondContact O-N 3.45Å; T129-H132 PolarHBondContact OG1-ND1 3.01Å; L130-H132 VanDerWaalsContact C-N 3.3Å; L130-H132 PolarHBondContact O-N 3.16Å; H132-L134 VanDerWaalsContact C-N 3.32Å; H132-L134 PolarHBondContact O-N 3.47Å; H132-V135 PolarHBondContact O-N 2.92Å; H132-V135 VanDerWaalsContact O-N 3.13Å; H132-H136 PolarHBondContact O-N 3.17Å
133	L	90.3	Very high	91.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.8	-46.3	-176.6	-177.6	60.3	0	0	0	113.2	F32 E41 I115 L128 T129 L130 V135 H136 L137	F32-L133 HydrophobicContact CB-CD2 4.33Å; F32-L133 HydrophobicContact CD1-CD2 3.93Å; F32-L133 HydrophobicContact CE1-CD2 4.46Å; F32-L133 HydrophobicContact CG-CD2 4.12Å; E41-L133 HydrophobicContact CG-CD2 3.87Å; I115-L133 HydrophobicContact CD1-CB 4.08Å; I115-L133 HydrophobicContact CD1-CD1 3.93Å; I115-L133 HydrophobicContact CD1-CD2 3.73Å; I115-L133 HydrophobicContact CD1-CG 4.11Å; L128-L133 VanDerWaalsContact CD1-CA 3.44Å; L128-L133 HydrophobicContact CD1-CB 4.23Å; L128-L133 HydrophobicContact CD1-CD1 4.11Å; T129-L133 PolarHBondContact O-N 3.46Å; L130-L133 WeakPolarHBondContact O-CB 3.48Å; L130-L133 PolarHBondContact O-N 3.34Å; L133-V135 VanDerWaalsContact C-N 3.32Å; L133-V135 PolarHBondContact O-N 3.27Å; L133-H136 PolarHBondContact O-N 2.95Å; L133-L137 HydrophobicContact CD1-CD1 4.03Å; L133-L137 HydrophobicContact CD1-CD2 4.46Å; L133-L137 HydrophobicContact CD1-CG 4.02Å; L133-L137 HydrophobicContact CG-CD1 4.01Å; L133-L137 HydrophobicContact CG-CG 4.37Å; L133-L137 WeakPolarHBondContact O-CG 3.47Å; L133-L137 PolarHBondContact O-N 3.19Å
134	L	88.1	Confident	91.5	Very high	32 Å²	32	53.6 Å²	53.6	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-38.6	-178	-169.8	68.9	0	0	0	112	P30 F32 H132 K138	P30-L134 HydrophobicContact CB-CD2 3.62Å; P30-L134 HydrophobicContact CG-CD2 4.01Å; P30-L134 WeakPolarHBondContact O-CD2 3.42Å; F32-L134 HydrophobicContact CB-CB 4.21Å; F32-L134 HydrophobicContact CD2-CD1 4.49Å; H132-L134 VanDerWaalsContact C-N 3.32Å; H132-L134 PolarHBondContact O-N 3.47Å; L134-K138 WeakPolarHBondContact O-CB 3.5Å; L134-K138 PolarHBondContact O-N 3.22Å
135	V	89.1	Confident	91.3	Very high	43 Å²	43	57 Å²	57	26%	0.261	29%	0.293	S	S	.	.	H	α-helix	trans	-64.9	-48.4	178.5	-179.7	0	0	0	0	109.7	T29 H132 L133 K138 N139	T29-V135 HydrophobicContact CG2-CG2 3.78Å; H132-V135 PolarHBondContact O-N 2.92Å; H132-V135 VanDerWaalsContact O-N 3.13Å; L133-V135 VanDerWaalsContact C-N 3.32Å; L133-V135 PolarHBondContact O-N 3.27Å; V135-K138 PolarHBondContact O-N 3.49Å; V135-N139 WeakPolarHBondContact O-CB 3.42Å; V135-N139 PolarHBondContact O-N 2.77Å
136	H	91.7	Very high	91.2	Very high	19 Å²	19	55 Å²	55	9%	0.088	27%	0.271	C	S	.	.	I	π-helix	trans	-57.8	-52.2	176.4	172	75.4	0	0	0	111.7	C117 C124 L128 H132 L133 K138 N139 D140 C141	C117-H136 VanDerWaalsContact SG-CD2 3.57Å; C117-H136 PolarHBondContact SG-NE2 3.3Å; C124-H136 PolarHBondContact SG-NE2 2.97Å; L128-H136 HydrophobicContact CD1-CB 3.58Å; H132-H136 PolarHBondContact O-N 3.17Å; L133-H136 PolarHBondContact O-N 2.95Å; H136-K138 VanDerWaalsContact C-N 3.29Å; H136-K138 PolarHBondContact O-N 3.41Å; H136-N139 PolarHBondContact O-N 2.94Å; H136-D140 CarbonylContact O-C 3.33Å; H136-D140 PolarHBondContact O-N 3.4Å; H136-C141 WeakPolarHBondContact NE2-CB 3.29Å; H136-C141 WeakPolarHBondContact O-CB 3.23Å; H136-C141 PolarHBondContact O-N 3.5Å
137	L	89.8	Confident	91.2	Very high	17 Å²	17	53.8 Å²	53.8	9%	0.089	27%	0.272	C	S	.	.	I	π-helix	trans	-59.4	-41.4	179.6	-66.2	177.4	0	0	0	111.5	L133 C141 R159	L133-L137 HydrophobicContact CD1-CD1 4.03Å; L133-L137 HydrophobicContact CD1-CD2 4.46Å; L133-L137 HydrophobicContact CD1-CG 4.02Å; L133-L137 HydrophobicContact CG-CD1 4.01Å; L133-L137 HydrophobicContact CG-CG 4.37Å; L133-L137 WeakPolarHBondContact O-CG 3.47Å; L133-L137 PolarHBondContact O-N 3.19Å; L137-C141 HydrophobicContact CD2-CB 4.31Å; L137-R159 PolarHBondContact O-NH1 3.04Å; L137-R159 PolarHBondContact O-NH2 3.38Å
138	K	87.2	Confident	91	Very high	145 Å²	145	49.6 Å²	49.6	63%	0.63	25%	0.254	S	S	*	.	I	π-helix	trans	-73.2	-38.7	-177.2	-169.1	179.9	178	-178.2	0	113.8	L134 V135 H136 R159	L134-K138 WeakPolarHBondContact O-CB 3.5Å; L134-K138 PolarHBondContact O-N 3.22Å; V135-K138 PolarHBondContact O-N 3.49Å; H136-K138 VanDerWaalsContact C-N 3.29Å; H136-K138 PolarHBondContact O-N 3.41Å; K138-R159 PolarHBondContact O-NH1 2.87Å; K138-R159 PolarHBondContact O-NH2 3.25Å
139	N	86.6	Confident	90.7	Very high	93 Å²	93	53.5 Å²	53.5	50%	0.497	28%	0.278	S	S	.	.	I	π-helix	trans	-113.8	-38.9	-167.3	-59.9	-21.7	0	0	0	113	V135 H136 R159	V135-N139 WeakPolarHBondContact O-CB 3.42Å; V135-N139 PolarHBondContact O-N 2.77Å; H136-N139 PolarHBondContact O-N 2.94Å; N139-R159 PolarHBondContact O-NH1 3.11Å
140	D	89.6	Confident	90.3	Very high	90 Å²	90	56.2 Å²	56.2	48%	0.481	29%	0.285	S	S	.	.	I	π-helix	trans	-113.1	-28.3	-162.7	-47.5	-46.4	0	0	0	114	H136 H142 R159	H136-D140 CarbonylContact O-C 3.33Å; H136-D140 PolarHBondContact O-N 3.4Å; D140-H142 PolarHBondContact O-N 3.3Å; D140-H142 PolarHBondContact O-ND1 3.4Å; D140-R159 VanDerWaalsContact N-NH1 3.14Å
141	C	93.4	Very high	89.8	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.007	33%	0.325	C	S	.	.			trans	-68.1	105.5	-176.3	-166.4	0	0	0	0	112	N119 H136 L137 F143 E144 R159	N119-C141 PolarHBondContact ND2-SG 3.3Å; H136-C141 WeakPolarHBondContact NE2-CB 3.29Å; H136-C141 WeakPolarHBondContact O-CB 3.23Å; H136-C141 PolarHBondContact O-N 3.5Å; L137-C141 HydrophobicContact CD2-CB 4.31Å; C141-F143 PolarHBondContact O-N 3.39Å; C141-E144 HydrophobicContact CB-CB 4.12Å; C141-E144 PolarHBondContact O-N 3Å; C141-R159 VanDerWaalsContact N-NH1 3.12Å; C141-R159 PolarHBondContact O-NH1 3.4Å; C141-R159 VanDerWaalsContact O-NH1 3.09Å
142	H	92.4	Very high	89.4	Confident	113 Å²	113	65.8 Å²	65.8	52%	0.523	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-18.9	177.8	-73.1	71.2	0	0	0	113.5	D140 R159 K160	D140-H142 PolarHBondContact O-N 3.3Å; D140-H142 PolarHBondContact O-ND1 3.4Å; H142-R159 PolarHBondContact O-N 2.71Å; H142-K160 HydrophobicContact CB-CB 4.23Å; H142-K160 PolarHBondContact O-N 2.98Å; H142-K160 VanDerWaalsContact O-N 3.11Å
143	F	93.6	Very high	89.3	Confident	47 Å²	47	61.1 Å²	61.1	21%	0.206	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	6.9	-177.2	-57.6	-90.3	0	0	0	113	N119 R122 G123 C124 C141 L158 K160	N119-F143 HydrophobicContact CB-CB 4.04Å; R122-F143 HydrophobicContact CB-CB 4.33Å; R122-F143 WeakPolarHBondContact O-CD1 3.22Å; R122-F143 WeakPolarHBondContact O-CE1 3.45Å; G123-F143 WeakPolarHBondContact O-CE2 3.14Å; G123-F143 VanDerWaalsContact O-CZ 3.29Å; G123-F143 WeakPolarHBondContact O-CZ 3.45Å; C124-F143 HydrophobicContact CB-CB 4.25Å; C124-F143 HydrophobicContact CB-CD2 3.67Å; C124-F143 HydrophobicContact CB-CE2 4.37Å; C124-F143 HydrophobicContact CB-CG 4.21Å; C141-F143 PolarHBondContact O-N 3.39Å; F143-L158 VanDerWaalsContact O-CD2 3.31Å; F143-L158 WeakPolarHBondContact O-CD2 3.38Å; F143-K160 HydrophobicContact CE1-CD 4.5Å
144	E	92.1	Very high	89.2	Confident	49 Å²	49	70.7 Å²	70.7	23%	0.229	37%	0.369	C	S	.	.			trans	-72.2	133.4	171	-173.5	62.8	-162.9	0	0	110	N119 C141 L146 L158 R159	N119-E144 PolarHBondContact ND2-OE2 3.41Å; C141-E144 HydrophobicContact CB-CB 4.12Å; C141-E144 PolarHBondContact O-N 3Å; E144-L146 HydrophobicContact CG-CD2 4.2Å; E144-L158 CarbonylContact O-C 3.55Å; E144-L158 WeakPolarHBondContact O-CA 3.42Å; E144-R159 PolarHBondContact O-N 2.92Å
145	E	90.6	Very high	89.3	Confident	77 Å²	77	73.8 Å²	73.8	36%	0.36	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.7	175.3	-87.6	176.4	161.9	0	0	110.4	R122 K156 L158	R122-E145 VanDerWaalsContact CZ-CD 3.43Å; R122-E145 IonicContact CZ-OE1 3.72Å; R122-E145 IonicContact CZ-OE2 3.69Å; R122-E145 IonicContact NH1-OE1 3.93Å; R122-E145 IonicContact NH1-OE2 3.59Å; R122-E145 PolarHBondContact NH1-OE2 2.98Å; R122-E145 IonicContact NH2-OE1 2.7Å; R122-E145 PolarHBondContact NH2-OE1 3.25Å; R122-E145 IonicContact NH2-OE2 2.77Å; R122-E145 PolarHBondContact NH2-OE2 3.31Å; E145-K156 HydrophobicContact CB-CB 4.49Å; E145-L158 HydrophobicContact CG-CD2 3.87Å
146	L	90.3	Very high	89.3	Confident	48 Å²	48	78.7 Å²	78.7	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.1	177	-61.6	179.5	0	0	0	110.1	E144 K156 V157 R159 L162	E144-L146 HydrophobicContact CG-CD2 4.2Å; L146-K156 WeakPolarHBondContact O-CA 3.33Å; L146-V157 PolarHBondContact N-O 3.36Å; L146-V157 PolarHBondContact O-N 3.45Å; L146-R159 HydrophobicContact CD1-CB 4.08Å; L146-R159 HydrophobicContact CD1-CG 4.22Å; L146-L162 HydrophobicContact CB-CD2 4.4Å; L146-L162 HydrophobicContact CD1-CD2 4.21Å
147	P	91.5	Very high	89.4	Confident	87 Å²	87	79 Å²	79	57%	0.565	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	147.7	168.6	29.3	-33.7	0	0	0	109.8
148	C	90.8	Very high	89.5	Confident	10 Å²	10	79.9 Å²	79.9	7%	0.068	41%	0.408	C	S	.	.			trans	-57.6	141.5	171.1	-176.4	0	0	0	0	111	R150 C153 E155 H165	C148-R150 PolarHBondContact O-N 2.96Å; C148-C153 HydrophobicContact CB-CB 3.72Å; C148-C153 VanDerWaalsContact CB-SG 3.58Å; C148-E155 PolarHBondContact N-O 2.6Å; C148-H165 VanDerWaalsContact SG-CD2 3.52Å; C148-H165 PolarHBondContact SG-NE2 3.28Å
149	V	88.6	Confident	89.7	Confident	101 Å²	101	75.3 Å²	75.3	61%	0.612	39%	0.387	S	S	*	.	S	Bend	trans	-68.8	-13.8	179.3	-59.6	0	0	0	0	113.4	V166	V149-V166 HydrophobicContact CG2-CG1 4.22Å; V149-V166 HydrophobicContact CG2-CG2 3.75Å
150	R	86.3	Confident	89.9	Confident	88 Å²	88	75.6 Å²	75.6	33%	0.332	38%	0.384	S	S	.	.	S	Bend	trans	-85	120.9	177.7	-58.2	-59.8	-174.1	-157.6	5	108.9	C148 D152 C153	C148-R150 PolarHBondContact O-N 2.96Å; R150-D152 PolarHBondContact O-N 3.21Å; R150-D152 VanDerWaalsContact O-N 3.11Å; R150-C153 HydrophobicContact CB-CB 4.04Å; R150-C153 WeakPolarHBondContact O-CB 3.45Å; R150-C153 PolarHBondContact O-N 2.91Å
151	A	81.4	Confident	90.1	Very high	102 Å²	102	74.6 Å²	74.6	84%	0.843	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-36.3	-172.5	0	0	0	0	0	114.3
152	D	83.9	Confident	89.9	Confident	109 Å²	109	75.9 Å²	75.9	58%	0.583	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-8.7	-178.4	-58.7	-59.6	0	0	0	113.7	R150 Y172	R150-D152 PolarHBondContact O-N 3.21Å; R150-D152 VanDerWaalsContact O-N 3.11Å; D152-Y172 HydrophobicContact CB-CD1 3.49Å; D152-Y172 VanDerWaalsContact CB-CD1 3.49Å; D152-Y172 HydrophobicContact CB-CD2 4.47Å; D152-Y172 HydrophobicContact CB-CE1 3.36Å; D152-Y172 HydrophobicContact CB-CE2 4.38Å; D152-Y172 HydrophobicContact CB-CG 4.05Å; D152-Y172 VanDerWaalsContact O-CE2 3.29Å; D152-Y172 WeakPolarHBondContact O-CE2 3.49Å; D152-Y172 PolarHBondContact O-OH 3.48Å
153	C	88.7	Confident	89.7	Confident	12 Å²	12	79 Å²	79	8%	0.081	39%	0.392	C	S	.	.			trans	-89.7	113.4	177.8	-172.2	0	0	0	0	110.7	C148 R150 E155 Y172	C148-C153 HydrophobicContact CB-CB 3.72Å; C148-C153 VanDerWaalsContact CB-SG 3.58Å; R150-C153 HydrophobicContact CB-CB 4.04Å; R150-C153 WeakPolarHBondContact O-CB 3.45Å; R150-C153 PolarHBondContact O-N 2.91Å; C153-E155 VanDerWaalsContact C-N 3.33Å; C153-Y172 HydrophobicContact CB-CD2 3.78Å; C153-Y172 HydrophobicContact CB-CE2 4.34Å
154	K	88	Confident	89.6	Confident	202 Å²	202	80.3 Å²	80.3	88%	0.878	40%	0.401	S	S	*	.			trans	-88.5	4.6	179.4	-63	-178.7	-178.6	177.9	0	114.1
155	E	88.9	Confident	89.6	Confident	96 Å²	96	78.6 Å²	78.6	45%	0.449	39%	0.394	S	S	.	.			trans	-74.6	140.7	-179.7	-65.9	-176.3	-171.7	0	0	110.9	C148 C153 H165	C148-E155 PolarHBondContact N-O 2.6Å; C153-E155 VanDerWaalsContact C-N 3.33Å; E155-H165 IonicContact OE2-CE1 2.68Å; E155-H165 PolarHBondContact OE2-CE1 3.33Å; E155-H165 IonicContact OE2-ND1 3.3Å
156	K	91.1	Very high	89.5	Confident	147 Å²	147	76.1 Å²	76.1	64%	0.639	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	130.5	168.5	-63	-175.5	-179	-178.8	0	107.9	E145 L146	E145-K156 HydrophobicContact CB-CB 4.49Å; L146-K156 WeakPolarHBondContact O-CA 3.33Å
157	V	92	Very high	89.3	Confident	24 Å²	24	78.8 Å²	78.8	15%	0.145	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	152.1	-176.5	-65.2	0	0	0	0	109.7	L146 L162 H165	L146-V157 PolarHBondContact N-O 3.36Å; L146-V157 PolarHBondContact O-N 3.45Å; V157-L162 HydrophobicContact CG2-CB 3.94Å; V157-L162 HydrophobicContact CG2-CD1 3.33Å; V157-L162 HydrophobicContact CG2-CG 4.22Å; V157-H165 HydrophobicContact CG1-CB 4.2Å; V157-H165 HydrophobicContact CG2-CB 4.35Å
158	L	92.3	Very high	89.1	Confident	36 Å²	36	81.1 Å²	81.1	19%	0.188	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	144.2	176.6	-57.9	176.2	0	0	0	109.7	F143 E144 E145 K160 D161 L162	F143-L158 VanDerWaalsContact O-CD2 3.31Å; F143-L158 WeakPolarHBondContact O-CD2 3.38Å; E144-L158 CarbonylContact O-C 3.55Å; E144-L158 WeakPolarHBondContact O-CA 3.42Å; E145-L158 HydrophobicContact CG-CD2 3.87Å; L158-K160 HydrophobicContact CB-CG 4.08Å; L158-K160 PolarHBondContact O-N 3.22Å; L158-K160 VanDerWaalsContact O-N 3.12Å; L158-D161 CarbonylContact O-C 3.59Å; L158-D161 PolarHBondContact O-N 3.33Å; L158-L162 PolarHBondContact O-N 2.87Å
159	R	92.4	Very high	89	Confident	49 Å²	49	83.9 Å²	83.9	19%	0.185	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-41.2	179.5	178	175.6	-64.9	142	18.5	112.9	L137 K138 N139 D140 C141 H142 E144 L146 D161 L162	L137-R159 PolarHBondContact O-NH1 3.04Å; L137-R159 PolarHBondContact O-NH2 3.38Å; K138-R159 PolarHBondContact O-NH1 2.87Å; K138-R159 PolarHBondContact O-NH2 3.25Å; N139-R159 PolarHBondContact O-NH1 3.11Å; D140-R159 VanDerWaalsContact N-NH1 3.14Å; C141-R159 VanDerWaalsContact N-NH1 3.12Å; C141-R159 PolarHBondContact O-NH1 3.4Å; C141-R159 VanDerWaalsContact O-NH1 3.09Å; H142-R159 PolarHBondContact O-N 2.71Å; E144-R159 PolarHBondContact O-N 2.92Å; L146-R159 HydrophobicContact CD1-CB 4.08Å; L146-R159 HydrophobicContact CD1-CG 4.22Å; R159-D161 VanDerWaalsContact C-N 3.28Å; R159-D161 PolarHBondContact O-N 3.09Å; R159-L162 PolarHBondContact O-N 3.45Å
160	K	90.9	Very high	89.1	Confident	99 Å²	99	79.1 Å²	79.1	43%	0.43	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-31.9	177.5	65.2	178.2	-169.7	178.2	0	113.9	H142 F143 L158	H142-K160 HydrophobicContact CB-CB 4.23Å; H142-K160 PolarHBondContact O-N 2.98Å; H142-K160 VanDerWaalsContact O-N 3.11Å; F143-K160 HydrophobicContact CE1-CD 4.5Å; L158-K160 HydrophobicContact CB-CG 4.08Å; L158-K160 PolarHBondContact O-N 3.22Å; L158-K160 VanDerWaalsContact O-N 3.12Å
161	D	92.1	Very high	89	Confident	69 Å²	69	81.3 Å²	81.3	37%	0.369	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-8.5	-174.2	-55.8	-45.3	0	0	0	112	L158 R159 R163 D164 H165	L158-D161 CarbonylContact O-C 3.59Å; L158-D161 PolarHBondContact O-N 3.33Å; R159-D161 VanDerWaalsContact C-N 3.28Å; R159-D161 PolarHBondContact O-N 3.09Å; D161-R163 VanDerWaalsContact C-N 3.31Å; D161-R163 PolarHBondContact O-N 3.28Å; D161-D164 PolarHBondContact O-N 2.77Å; D161-H165 WeakPolarHBondContact O-CB 3.37Å; D161-H165 PolarHBondContact O-N 2.94Å
162	L	89.4	Confident	89.3	Confident	29 Å²	29	80.1 Å²	80.1	15%	0.152	38%	0.377	C	S	.	.	H	α-helix	trans	-59.5	-39.5	-175.1	180	62.6	0	0	0	112.5	L146 V157 L158 R159 H165 V166	L146-L162 HydrophobicContact CB-CD2 4.4Å; L146-L162 HydrophobicContact CD1-CD2 4.21Å; V157-L162 HydrophobicContact CG2-CB 3.94Å; V157-L162 HydrophobicContact CG2-CD1 3.33Å; V157-L162 HydrophobicContact CG2-CG 4.22Å; L158-L162 PolarHBondContact O-N 2.87Å; R159-L162 PolarHBondContact O-N 3.45Å; L162-H165 PolarHBondContact O-N 3.43Å; L162-V166 HydrophobicContact CD1-CG2 4.19Å; L162-V166 VanDerWaalsContact O-CG2 3.26Å; L162-V166 WeakPolarHBondContact O-CG2 3.44Å; L162-V166 PolarHBondContact O-N 3.39Å
163	R	89.5	Confident	89.6	Confident	177 Å²	177	78.8 Å²	78.8	67%	0.668	36%	0.364	S	S	*	.	H	α-helix	trans	-62.5	-53.1	177.4	-178.7	-173.4	-67.5	-91.8	3.3	111.1	D161 H165 V166 E167	D161-R163 VanDerWaalsContact C-N 3.31Å; D161-R163 PolarHBondContact O-N 3.28Å; R163-H165 VanDerWaalsContact C-N 3.28Å; R163-H165 PolarHBondContact O-N 3.34Å; R163-V166 PolarHBondContact O-N 3.32Å; R163-E167 WeakPolarHBondContact CG-OE1 3.41Å; R163-E167 IonicContact NH1-OE1 3.61Å; R163-E167 PolarHBondContact O-N 2.99Å
164	D	91.4	Very high	89.5	Confident	75 Å²	75	83.4 Å²	83.4	40%	0.401	38%	0.384	S	S	.	.	H	α-helix	trans	-62.7	-36.9	179.9	-79.9	-43.1	0	0	0	111.7	D161 K168 A169	D161-D164 PolarHBondContact O-N 2.77Å; D164-K168 WeakPolarHBondContact O-CA 3.37Å; D164-K168 VanDerWaalsContact O-CB 3.32Å; D164-K168 WeakPolarHBondContact O-CB 3.31Å; D164-K168 PolarHBondContact O-N 3.39Å; D164-K168 IonicContact OD1-NZ 2.77Å; D164-K168 PolarHBondContact OD1-NZ 3.37Å; D164-A169 PolarHBondContact O-N 3.13Å
165	H	92	Very high	89.5	Confident	14 Å²	14	74.5 Å²	74.5	7%	0.065	35%	0.348	C	S	.	.	I	π-helix	trans	-58.2	-54.8	172	170.2	84.7	0	0	0	111.2	C148 E155 V157 D161 L162 R163 E167 A169 C170	C148-H165 VanDerWaalsContact SG-CD2 3.52Å; C148-H165 PolarHBondContact SG-NE2 3.28Å; E155-H165 IonicContact OE2-CE1 2.68Å; E155-H165 PolarHBondContact OE2-CE1 3.33Å; E155-H165 IonicContact OE2-ND1 3.3Å; V157-H165 HydrophobicContact CG1-CB 4.2Å; V157-H165 HydrophobicContact CG2-CB 4.35Å; D161-H165 WeakPolarHBondContact O-CB 3.37Å; D161-H165 PolarHBondContact O-N 2.94Å; L162-H165 PolarHBondContact O-N 3.43Å; R163-H165 VanDerWaalsContact C-N 3.28Å; R163-H165 PolarHBondContact O-N 3.34Å; H165-E167 VanDerWaalsContact C-N 3.32Å; H165-E167 PolarHBondContact O-N 2.73Å; H165-A169 CarbonylContact O-C 3.5Å; H165-A169 PolarHBondContact O-N 2.68Å; H165-C170 WeakPolarHBondContact O-CB 3.37Å; H165-C170 PolarHBondContact O-N 3.13Å
166	V	88.4	Confident	89.5	Confident	25 Å²	25	74 Å²	74	15%	0.152	35%	0.352	C	S	.	.	I	π-helix	trans	-62.8	-38.3	-175	173.6	0	0	0	0	112.2	V149 L162 R163	V149-V166 HydrophobicContact CG2-CG1 4.22Å; V149-V166 HydrophobicContact CG2-CG2 3.75Å; L162-V166 HydrophobicContact CD1-CG2 4.19Å; L162-V166 VanDerWaalsContact O-CG2 3.26Å; L162-V166 WeakPolarHBondContact O-CG2 3.44Å; L162-V166 PolarHBondContact O-N 3.39Å; R163-V166 PolarHBondContact O-N 3.32Å
167	E	86.8	Confident	89.4	Confident	104 Å²	104	67 Å²	67	49%	0.486	32%	0.322	S	S	.	.	I	π-helix	trans	-82.6	-42.2	-177	-67.7	173.9	-171.7	0	0	112.4	R163 H165 R173	R163-E167 WeakPolarHBondContact CG-OE1 3.41Å; R163-E167 IonicContact NH1-OE1 3.61Å; R163-E167 PolarHBondContact O-N 2.99Å; H165-E167 VanDerWaalsContact C-N 3.32Å; H165-E167 PolarHBondContact O-N 2.73Å; E167-R173 WeakPolarHBondContact O-CD 3.39Å; E167-R173 PolarHBondContact O-NH1 3.4Å
168	K	87.1	Confident	89.1	Confident	135 Å²	135	68.9 Å²	68.9	59%	0.587	34%	0.336	S	S	*	.	I	π-helix	trans	-115.4	-29.5	-164.5	-60.1	172.8	-173.5	153.9	0	115.2	D164 R173	D164-K168 WeakPolarHBondContact O-CA 3.37Å; D164-K168 VanDerWaalsContact O-CB 3.32Å; D164-K168 WeakPolarHBondContact O-CB 3.31Å; D164-K168 PolarHBondContact O-N 3.39Å; D164-K168 IonicContact OD1-NZ 2.77Å; D164-K168 PolarHBondContact OD1-NZ 3.37Å; K168-R173 PolarHBondContact O-NH1 2.79Å
169	A	87.8	Confident	88.7	Confident	68 Å²	68	72 Å²	72	56%	0.562	35%	0.349	S	S	*	.	I	π-helix	trans	-111.1	-28	-172.9	0	0	0	0	0	114.1	D164 H165 K171	D164-A169 PolarHBondContact O-N 3.13Å; H165-A169 CarbonylContact O-C 3.5Å; H165-A169 PolarHBondContact O-N 2.68Å; A169-K171 PolarHBondContact O-N 3.31Å
170	C	89.9	Confident	88.2	Confident	2 Å²	2	71.2 Å²	71.2	1%	0.014	35%	0.351	C	S	.	.			trans	-64.6	122.6	-171.5	-175.8	0	0	0	0	111.2	H165 Y172 R173	H165-C170 WeakPolarHBondContact O-CB 3.37Å; H165-C170 PolarHBondContact O-N 3.13Å; C170-Y172 PolarHBondContact O-N 3.05Å; C170-Y172 VanDerWaalsContact O-N 3.16Å; C170-Y172 PolarHBondContact SG-N 3.37Å; C170-Y172 VanDerWaalsContact SG-N 3.43Å; C170-R173 HydrophobicContact CB-CB 4.49Å; C170-R173 WeakPolarHBondContact O-CB 3.47Å; C170-R173 WeakPolarHBondContact O-CG 3.33Å; C170-R173 PolarHBondContact O-N 3Å
171	K	84.9	Confident	88	Confident	134 Å²	134	73.6 Å²	73.6	58%	0.583	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-18	177	-61.3	178.7	-176.5	173.9	0	113.2	A169 I187	A169-K171 PolarHBondContact O-N 3.31Å; K171-I187 WeakPolarHBondContact O-CB 3.32Å; K171-I187 PolarHBondContact O-N 3.09Å
172	Y	87.5	Confident	87.7	Confident	77 Å²	77	72.4 Å²	72.4	30%	0.302	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	11.3	178.1	-59.4	-85.9	0	0	0	112.8	D152 C153 C170 I187	D152-Y172 HydrophobicContact CB-CD1 3.49Å; D152-Y172 VanDerWaalsContact CB-CD1 3.49Å; D152-Y172 HydrophobicContact CB-CD2 4.47Å; D152-Y172 HydrophobicContact CB-CE1 3.36Å; D152-Y172 HydrophobicContact CB-CE2 4.38Å; D152-Y172 HydrophobicContact CB-CG 4.05Å; D152-Y172 VanDerWaalsContact O-CE2 3.29Å; D152-Y172 WeakPolarHBondContact O-CE2 3.49Å; D152-Y172 PolarHBondContact O-OH 3.48Å; C153-Y172 HydrophobicContact CB-CD2 3.78Å; C153-Y172 HydrophobicContact CB-CE2 4.34Å; C170-Y172 PolarHBondContact O-N 3.05Å; C170-Y172 VanDerWaalsContact O-N 3.16Å; C170-Y172 PolarHBondContact SG-N 3.37Å; C170-Y172 VanDerWaalsContact SG-N 3.43Å; Y172-I187 HydrophobicContact CD1-CG2 3.98Å; Y172-I187 HydrophobicContact CE1-CG2 3.97Å
173	R	89.9	Confident	87.6	Confident	80 Å²	80	77.1 Å²	77.1	30%	0.302	38%	0.38	S	S	.	.	S	Bend	trans	-62.1	151.6	169.7	75.3	-175.9	177.1	-167.3	-10.4	110.4	E167 K168 C170 P185 M186	E167-R173 WeakPolarHBondContact O-CD 3.39Å; E167-R173 PolarHBondContact O-NH1 3.4Å; K168-R173 PolarHBondContact O-NH1 2.79Å; C170-R173 HydrophobicContact CB-CB 4.49Å; C170-R173 WeakPolarHBondContact O-CB 3.47Å; C170-R173 WeakPolarHBondContact O-CG 3.33Å; C170-R173 PolarHBondContact O-N 3Å; R173-P185 CarbonylContact O-C 3.49Å; R173-P185 WeakPolarHBondContact O-CA 3.5Å; R173-M186 HydrophobicContact CG-CB 3.95Å; R173-M186 PolarHBondContact O-N 3.37Å
174	E	87.3	Confident	87.5	Confident	109 Å²	109	69.7 Å²	69.7	51%	0.509	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	132.2	174.8	-69.3	169.2	173.5	0	0	109.9	Q183	E174-Q183 HydrophobicContact CB-CB 4.49Å; E174-Q183 PolarHBondContact OE2-OE1 2.93Å
175	A	87.1	Confident	87.3	Confident	15 Å²	15	68.8 Å²	68.8	12%	0.124	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.4	172.7	0	0	0	0	0	109.1	Q183 V184 M186 L189	A175-Q183 WeakPolarHBondContact O-CA 3.46Å; A175-V184 PolarHBondContact N-O 2.95Å; A175-V184 PolarHBondContact O-N 2.82Å; A175-V184 VanDerWaalsContact O-O 3.13Å; A175-M186 HydrophobicContact CB-CB 4.34Å; A175-M186 HydrophobicContact CB-SD 3.73Å; A175-L189 HydrophobicContact CB-CD2 3.93Å
176	T	89.4	Confident	87.1	Confident	85 Å²	85	72 Å²	72	52%	0.521	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.6	-178.5	-57.4	0	0	0	0	110.5	S182	T176-S182 WeakPolarHBondContact CA-O 3.33Å
177	C	88.9	Confident	87	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.007	38%	0.384	C	S	.	.			trans	-64	133.6	175.3	176.6	0	0	0	0	111.6	H179 K181 S182 L189 H192	C177-H179 VanDerWaalsContact C-N 3.31Å; C177-H179 PolarHBondContact O-N 3.42Å; C177-K181 VanDerWaalsContact O-CA 3.25Å; C177-K181 WeakPolarHBondContact O-CA 3.49Å; C177-K181 PolarHBondContact O-N 2.84Å; C177-K181 VanDerWaalsContact O-N 3.08Å; C177-S182 PolarHBondContact N-O 3.45Å; C177-L189 HydrophobicContact CB-CD1 4.23Å; C177-H192 VanDerWaalsContact SG-CD2 3.51Å; C177-H192 PolarHBondContact SG-NE2 3.19Å; C177-H192 VanDerWaalsContact SG-NE2 3.42Å
178	S	85.7	Confident	87	Confident	63 Å²	63	72.2 Å²	72.2	44%	0.441	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-33.6	-178.4	61.2	0	0	0	0	112.7	K181 E193	S178-K181 PolarHBondContact O-NZ 3.45Å; S178-E193 PolarHBondContact OG-OE1 3.25Å
179	H	83.4	Confident	87	Confident	103 Å²	103	67 Å²	67	48%	0.477	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-52	-175	-60	-74.2	0	0	0	114.1	C177 C199	C177-H179 VanDerWaalsContact C-N 3.31Å; C177-H179 PolarHBondContact O-N 3.42Å; H179-C199 HydrophobicContact CB-CB 4.21Å
180	C	83.8	Confident	86.8	Confident	32 Å²	32	69.3 Å²	69.3	22%	0.216	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-4.4	-174.6	72.5	0	0	0	0	114.4	S182 H192 P198 C199	C180-S182 PolarHBondContact O-N 2.82Å; C180-S182 PolarHBondContact SG-OG 3.3Å; C180-H192 PolarHBondContact SG-NE2 3.01Å; C180-P198 HydrophobicContact CB-CG 4.33Å; C180-C199 HydrophobicContact CB-CB 4.06Å; C180-C199 WeakPolarHBondContact CB-SG 3.37Å
181	K	86.8	Confident	86.6	Confident	148 Å²	148	75.5 Å²	75.5	64%	0.643	38%	0.38	S	S	*	.			trans	61	9.9	-179.5	-50	-58.8	-178.1	-162.7	0	115.5	C177 S178	C177-K181 VanDerWaalsContact O-CA 3.25Å; C177-K181 WeakPolarHBondContact O-CA 3.49Å; C177-K181 PolarHBondContact O-N 2.84Å; C177-K181 VanDerWaalsContact O-N 3.08Å; S178-K181 PolarHBondContact O-NZ 3.45Å
182	S	84	Confident	86.7	Confident	45 Å²	45	70.1 Å²	70.1	32%	0.315	36%	0.357	S	S	.	.			trans	-72.3	154.7	173.8	72.4	0	0	0	0	111.6	T176 C177 C180	T176-S182 WeakPolarHBondContact CA-O 3.33Å; C177-S182 PolarHBondContact N-O 3.45Å; C180-S182 PolarHBondContact O-N 2.82Å; C180-S182 PolarHBondContact SG-OG 3.3Å
183	Q	88.3	Confident	86.5	Confident	128 Å²	128	68.5 Å²	68.5	60%	0.598	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.9	125.7	171.5	-70.6	-174.3	-29.3	0	0	109.8	E174 A175	E174-Q183 HydrophobicContact CB-CB 4.49Å; E174-Q183 PolarHBondContact OE2-OE1 2.93Å; A175-Q183 WeakPolarHBondContact O-CA 3.46Å
184	V	86.8	Confident	86	Confident	20 Å²	20	69.1 Å²	69.1	12%	0.121	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.4	176.9	-64.2	0	0	0	0	110.1	A175 M186 L189 H192	A175-V184 PolarHBondContact N-O 2.95Å; A175-V184 PolarHBondContact O-N 2.82Å; A175-V184 VanDerWaalsContact O-O 3.13Å; V184-M186 PolarHBondContact O-N 3.01Å; V184-L189 HydrophobicContact CG2-CB 4.06Å; V184-L189 HydrophobicContact CG2-CD1 3.48Å; V184-L189 VanDerWaalsContact CG2-CD1 3.48Å; V184-L189 HydrophobicContact CG2-CG 4.38Å; V184-H192 HydrophobicContact CG2-CB 4.43Å
185	P	87.7	Confident	85.6	Confident	57 Å²	57	67 Å²	67	37%	0.37	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	136.5	174.4	-24.2	34.1	0	0	0	111.3	R173 I187 A188 L189	R173-P185 CarbonylContact O-C 3.49Å; R173-P185 WeakPolarHBondContact O-CA 3.5Å; P185-I187 HydrophobicContact CB-CG2 4.18Å; P185-I187 PolarHBondContact O-N 3.32Å; P185-I187 VanDerWaalsContact O-N 3.14Å; P185-A188 HydrophobicContact CB-CB 4.34Å; P185-A188 CarbonylContact O-C 3.6Å; P185-A188 WeakPolarHBondContact O-CA 3.29Å; P185-A188 PolarHBondContact O-N 3.29Å; P185-L189 PolarHBondContact O-N 3.03Å
186	M	87.8	Confident	85.3	Confident	80 Å²	80	70.6 Å²	70.6	39%	0.394	37%	0.373	S	S	.	.	H	α-helix	trans	-53.1	-39.6	-177.5	-175.8	74.7	-159.5	0	0	112.6	R173 A175 V184 A188 L189	R173-M186 HydrophobicContact CG-CB 3.95Å; R173-M186 PolarHBondContact O-N 3.37Å; A175-M186 HydrophobicContact CB-CB 4.34Å; A175-M186 HydrophobicContact CB-SD 3.73Å; V184-M186 PolarHBondContact O-N 3.01Å; M186-A188 PolarHBondContact O-N 2.73Å; M186-L189 WeakPolarHBondContact O-CB 3.32Å; M186-L189 PolarHBondContact O-N 3.34Å; M186-L189 HydrophobicContact SD-CD2 4.34Å
187	I	86.9	Confident	85.1	Confident	98 Å²	98	66.5 Å²	66.5	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-62.7	-27	175.9	-166.4	166.7	0	0	0	113.8	K171 Y172 P185	K171-I187 WeakPolarHBondContact O-CB 3.32Å; K171-I187 PolarHBondContact O-N 3.09Å; Y172-I187 HydrophobicContact CD1-CG2 3.98Å; Y172-I187 HydrophobicContact CE1-CG2 3.97Å; P185-I187 HydrophobicContact CB-CG2 4.18Å; P185-I187 PolarHBondContact O-N 3.32Å; P185-I187 VanDerWaalsContact O-N 3.14Å
188	A	86.6	Confident	84.6	Confident	37 Å²	37	69 Å²	69	31%	0.306	36%	0.364	S	S	.	.	H	α-helix	trans	-99.5	-6.6	-178.9	0	0	0	0	0	112.8	P185 M186 Q190 K191 H192	P185-A188 HydrophobicContact CB-CB 4.34Å; P185-A188 CarbonylContact O-C 3.6Å; P185-A188 WeakPolarHBondContact O-CA 3.29Å; P185-A188 PolarHBondContact O-N 3.29Å; M186-A188 PolarHBondContact O-N 2.73Å; A188-Q190 PolarHBondContact O-N 3.45Å; A188-K191 PolarHBondContact O-N 3Å; A188-H192 WeakPolarHBondContact O-CB 3.31Å; A188-H192 PolarHBondContact O-N 2.88Å
189	L	86.3	Confident	84.4	Confident	25 Å²	25	68.5 Å²	68.5	13%	0.131	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-46.5	-175.2	178.8	62.5	0	0	0	112.1	A175 C177 V184 P185 M186 K191 H192 E193	A175-L189 HydrophobicContact CB-CD2 3.93Å; C177-L189 HydrophobicContact CB-CD1 4.23Å; V184-L189 HydrophobicContact CG2-CB 4.06Å; V184-L189 HydrophobicContact CG2-CD1 3.48Å; V184-L189 VanDerWaalsContact CG2-CD1 3.48Å; V184-L189 HydrophobicContact CG2-CG 4.38Å; P185-L189 PolarHBondContact O-N 3.03Å; M186-L189 WeakPolarHBondContact O-CB 3.32Å; M186-L189 PolarHBondContact O-N 3.34Å; M186-L189 HydrophobicContact SD-CD2 4.34Å; L189-K191 PolarHBondContact O-N 2.79Å; L189-H192 WeakPolarHBondContact O-CB 3.26Å; L189-H192 PolarHBondContact O-N 2.98Å; L189-E193 HydrophobicContact CD1-CG 4.32Å; L189-E193 WeakPolarHBondContact O-CG 3.49Å; L189-E193 PolarHBondContact O-N 3.46Å
190	Q	84.8	Confident	84.3	Confident	116 Å²	116	65 Å²	65	54%	0.542	35%	0.346	S	S	.	.	H	α-helix	trans	-60.5	-49	178.6	-174.5	62.8	46.8	0	0	111.4	A188 H192 E193 D194	A188-Q190 PolarHBondContact O-N 3.45Å; Q190-H192 VanDerWaalsContact C-N 3.28Å; Q190-H192 PolarHBondContact O-N 3.25Å; Q190-E193 PolarHBondContact O-N 2.89Å; Q190-D194 PolarHBondContact NE2-OD1 3.36Å; Q190-D194 PolarHBondContact NE2-OD2 2.84Å; Q190-D194 WeakPolarHBondContact O-CB 3.32Å; Q190-D194 VanDerWaalsContact O-CG 3.25Å; Q190-D194 PolarHBondContact O-N 3.28Å
191	K	85.8	Confident	84.2	Confident	132 Å²	132	67.7 Å²	67.7	57%	0.574	36%	0.361	S	S	*	.	H	α-helix	trans	-60.4	-41.4	176.5	-178.3	-177.1	171.6	-172.2	0	111.2	A188 L189 D194 T195	A188-K191 PolarHBondContact O-N 3Å; L189-K191 PolarHBondContact O-N 2.79Å; K191-D194 PolarHBondContact O-N 3.31Å; K191-T195 PolarHBondContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 2.91Å
192	H	85.4	Confident	83.9	Confident	22 Å²	22	62 Å²	62	10%	0.102	34%	0.339	C	S	.	.	I	π-helix	trans	-58.8	-50.4	176.1	172.8	77.7	0	0	0	110.9	C177 C180 V184 A188 L189 Q190 D194 D196 C197	C177-H192 VanDerWaalsContact SG-CD2 3.51Å; C177-H192 PolarHBondContact SG-NE2 3.19Å; C177-H192 VanDerWaalsContact SG-NE2 3.42Å; C180-H192 PolarHBondContact SG-NE2 3.01Å; V184-H192 HydrophobicContact CG2-CB 4.43Å; A188-H192 WeakPolarHBondContact O-CB 3.31Å; A188-H192 PolarHBondContact O-N 2.88Å; L189-H192 WeakPolarHBondContact O-CB 3.26Å; L189-H192 PolarHBondContact O-N 2.98Å; Q190-H192 VanDerWaalsContact C-N 3.28Å; Q190-H192 PolarHBondContact O-N 3.25Å; H192-D194 VanDerWaalsContact C-N 3.33Å; H192-D194 PolarHBondContact O-N 2.88Å; H192-D196 CarbonylContact O-C 3.57Å; H192-D196 PolarHBondContact O-N 3.04Å; H192-C197 WeakPolarHBondContact O-CA 3.45Å; H192-C197 WeakPolarHBondContact O-CB 3.18Å; H192-C197 PolarHBondContact O-N 3.23Å
193	E	83	Confident	83.6	Confident	42 Å²	42	64.4 Å²	64.4	20%	0.196	36%	0.356	C	S	.	.	I	π-helix	trans	-60.4	-41.1	177.7	-68.5	-176.9	148.6	0	0	111.9	S178 L189 Q190	S178-E193 PolarHBondContact OG-OE1 3.25Å; L189-E193 HydrophobicContact CD1-CG 4.32Å; L189-E193 WeakPolarHBondContact O-CG 3.49Å; L189-E193 PolarHBondContact O-N 3.46Å; Q190-E193 PolarHBondContact O-N 2.89Å
194	D	80.8	Confident	83.1	Confident	93 Å²	93	58.7 Å²	58.7	50%	0.497	33%	0.33	S	S	.	.	I	π-helix	trans	-76.1	-39.7	-176.6	-66.5	-27.4	0	0	0	113.9	Q190 K191 H192 R215	Q190-D194 PolarHBondContact NE2-OD1 3.36Å; Q190-D194 PolarHBondContact NE2-OD2 2.84Å; Q190-D194 WeakPolarHBondContact O-CB 3.32Å; Q190-D194 VanDerWaalsContact O-CG 3.25Å; Q190-D194 PolarHBondContact O-N 3.28Å; K191-D194 PolarHBondContact O-N 3.31Å; H192-D194 VanDerWaalsContact C-N 3.33Å; H192-D194 PolarHBondContact O-N 2.88Å; D194-R215 PolarHBondContact O-NH1 3.38Å; D194-R215 PolarHBondContact O-NH2 3.28Å
195	T	78.8	Confident	82.7	Confident	66 Å²	66	61.9 Å²	61.9	41%	0.405	35%	0.351	S	S	.	.	I	π-helix	trans	-124.5	-25.8	-167.8	67.9	0	0	0	0	115.9	K191 R215	K191-T195 PolarHBondContact O-N 3.12Å; K191-T195 PolarHBondContact O-OG1 2.91Å; T195-R215 PolarHBondContact O-NH1 3.46Å
196	D	80.4	Confident	82	Confident	89 Å²	89	62.6 Å²	62.6	48%	0.476	35%	0.349	S	S	.	.	I	π-helix	trans	-118.3	-18.1	-165.4	-49.7	-25.6	0	0	0	113	H192 P198	H192-D196 CarbonylContact O-C 3.57Å; H192-D196 PolarHBondContact O-N 3.04Å; D196-P198 WeakPolarHBondContact O-CD 3.4Å
197	C	84.3	Confident	81.2	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.37	C	S	.	.			trans	-70.3	119.6	-173.2	-179.6	0	0	0	0	110.6	H192 C199 V200 R215	H192-C197 WeakPolarHBondContact O-CA 3.45Å; H192-C197 WeakPolarHBondContact O-CB 3.18Å; H192-C197 PolarHBondContact O-N 3.23Å; C197-C199 PolarHBondContact O-N 2.95Å; C197-V200 HydrophobicContact CB-CG2 3.81Å; C197-V200 PolarHBondContact O-N 3.27Å; C197-R215 WeakPolarHBondContact O-CD 3.35Å; C197-R215 PolarHBondContact O-NE 3.17Å
198	P	80.3	Confident	80.6	Confident	52 Å²	52	64.8 Å²	64.8	34%	0.338	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.7	-176.1	24.7	-32.6	0	0	0	112.9	C180 D196 V200 R215 S216	C180-P198 HydrophobicContact CB-CG 4.33Å; D196-P198 WeakPolarHBondContact O-CD 3.4Å; P198-V200 VanDerWaalsContact C-N 3.35Å; P198-V200 PolarHBondContact O-N 2.84Å; P198-R215 PolarHBondContact O-N 2.98Å; P198-S216 PolarHBondContact O-N 3.5Å; P198-S216 VanDerWaalsContact O-N 3.12Å; P198-S216 PolarHBondContact O-OG 2.86Å
199	C	80.1	Confident	79.9	Confident	53 Å²	53	68.6 Å²	68.6	36%	0.358	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	7.4	-173.3	-57.2	0	0	0	0	114.1	H179 C180 C197	H179-C199 HydrophobicContact CB-CB 4.21Å; C180-C199 HydrophobicContact CB-CB 4.06Å; C180-C199 WeakPolarHBondContact CB-SG 3.37Å; C197-C199 PolarHBondContact O-N 2.95Å
200	V	82.5	Confident	79.3	Confident	30 Å²	30	70.2 Å²	70.2	18%	0.182	39%	0.392	C	S	.	.	S	Bend	trans	-84.7	133.3	175.1	174.5	0	0	0	0	109.6	C197 P198 V202 R215	C197-V200 HydrophobicContact CB-CG2 3.81Å; C197-V200 PolarHBondContact O-N 3.27Å; P198-V200 VanDerWaalsContact C-N 3.35Å; P198-V200 PolarHBondContact O-N 2.84Å; V200-V202 HydrophobicContact CG1-CG1 4.43Å; V200-R215 PolarHBondContact O-N 2.76Å
201	V	81.2	Confident	78.4	Confident	88 Å²	88	72.9 Å²	72.9	53%	0.533	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	126.1	175.5	-178.9	0	0	0	0	109.3	L213 L214	V201-L213 CarbonylContact C-O 3.58Å; V201-L213 WeakPolarHBondContact CA-O 3.39Å; V201-L214 HydrophobicContact CG2-CD2 4.09Å
202	V	80.9	Confident	77.9	Confident	29 Å²	29	72.2 Å²	72.2	18%	0.176	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.5	-179.1	-64	0	0	0	0	110.5	V200 L213 R215 L218	V200-V202 HydrophobicContact CG1-CG1 4.43Å; V202-L213 PolarHBondContact N-O 2.97Å; V202-L213 WeakPolarHBondContact O-CB 3.34Å; V202-R215 HydrophobicContact CG1-CB 4.23Å; V202-R215 HydrophobicContact CG1-CG 4.48Å; V202-R215 HydrophobicContact CG2-CB 4.29Å; V202-L218 HydrophobicContact CG2-CB 4.34Å; V202-L218 HydrophobicContact CG2-CD1 4.47Å; V202-L218 HydrophobicContact CG2-CD2 4.12Å
203	S	77.3	Confident	77.4	Confident	96 Å²	96	71.6 Å²	71.6	67%	0.671	41%	0.409	S	S	*	.			trans	-85.4	144.2	175.3	56.6	0	0	0	0	111.6	P205	S203-P205 WeakPolarHBondContact O-CD 3.41Å
204	C	77.8	Confident	77.4	Confident	7 Å²	7	72.3 Å²	72.3	5%	0.047	41%	0.413	C	S	.	.			trans	-62.6	124.8	175.6	-179.8	0	0	0	0	111.7	H206 K207 C208 L213 H221	C204-H206 PolarHBondContact O-N 2.7Å; C204-H206 VanDerWaalsContact O-N 3.14Å; C204-H206 PolarHBondContact SG-N 2.88Å; C204-K207 PolarHBondContact O-N 3.11Å; C204-C208 WeakPolarHBondContact CB-SG 3.36Å; C204-L213 HydrophobicContact CB-CD1 4.11Å; C204-H221 PolarHBondContact SG-NE2 2.91Å; C204-H221 VanDerWaalsContact SG-NE2 3.41Å
205	P	77.3	Confident	77.4	Confident	88 Å²	88	71 Å²	71	57%	0.571	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.2	177.2	-26	34.3	0	0	0	114.3	S203 K207	S203-P205 WeakPolarHBondContact O-CD 3.41Å; P205-K207 VanDerWaalsContact C-N 3.28Å; P205-K207 PolarHBondContact O-N 3.05Å
206	H	73.4	Confident	77.4	Confident	72 Å²	72	71 Å²	71	33%	0.333	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	12.8	178.1	-58	-53.8	0	0	0	113.5	C204 C208 L222 N227	C204-H206 PolarHBondContact O-N 2.7Å; C204-H206 VanDerWaalsContact O-N 3.14Å; C204-H206 PolarHBondContact SG-N 2.88Å; H206-C208 PolarHBondContact O-N 2.92Å; H206-C208 VanDerWaalsContact O-N 3.16Å; H206-L222 VanDerWaalsContact CD2-CD2 3.45Å; H206-L222 WeakPolarHBondContact CD2-CD2 3.36Å; H206-N227 HydrophobicContact CB-CB 4.11Å
207	K	71.5	Confident	77.3	Confident	192 Å²	192	71 Å²	71	84%	0.835	40%	0.401	S	S	*	.			trans	49	42.2	175	-59.2	-177.4	179.9	-179.5	0	113.4	C204 P205	C204-K207 PolarHBondContact O-N 3.11Å; P205-K207 VanDerWaalsContact C-N 3.28Å; P205-K207 PolarHBondContact O-N 3.05Å
208	C	74.1	Confident	77	Confident	31 Å²	31	72.7 Å²	72.7	21%	0.209	41%	0.41	C	S	.	.			trans	-70.7	172.9	170.2	75.3	0	0	0	0	110.5	C204 H206 V210 H221	C204-C208 WeakPolarHBondContact CB-SG 3.36Å; H206-C208 PolarHBondContact O-N 2.92Å; H206-C208 VanDerWaalsContact O-N 3.16Å; C208-V210 PolarHBondContact O-N 3.21Å; C208-H221 PolarHBondContact SG-CE1 3.48Å; C208-H221 PolarHBondContact SG-NE2 3.48Å
209	S	72.2	Confident	76.8	Confident	118 Å²	118	74.3 Å²	74.3	83%	0.825	42%	0.422	S	S	*	.	S	Bend	trans	-74.3	-2.1	-176.5	44.6	0	0	0	0	115.3
210	V	74.1	Confident	76.6	Confident	59 Å²	59	74.4 Å²	74.4	36%	0.358	43%	0.427	S	S	.	.			trans	-87.3	118	-176.9	-171.7	0	0	0	0	110.6	C208 L213	C208-V210 PolarHBondContact O-N 3.21Å; V210-L213 HydrophobicContact CB-CD1 3.9Å; V210-L213 HydrophobicContact CB-CG 4.37Å; V210-L213 HydrophobicContact CG1-CD1 3.76Å; V210-L213 HydrophobicContact CG1-CD2 4.33Å; V210-L213 HydrophobicContact CG1-CG 3.66Å
211	Q	65.4	Low	76.5	Confident	172 Å²	172	74.5 Å²	74.5	80%	0.804	43%	0.425	S	S	*	.			trans	-104.2	-15.3	-174.8	-65.4	-173.1	-8	0	0	114.7
212	T	75	Confident	76.1	Confident	117 Å²	117	72.8 Å²	72.8	72%	0.718	41%	0.413	S	S	*	.			trans	-115.9	73.6	-179.2	55.6	0	0	0	0	110.5
213	L	76.1	Confident	75.6	Confident	9 Å²	9	75.3 Å²	75.3	5%	0.047	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.1	177.4	-84.9	155.4	0	0	0	109.8	V201 V202 C204 V210 E217 H221	V201-L213 CarbonylContact C-O 3.58Å; V201-L213 WeakPolarHBondContact CA-O 3.39Å; V202-L213 PolarHBondContact N-O 2.97Å; V202-L213 WeakPolarHBondContact O-CB 3.34Å; C204-L213 HydrophobicContact CB-CD1 4.11Å; V210-L213 HydrophobicContact CB-CD1 3.9Å; V210-L213 HydrophobicContact CB-CG 4.37Å; V210-L213 HydrophobicContact CG1-CD1 3.76Å; V210-L213 HydrophobicContact CG1-CD2 4.33Å; V210-L213 HydrophobicContact CG1-CG 3.66Å; L213-E217 HydrophobicContact CD2-CB 4.36Å; L213-H221 HydrophobicContact CD2-CB 3.58Å
214	L	81.6	Confident	75.3	Confident	57 Å²	57	78.4 Å²	78.4	30%	0.298	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	147	168.5	-63.5	175.6	0	0	0	109.6	V201 S216 E217 L218	V201-L214 HydrophobicContact CG2-CD2 4.09Å; L214-S216 PolarHBondContact O-N 3.17Å; L214-S216 VanDerWaalsContact O-N 3.15Å; L214-E217 HydrophobicContact CB-CB 4.48Å; L214-E217 HydrophobicContact CB-CG 4.12Å; L214-E217 PolarHBondContact N-OE2 3.3Å; L214-E217 WeakPolarHBondContact O-CA 3.12Å; L214-E217 WeakPolarHBondContact O-CB 3.3Å; L214-E217 PolarHBondContact O-N 3.23Å; L214-L218 PolarHBondContact O-N 3.12Å; L214-L218 VanDerWaalsContact O-N 3.14Å
215	R	80.4	Confident	75.3	Confident	67 Å²	67	78.3 Å²	78.3	25%	0.253	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-33.4	178	-168.7	-173.9	-59.1	-112	-1.6	112.3	D194 T195 C197 P198 V200 V202 E217 L218	D194-R215 PolarHBondContact O-NH1 3.38Å; D194-R215 PolarHBondContact O-NH2 3.28Å; T195-R215 PolarHBondContact O-NH1 3.46Å; C197-R215 WeakPolarHBondContact O-CD 3.35Å; C197-R215 PolarHBondContact O-NE 3.17Å; P198-R215 PolarHBondContact O-N 2.98Å; V200-R215 PolarHBondContact O-N 2.76Å; V202-R215 HydrophobicContact CG1-CB 4.23Å; V202-R215 HydrophobicContact CG1-CG 4.48Å; V202-R215 HydrophobicContact CG2-CB 4.29Å; R215-E217 VanDerWaalsContact C-N 3.29Å; R215-E217 PolarHBondContact O-N 3.39Å; R215-L218 WeakPolarHBondContact O-CB 3.45Å; R215-L218 PolarHBondContact O-N 3.39Å
216	S	79	Confident	75	Confident	64 Å²	64	78.2 Å²	78.2	45%	0.448	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.9	173.1	50.8	0	0	0	0	114.1	P198 L214	P198-S216 PolarHBondContact O-N 3.5Å; P198-S216 VanDerWaalsContact O-N 3.12Å; P198-S216 PolarHBondContact O-OG 2.86Å; L214-S216 PolarHBondContact O-N 3.17Å; L214-S216 VanDerWaalsContact O-N 3.15Å
217	E	79	Confident	74.9	Confident	90 Å²	90	78.5 Å²	78.5	42%	0.421	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-11.5	-177.2	-62.2	168.1	164	0	0	111.7	L213 L214 R215 S219 A220 H221	L213-E217 HydrophobicContact CD2-CB 4.36Å; L214-E217 HydrophobicContact CB-CB 4.48Å; L214-E217 HydrophobicContact CB-CG 4.12Å; L214-E217 PolarHBondContact N-OE2 3.3Å; L214-E217 WeakPolarHBondContact O-CA 3.12Å; L214-E217 WeakPolarHBondContact O-CB 3.3Å; L214-E217 PolarHBondContact O-N 3.23Å; R215-E217 VanDerWaalsContact C-N 3.29Å; R215-E217 PolarHBondContact O-N 3.39Å; E217-S219 VanDerWaalsContact C-N 3.31Å; E217-S219 PolarHBondContact O-N 2.79Å; E217-A220 PolarHBondContact O-N 3.05Å; E217-H221 VanDerWaalsContact O-CB 3.27Å; E217-H221 WeakPolarHBondContact O-CB 3.35Å; E217-H221 PolarHBondContact O-N 2.93Å
218	L	78.5	Confident	75.1	Confident	36 Å²	36	69.6 Å²	69.6	19%	0.188	40%	0.399	C	S	.	.	H	α-helix	trans	-59.3	-40.9	-178.2	-177.8	63.1	0	0	0	112	V202 L214 R215 H221 L222	V202-L218 HydrophobicContact CG2-CB 4.34Å; V202-L218 HydrophobicContact CG2-CD1 4.47Å; V202-L218 HydrophobicContact CG2-CD2 4.12Å; L214-L218 PolarHBondContact O-N 3.12Å; L214-L218 VanDerWaalsContact O-N 3.14Å; R215-L218 WeakPolarHBondContact O-CB 3.45Å; R215-L218 PolarHBondContact O-N 3.39Å; L218-H221 PolarHBondContact O-N 3.37Å; L218-L222 HydrophobicContact CD1-CD1 4.34Å; L218-L222 HydrophobicContact CD1-CG 4.21Å; L218-L222 HydrophobicContact CG-CD1 4.05Å; L218-L222 HydrophobicContact CG-CG 4.35Å; L218-L222 WeakPolarHBondContact O-CB 3.43Å; L218-L222 WeakPolarHBondContact O-CG 3.47Å; L218-L222 PolarHBondContact O-N 2.91Å
219	S	75.3	Confident	75.3	Confident	85 Å²	85	72.9 Å²	72.9	59%	0.594	42%	0.42	S	S	*	.	H	α-helix	trans	-66.3	-46.8	-179.9	56.8	0	0	0	0	112.3	E217 H221 L222 S223	E217-S219 VanDerWaalsContact C-N 3.31Å; E217-S219 PolarHBondContact O-N 2.79Å; S219-H221 VanDerWaalsContact C-N 3.34Å; S219-L222 PolarHBondContact O-N 3.42Å; S219-S223 PolarHBondContact O-N 2.98Å; S219-S223 PolarHBondContact O-OG 3.46Å
220	A	75.6	Confident	75.7	Confident	55 Å²	55	69.2 Å²	69.2	46%	0.455	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-40.7	175.6	0	0	0	0	0	111.5	E217 S223 E224	E217-A220 PolarHBondContact O-N 3.05Å; A220-S223 PolarHBondContact O-N 2.85Å; A220-S223 PolarHBondContact O-OG 3.2Å; A220-E224 PolarHBondContact O-N 3.3Å
221	H	80	Confident	76.3	Confident	32 Å²	32	68.9 Å²	68.9	15%	0.148	39%	0.393	C	S	.	.	H	α-helix	trans	-62.1	-44.6	173.4	175.6	76.9	0	0	0	112.1	C204 C208 L213 E217 L218 S219 S223 E224 C225	C204-H221 PolarHBondContact SG-NE2 2.91Å; C204-H221 VanDerWaalsContact SG-NE2 3.41Å; C208-H221 PolarHBondContact SG-CE1 3.48Å; C208-H221 PolarHBondContact SG-NE2 3.48Å; L213-H221 HydrophobicContact CD2-CB 3.58Å; E217-H221 VanDerWaalsContact O-CB 3.27Å; E217-H221 WeakPolarHBondContact O-CB 3.35Å; E217-H221 PolarHBondContact O-N 2.93Å; L218-H221 PolarHBondContact O-N 3.37Å; S219-H221 VanDerWaalsContact C-N 3.34Å; H221-S223 VanDerWaalsContact C-N 3.29Å; H221-S223 PolarHBondContact O-N 3.23Å; H221-E224 CarbonylContact O-C 3.51Å; H221-E224 PolarHBondContact O-N 2.88Å; H221-E224 VanDerWaalsContact O-N 3.13Å; H221-C225 WeakPolarHBondContact O-CA 3.45Å; H221-C225 VanDerWaalsContact O-CB 3.28Å; H221-C225 WeakPolarHBondContact O-CB 3.46Å; H221-C225 PolarHBondContact O-N 3.41Å
222	L	73.8	Confident	77.4	Confident	52 Å²	52	60.8 Å²	60.8	27%	0.272	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-33.7	179.9	-75.1	172.5	0	0	0	112.4	H206 L218 S219 E224 A228	H206-L222 VanDerWaalsContact CD2-CD2 3.45Å; H206-L222 WeakPolarHBondContact CD2-CD2 3.36Å; L218-L222 HydrophobicContact CD1-CD1 4.34Å; L218-L222 HydrophobicContact CD1-CG 4.21Å; L218-L222 HydrophobicContact CG-CD1 4.05Å; L218-L222 HydrophobicContact CG-CG 4.35Å; L218-L222 WeakPolarHBondContact O-CB 3.43Å; L218-L222 WeakPolarHBondContact O-CG 3.47Å; L218-L222 PolarHBondContact O-N 2.91Å; S219-L222 PolarHBondContact O-N 3.42Å; L222-E224 VanDerWaalsContact C-N 3.3Å; L222-E224 PolarHBondContact O-N 3.33Å; L222-A228 VanDerWaalsContact O-CB 3.23Å; L222-A228 WeakPolarHBondContact O-CB 3.44Å
223	S	70.8	Confident	77.9	Confident	82 Å²	82	59 Å²	59	57%	0.573	35%	0.348	S	S	*	.	H	α-helix	trans	-65.7	-32.3	174.4	42.9	0	0	0	0	113.5	S219 A220 H221 N245	S219-S223 PolarHBondContact O-N 2.98Å; S219-S223 PolarHBondContact O-OG 3.46Å; A220-S223 PolarHBondContact O-N 2.85Å; A220-S223 PolarHBondContact O-OG 3.2Å; H221-S223 VanDerWaalsContact C-N 3.29Å; H221-S223 PolarHBondContact O-N 3.23Å; S223-N245 PolarHBondContact O-ND2 3.34Å
224	E	70.1	Confident	78.3	Confident	162 Å²	162	61.1 Å²	61.1	76%	0.757	36%	0.356	S	S	*	.	H	α-helix	trans	-101.3	-5.3	-178	-61.7	-175	178.1	0	0	113.1	A220 H221 L222 V226	A220-E224 PolarHBondContact O-N 3.3Å; H221-E224 CarbonylContact O-C 3.51Å; H221-E224 PolarHBondContact O-N 2.88Å; H221-E224 VanDerWaalsContact O-N 3.13Å; L222-E224 VanDerWaalsContact C-N 3.3Å; L222-E224 PolarHBondContact O-N 3.33Å; E224-V226 PolarHBondContact O-N 2.88Å
225	C	77.3	Confident	78.6	Confident	4 Å²	4	63.5 Å²	63.5	3%	0.027	36%	0.364	C	S	.	.			trans	-62.7	124.4	-175.9	-176.5	0	0	0	0	109.9	H221 N227 A228 N245	H221-C225 WeakPolarHBondContact O-CA 3.45Å; H221-C225 VanDerWaalsContact O-CB 3.28Å; H221-C225 WeakPolarHBondContact O-CB 3.46Å; H221-C225 PolarHBondContact O-N 3.41Å; C225-N227 PolarHBondContact O-N 3.4Å; C225-N227 VanDerWaalsContact O-N 3.15Å; C225-A228 HydrophobicContact CB-CB 3.82Å; C225-A228 WeakPolarHBondContact O-CB 3.35Å; C225-A228 PolarHBondContact O-N 2.93Å; C225-N245 PolarHBondContact O-ND2 3.43Å
226	V	70.9	Confident	78.7	Confident	87 Å²	87	69.1 Å²	69.1	53%	0.527	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.6	-177.6	-178	0	0	0	0	111.9	E224 Q246	E224-V226 PolarHBondContact O-N 2.88Å; V226-Q246 HydrophobicContact CG1-CB 4.21Å
227	N	72.6	Confident	78.9	Confident	77 Å²	77	68.4 Å²	68.4	41%	0.412	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-1.8	-178.1	-64.4	-17.9	0	0	0	113.7	H206 C225	H206-N227 HydrophobicContact CB-CB 4.11Å; C225-N227 PolarHBondContact O-N 3.4Å; C225-N227 VanDerWaalsContact O-N 3.15Å
228	A	75.5	Confident	79.2	Confident	6 Å²	6	66.4 Å²	66.4	5%	0.05	38%	0.377	C	S	.	.	S	Bend	trans	-71.8	137.2	179.8	0	0	0	0	0	111	L222 C225 T244 N245	L222-A228 VanDerWaalsContact O-CB 3.23Å; L222-A228 WeakPolarHBondContact O-CB 3.44Å; C225-A228 HydrophobicContact CB-CB 3.82Å; C225-A228 WeakPolarHBondContact O-CB 3.35Å; C225-A228 PolarHBondContact O-N 2.93Å; A228-T244 WeakPolarHBondContact O-CA 3.44Å; A228-N245 PolarHBondContact O-N 3.41Å; A228-N245 VanDerWaalsContact O-N 3.16Å
229	P	78.5	Confident	79.7	Confident	100 Å²	100	65 Å²	65	65%	0.649	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.5	170.2	29	-32.4	0	0	0	109.4
230	S	81.1	Confident	80.3	Confident	41 Å²	41	67.3 Å²	67.3	29%	0.287	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	173.6	-176.2	-179	0	0	0	0	109.6	Q242 G243 N245 I248	S230-Q242 WeakPolarHBondContact O-CA 3.22Å; S230-G243 CarbonylContact C-O 3.58Å; S230-G243 PolarHBondContact N-O 2.9Å; S230-G243 PolarHBondContact O-N 3.37Å; S230-N245 WeakPolarHBondContact CB-OD1 3.16Å; S230-N245 PolarHBondContact OG-OD1 3.06Å; S230-I248 VanDerWaalsContact CB-CD1 3.44Å; S230-I248 WeakPolarHBondContact OG-CD1 3.35Å
231	T	86.2	Confident	80.8	Confident	52 Å²	52	68 Å²	68	32%	0.319	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.8	178.6	67.1	0	0	0	0	110.5	S233 K235 Q242 I248	T231-S233 PolarHBondContact O-N 2.8Å; T231-K235 HydrophobicContact CG2-CD 4.38Å; T231-Q242 HydrophobicContact CG2-CB 4.27Å; T231-Q242 HydrophobicContact CG2-CG 3.71Å; T231-I248 VanDerWaalsContact C-CD1 3.49Å
232	C	87.1	Confident	81.1	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.014	39%	0.394	C	S	.	.			trans	-56.4	140	-176.7	179.3	0	0	0	0	112.6	F234 K235 C239 F241 H259	C232-F234 PolarHBondContact O-N 3.48Å; C232-K235 VanDerWaalsContact O-CB 3.25Å; C232-K235 WeakPolarHBondContact O-CB 3.47Å; C232-K235 PolarHBondContact O-N 3.15Å; C232-C239 HydrophobicContact CB-CB 4.46Å; C232-F241 HydrophobicContact CB-CB 4.4Å; C232-F241 PolarHBondContact N-O 3.36Å; C232-F241 VanDerWaalsContact N-O 3.11Å; C232-H259 PolarHBondContact SG-CE1 3.03Å; C232-H259 PolarHBondContact SG-NE2 3.03Å
233	S	85.5	Confident	81.5	Confident	80 Å²	80	70.6 Å²	70.6	56%	0.559	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-23.8	179.4	-51.5	0	0	0	0	113.7	T231 K235 E252	T231-S233 PolarHBondContact O-N 2.8Å; S233-K235 VanDerWaalsContact C-N 3.33Å; S233-E252 WeakPolarHBondContact CB-OE1 3.36Å; S233-E252 PolarHBondContact OG-OE1 2.92Å
234	F	86.4	Confident	82.1	Confident	52 Å²	52	68.6 Å²	68.6	23%	0.228	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	8.3	178.5	-68.5	-94.4	0	0	0	114.2	C232 R236 Y237 G238 C239 H259 L263	C232-F234 PolarHBondContact O-N 3.48Å; F234-R236 VanDerWaalsContact C-N 3.26Å; F234-R236 PolarHBondContact O-N 2.95Å; F234-Y237 HydrophobicContact CB-CD2 4.36Å; F234-Y237 AromaticContact CD1-CD2 3.73Å; F234-Y237 HydrophobicContact CD1-CD2 3.73Å; F234-Y237 HydrophobicContact CD1-CE2 4.26Å; F234-Y237 HydrophobicContact CE1-CD2 4.5Å; F234-Y237 HydrophobicContact CG-CD2 4.4Å; F234-Y237 CarbonylContact O-C 3.56Å; F234-Y237 WeakPolarHBondContact O-CA 3.43Å; F234-Y237 PolarHBondContact O-N 2.79Å; F234-G238 PolarHBondContact O-N 3.39Å; F234-C239 HydrophobicContact CB-CB 3.82Å; F234-C239 WeakPolarHBondContact O-CB 3.48Å; F234-C239 PolarHBondContact O-N 3.45Å; F234-C239 VanDerWaalsContact O-N 3.15Å; F234-H259 HydrophobicContact CB-CB 4.44Å; F234-H259 HydrophobicContact CD1-CB 3.64Å; F234-H259 HydrophobicContact CD2-CB 3.94Å; F234-H259 AromaticContact CD2-CE1 3.81Å; F234-H259 AromaticContact CD2-CG 3.53Å; F234-H259 AromaticContact CD2-ND1 3.37Å; F234-H259 WeakPolarHBondContact CD2-ND1 3.26Å; F234-H259 HydrophobicContact CE1-CB 3.75Å; F234-H259 HydrophobicContact CE2-CB 4.05Å; F234-H259 AromaticContact CE2-CG 3.99Å; F234-H259 AromaticContact CE2-ND1 3.7Å; F234-H259 HydrophobicContact CG-CB 3.73Å; F234-H259 AromaticContact CG-CD2 3.81Å; F234-H259 AromaticContact CG-CG 3.55Å; F234-H259 AromaticContact CG-ND1 3.9Å; F234-H259 HydrophobicContact CZ-CB 3.96Å; F234-L263 HydrophobicContact CD1-CD2 4.45Å; F234-L263 HydrophobicContact CD1-CG 4.27Å; F234-L263 HydrophobicContact CE1-CD1 3.76Å; F234-L263 HydrophobicContact CE1-CD2 4.21Å; F234-L263 HydrophobicContact CE1-CG 3.87Å
235	K	86	Confident	82.5	Confident	107 Å²	107	62.4 Å²	62.4	47%	0.465	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-55.4	-39.5	178.1	-179.1	175.2	178.5	179.4	0	113.2	T231 C232 S233 Y237 G238 C239	T231-K235 HydrophobicContact CG2-CD 4.38Å; C232-K235 VanDerWaalsContact O-CB 3.25Å; C232-K235 WeakPolarHBondContact O-CB 3.47Å; C232-K235 PolarHBondContact O-N 3.15Å; S233-K235 VanDerWaalsContact C-N 3.33Å; K235-Y237 PolarHBondContact O-N 3.45Å; K235-G238 PolarHBondContact O-N 3.08Å; K235-C239 VanDerWaalsContact CA-O 3.29Å; K235-C239 WeakPolarHBondContact CA-O 3.4Å
236	R	83.4	Confident	82.5	Confident	185 Å²	185	68.4 Å²	68.4	70%	0.698	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-62.2	-20.9	176.1	67.3	-178.9	175.5	-175.1	0.1	114.1	F234	F234-R236 VanDerWaalsContact C-N 3.26Å; F234-R236 PolarHBondContact O-N 2.95Å
237	Y	84.3	Confident	82.9	Confident	49 Å²	49	69.4 Å²	69.4	19%	0.192	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-100.8	-1	177.4	-52.4	-67.5	0	0	0	112.5	F234 K235 L263 W266	F234-Y237 HydrophobicContact CB-CD2 4.36Å; F234-Y237 AromaticContact CD1-CD2 3.73Å; F234-Y237 HydrophobicContact CD1-CD2 3.73Å; F234-Y237 HydrophobicContact CD1-CE2 4.26Å; F234-Y237 HydrophobicContact CE1-CD2 4.5Å; F234-Y237 HydrophobicContact CG-CD2 4.4Å; F234-Y237 CarbonylContact O-C 3.56Å; F234-Y237 WeakPolarHBondContact O-CA 3.43Å; F234-Y237 PolarHBondContact O-N 2.79Å; K235-Y237 PolarHBondContact O-N 3.45Å; Y237-L263 HydrophobicContact CD1-CD2 3.97Å; Y237-L263 HydrophobicContact CD2-CD2 3.69Å; Y237-L263 HydrophobicContact CE1-CD2 3.78Å; Y237-L263 HydrophobicContact CE2-CD2 3.48Å; Y237-L263 VanDerWaalsContact CE2-CD2 3.48Å; Y237-L263 HydrophobicContact CG-CD2 3.92Å; Y237-W266 HydrophobicContact CD1-CB 3.89Å; Y237-W266 AromaticContact CD1-CD1 3.82Å; Y237-W266 AromaticContact CD1-CD2 3.95Å; Y237-W266 HydrophobicContact CD1-CD2 3.95Å; Y237-W266 AromaticContact CD1-CG 3.58Å; Y237-W266 HydrophobicContact CD1-CG 3.58Å; Y237-W266 HydrophobicContact CE1-CB 4.48Å; Y237-W266 AromaticContact CE1-CD1 3.61Å; Y237-W266 HydrophobicContact CE1-CD2 4.32Å; Y237-W266 AromaticContact CE1-CG 3.88Å; Y237-W266 HydrophobicContact CE1-CG 3.88Å; Y237-W266 AromaticContact CE1-NE1 3.88Å
238	G	83.8	Confident	83.5	Confident	48 Å²	48	66.1 Å²	66.1	50%	0.495	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	117.5	3.7	175.2	0	0	0	0	0	116.2	F234 K235	F234-G238 PolarHBondContact O-N 3.39Å; K235-G238 PolarHBondContact O-N 3.08Å
239	C	88.9	Confident	83.8	Confident	6 Å²	6	73.5 Å²	73.5	4%	0.041	38%	0.384	C	S	.	.			trans	-74	129.2	176.8	-174	0	0	0	0	111.9	C232 F234 K235 H259 L262	C232-C239 HydrophobicContact CB-CB 4.46Å; F234-C239 HydrophobicContact CB-CB 3.82Å; F234-C239 WeakPolarHBondContact O-CB 3.48Å; F234-C239 PolarHBondContact O-N 3.45Å; F234-C239 VanDerWaalsContact O-N 3.15Å; K235-C239 VanDerWaalsContact CA-O 3.29Å; K235-C239 WeakPolarHBondContact CA-O 3.4Å; C239-H259 PolarHBondContact SG-NE2 3.19Å; C239-L262 HydrophobicContact CB-CD1 4.18Å
240	V	87.6	Confident	83.9	Confident	134 Å²	134	71.8 Å²	71.8	81%	0.812	38%	0.378	S	S	*	.			trans	-98.7	-3.1	-174.9	-62.7	0	0	0	0	114.4
241	F	87.1	Confident	84.1	Confident	69 Å²	69	70.8 Å²	70.8	30%	0.303	37%	0.369	S	S	.	.			trans	-69	133.2	-174.5	-173.6	-95.5	0	0	0	112.8	C232 Q247 I248 H251	C232-F241 HydrophobicContact CB-CB 4.4Å; C232-F241 PolarHBondContact N-O 3.36Å; C232-F241 VanDerWaalsContact N-O 3.11Å; F241-Q247 HydrophobicContact CZ-CB 4.44Å; F241-I248 HydrophobicContact CD1-CG1 4.27Å; F241-I248 HydrophobicContact CE1-CG1 4.06Å; F241-H251 HydrophobicContact CD1-CB 3.65Å; F241-H251 AromaticContact CD1-CD2 3.68Å; F241-H251 AromaticContact CD1-CG 3.38Å; F241-H251 AromaticContact CD1-ND1 3.81Å; F241-H251 AromaticContact CD2-ND1 3.63Å; F241-H251 HydrophobicContact CE1-CB 3.46Å; F241-H251 VanDerWaalsContact CE1-CB 3.46Å; F241-H251 AromaticContact CE1-CG 3.76Å; F241-H251 HydrophobicContact CE2-CB 4.39Å; F241-H251 HydrophobicContact CG-CB 4.21Å; F241-H251 AromaticContact CG-CD2 3.89Å; F241-H251 AromaticContact CG-CE1 3.74Å; F241-H251 AromaticContact CG-CG 3.55Å; F241-H251 AromaticContact CG-ND1 3.44Å; F241-H251 WeakPolarHBondContact CG-ND1 3.4Å; F241-H251 HydrophobicContact CZ-CB 3.87Å
242	Q	85.8	Confident	84	Confident	125 Å²	125	71.2 Å²	71.2	58%	0.584	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.4	175.8	-51	-171.8	-2.8	0	0	108.8	S230 T231	S230-Q242 WeakPolarHBondContact O-CA 3.22Å; T231-Q242 HydrophobicContact CG2-CB 4.27Å; T231-Q242 HydrophobicContact CG2-CG 3.71Å
243	G	83.5	Confident	83.7	Confident	14 Å²	14	75.1 Å²	75.1	14%	0.144	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	-176.3	-177.4	0	0	0	0	0	110.9	S230	S230-G243 CarbonylContact C-O 3.58Å; S230-G243 PolarHBondContact N-O 2.9Å; S230-G243 PolarHBondContact O-N 3.37Å
244	T	82.9	Confident	83.7	Confident	40 Å²	40	75.8 Å²	75.8	25%	0.245	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	157.6	172.1	57.1	0	0	0	0	111.3	A228 Q246 Q247 I248	A228-T244 WeakPolarHBondContact O-CA 3.44Å; T244-Q246 PolarHBondContact O-N 3.43Å; T244-Q246 VanDerWaalsContact O-N 3.08Å; T244-Q247 WeakPolarHBondContact O-CA 3.39Å; T244-Q247 PolarHBondContact O-N 2.96Å; T244-Q247 VanDerWaalsContact OG1-CD 3.31Å; T244-Q247 VanDerWaalsContact OG1-CG 3.28Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.28Å; T244-Q247 PolarHBondContact OG1-N 3.15Å; T244-Q247 PolarHBondContact OG1-OE1 3.03Å; T244-I248 PolarHBondContact O-N 3.3Å
245	N	78.1	Confident	83.7	Confident	32 Å²	32	74.3 Å²	74.3	17%	0.171	40%	0.4	C	S	.	.	H	α-helix	trans	-52.2	-32.5	174.2	-84.9	-25.5	0	0	0	113	S223 C225 A228 S230 K249	S223-N245 PolarHBondContact O-ND2 3.34Å; C225-N245 PolarHBondContact O-ND2 3.43Å; A228-N245 PolarHBondContact O-N 3.41Å; A228-N245 VanDerWaalsContact O-N 3.16Å; S230-N245 WeakPolarHBondContact CB-OD1 3.16Å; S230-N245 PolarHBondContact OG-OD1 3.06Å; N245-K249 WeakPolarHBondContact O-CG 3.43Å; N245-K249 PolarHBondContact O-N 3.15Å
246	Q	76.8	Confident	83.7	Confident	131 Å²	131	71.6 Å²	71.6	61%	0.612	40%	0.398	S	S	*	.	H	α-helix	trans	-68.3	-44.9	172.8	-171.5	177	6.6	0	0	112.9	V226 T244 I248 K249 A250	V226-Q246 HydrophobicContact CG1-CB 4.21Å; T244-Q246 PolarHBondContact O-N 3.43Å; T244-Q246 VanDerWaalsContact O-N 3.08Å; Q246-I248 VanDerWaalsContact C-N 3.32Å; Q246-I248 PolarHBondContact O-N 3.04Å; Q246-K249 PolarHBondContact O-N 3.01Å; Q246-A250 PolarHBondContact O-N 2.88Å
247	Q	80.8	Confident	84	Confident	107 Å²	107	68.3 Å²	68.3	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-67.3	-32.5	178.2	-72.5	165.2	-36.7	0	0	112.3	F241 T244 A250 H251	F241-Q247 HydrophobicContact CZ-CB 4.44Å; T244-Q247 WeakPolarHBondContact O-CA 3.39Å; T244-Q247 PolarHBondContact O-N 2.96Å; T244-Q247 VanDerWaalsContact OG1-CD 3.31Å; T244-Q247 VanDerWaalsContact OG1-CG 3.28Å; T244-Q247 WeakPolarHBondContact OG1-CG 3.28Å; T244-Q247 PolarHBondContact OG1-N 3.15Å; T244-Q247 PolarHBondContact OG1-OE1 3.03Å; Q247-A250 PolarHBondContact O-N 2.78Å; Q247-H251 WeakPolarHBondContact O-CB 3.32Å; Q247-H251 PolarHBondContact O-N 2.95Å
248	I	84.7	Confident	84.1	Confident	8 Å²	8	71.2 Å²	71.2	4%	0.041	41%	0.413	C	S	.	.	H	α-helix	trans	-67	-42.8	175.8	-69.8	-178.2	0	0	0	111.6	S230 T231 F241 T244 Q246 A250 H251 E252	S230-I248 VanDerWaalsContact CB-CD1 3.44Å; S230-I248 WeakPolarHBondContact OG-CD1 3.35Å; T231-I248 VanDerWaalsContact C-CD1 3.49Å; F241-I248 HydrophobicContact CD1-CG1 4.27Å; F241-I248 HydrophobicContact CE1-CG1 4.06Å; T244-I248 PolarHBondContact O-N 3.3Å; Q246-I248 VanDerWaalsContact C-N 3.32Å; Q246-I248 PolarHBondContact O-N 3.04Å; I248-A250 PolarHBondContact O-N 2.8Å; I248-H251 PolarHBondContact O-N 3.24Å; I248-H251 VanDerWaalsContact O-N 3.13Å; I248-E252 HydrophobicContact CG2-CG 4Å; I248-E252 WeakPolarHBondContact O-CB 3.3Å; I248-E252 WeakPolarHBondContact O-CG 3.36Å; I248-E252 PolarHBondContact O-N 3.16Å
249	K	80.7	Confident	84.5	Confident	161 Å²	161	69.1 Å²	69.1	70%	0.7	39%	0.391	S	S	*	.	H	α-helix	trans	-58.7	-38.2	176	-74.4	-178.5	180	-177.5	0	111.8	N245 Q246 A253	N245-K249 WeakPolarHBondContact O-CG 3.43Å; N245-K249 PolarHBondContact O-N 3.15Å; Q246-K249 PolarHBondContact O-N 3.01Å; K249-A253 PolarHBondContact O-N 3.04Å
250	A	81.9	Confident	84.5	Confident	64 Å²	64	73.1 Å²	73.1	53%	0.529	42%	0.415	S	S	.	.	H	α-helix	trans	-67.7	-45.6	173.9	0	0	0	0	0	112.2	Q246 Q247 I248 A253 S254	Q246-A250 PolarHBondContact O-N 2.88Å; Q247-A250 PolarHBondContact O-N 2.78Å; I248-A250 PolarHBondContact O-N 2.8Å; A250-A253 PolarHBondContact O-N 3.45Å; A250-S254 PolarHBondContact O-N 2.98Å; A250-S254 VanDerWaalsContact O-N 3.13Å; A250-S254 PolarHBondContact O-OG 2.91Å
251	H	85.8	Confident	84.6	Confident	21 Å²	21	70.9 Å²	70.9	10%	0.097	40%	0.399	C	S	.	.	H	α-helix	trans	-60.8	-44.4	177	169.3	80.5	0	0	0	112.9	F241 Q247 I248 A253 S254 S255 H259	F241-H251 HydrophobicContact CD1-CB 3.65Å; F241-H251 AromaticContact CD1-CD2 3.68Å; F241-H251 AromaticContact CD1-CG 3.38Å; F241-H251 AromaticContact CD1-ND1 3.81Å; F241-H251 AromaticContact CD2-ND1 3.63Å; F241-H251 HydrophobicContact CE1-CB 3.46Å; F241-H251 VanDerWaalsContact CE1-CB 3.46Å; F241-H251 AromaticContact CE1-CG 3.76Å; F241-H251 HydrophobicContact CE2-CB 4.39Å; F241-H251 HydrophobicContact CG-CB 4.21Å; F241-H251 AromaticContact CG-CD2 3.89Å; F241-H251 AromaticContact CG-CE1 3.74Å; F241-H251 AromaticContact CG-CG 3.55Å; F241-H251 AromaticContact CG-ND1 3.44Å; F241-H251 WeakPolarHBondContact CG-ND1 3.4Å; F241-H251 HydrophobicContact CZ-CB 3.87Å; Q247-H251 WeakPolarHBondContact O-CB 3.32Å; Q247-H251 PolarHBondContact O-N 2.95Å; I248-H251 PolarHBondContact O-N 3.24Å; I248-H251 VanDerWaalsContact O-N 3.13Å; H251-A253 VanDerWaalsContact C-N 3.26Å; H251-A253 PolarHBondContact O-N 3.21Å; H251-S254 WeakPolarHBondContact CA-OG 3.46Å; H251-S254 PolarHBondContact O-N 3.32Å; H251-S254 PolarHBondContact O-OG 2.86Å; H251-S254 VanDerWaalsContact O-OG 3.12Å; H251-S255 PolarHBondContact CE1-OG 3.42Å; H251-S255 VanDerWaalsContact CE1-OG 3.28Å; H251-S255 PolarHBondContact ND1-OG 3.22Å; H251-S255 VanDerWaalsContact O-CB 3.31Å; H251-S255 WeakPolarHBondContact O-CB 3.46Å; H251-S255 PolarHBondContact O-N 2.75Å; H251-S255 PolarHBondContact O-OG 3.37Å; H251-H259 AromaticContact CD2-CE1 3.89Å; H251-H259 AromaticContact NE2-CE1 3.46Å; H251-H259 PolarHBondContact NE2-CE1 2.57Å; H251-H259 AromaticContact NE2-NE2 3.25Å; H251-H259 PolarHBondContact NE2-NE2 2.7Å
252	E	82.4	Confident	84.7	Confident	61 Å²	61	69 Å²	69	29%	0.285	39%	0.391	S	S	.	.	H	α-helix	trans	-62.6	-34.3	178.9	-73.8	-178.4	161.4	0	0	112	S233 I248	S233-E252 WeakPolarHBondContact CB-OE1 3.36Å; S233-E252 PolarHBondContact OG-OE1 2.92Å; I248-E252 HydrophobicContact CG2-CG 4Å; I248-E252 WeakPolarHBondContact O-CB 3.3Å; I248-E252 WeakPolarHBondContact O-CG 3.36Å; I248-E252 PolarHBondContact O-N 3.16Å
253	A	81.1	Confident	84.9	Confident	83 Å²	83	66 Å²	66	69%	0.686	38%	0.379	S	S	*	.	H	α-helix	trans	-71.2	-37.3	174.2	0	0	0	0	0	112.9	K249 A250 H251	K249-A253 PolarHBondContact O-N 3.04Å; A250-A253 PolarHBondContact O-N 3.45Å; H251-A253 VanDerWaalsContact C-N 3.26Å; H251-A253 PolarHBondContact O-N 3.21Å
254	S	85.5	Confident	85.2	Confident	94 Å²	94	71.8 Å²	71.8	66%	0.657	40%	0.4	S	S	*	.	H	α-helix	trans	-84.4	-25.4	-178.1	58	0	0	0	0	114.7	A250 H251	A250-S254 PolarHBondContact O-N 2.98Å; A250-S254 VanDerWaalsContact O-N 3.13Å; A250-S254 PolarHBondContact O-OG 2.91Å; H251-S254 WeakPolarHBondContact CA-OG 3.46Å; H251-S254 PolarHBondContact O-N 3.32Å; H251-S254 PolarHBondContact O-OG 2.86Å; H251-S254 VanDerWaalsContact O-OG 3.12Å
255	S	87.1	Confident	85.5	Confident	21 Å²	21	76.1 Å²	76.1	15%	0.147	42%	0.418	C	S	.	.	S	Bend	trans	-108.9	17.4	-171.1	-61.9	0	0	0	0	114.2	H251 V257 Q258 H259	H251-S255 PolarHBondContact CE1-OG 3.42Å; H251-S255 VanDerWaalsContact CE1-OG 3.28Å; H251-S255 PolarHBondContact ND1-OG 3.22Å; H251-S255 VanDerWaalsContact O-CB 3.31Å; H251-S255 WeakPolarHBondContact O-CB 3.46Å; H251-S255 PolarHBondContact O-N 2.75Å; H251-S255 PolarHBondContact O-OG 3.37Å; S255-V257 VanDerWaalsContact C-N 3.34Å; S255-V257 PolarHBondContact O-N 2.93Å; S255-Q258 WeakPolarHBondContact O-CB 3.22Å; S255-Q258 PolarHBondContact O-N 3.18Å; S255-Q258 VanDerWaalsContact O-N 3.13Å; S255-H259 PolarHBondContact O-N 3Å; S255-H259 VanDerWaalsContact O-N 3.09Å
256	A	86.1	Confident	86.1	Confident	51 Å²	51	80 Å²	80	42%	0.421	43%	0.43	S	S	.	.	H	α-helix	trans	-54.2	-43.4	-176.7	0	0	0	0	0	113.7	Q258 H259 V260	A256-Q258 PolarHBondContact O-N 3.29Å; A256-H259 PolarHBondContact O-N 3.48Å; A256-V260 WeakPolarHBondContact O-CG2 3.44Å; A256-V260 PolarHBondContact O-N 2.74Å
257	V	88.4	Confident	86.8	Confident	115 Å²	115	76.3 Å²	76.3	70%	0.697	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-41.8	179.2	179.1	0	0	0	0	111.7	S255 V260 N261	S255-V257 VanDerWaalsContact C-N 3.34Å; S255-V257 PolarHBondContact O-N 2.93Å; V257-V260 PolarHBondContact O-N 3.26Å; V257-N261 PolarHBondContact O-N 3.02Å; V257-N261 VanDerWaalsContact O-N 3.15Å; V257-N261 PolarHBondContact O-ND2 2.98Å
258	Q	87.8	Confident	87.3	Confident	110 Å²	110	74.8 Å²	74.8	51%	0.514	41%	0.414	S	S	.	.	H	α-helix	trans	-63.9	-42.1	177	-173.6	-178.9	3.5	0	0	111.1	S255 A256 V260 N261 L262	S255-Q258 WeakPolarHBondContact O-CB 3.22Å; S255-Q258 PolarHBondContact O-N 3.18Å; S255-Q258 VanDerWaalsContact O-N 3.13Å; A256-Q258 PolarHBondContact O-N 3.29Å; Q258-V260 PolarHBondContact O-N 3.05Å; Q258-N261 PolarHBondContact O-N 2.77Å; Q258-L262 WeakPolarHBondContact O-CG 3.46Å; Q258-L262 PolarHBondContact O-N 2.86Å; Q258-L262 VanDerWaalsContact O-N 3.12Å
259	H	90.9	Very high	87.5	Confident	4 Å²	4	76.8 Å²	76.8	2%	0.019	43%	0.429	C	S	.	.	H	α-helix	trans	-64	-38.5	177.2	-66.2	160.1	0	0	0	112.9	C232 F234 C239 H251 S255 A256 N261 L262 L263	C232-H259 PolarHBondContact SG-CE1 3.03Å; C232-H259 PolarHBondContact SG-NE2 3.03Å; F234-H259 HydrophobicContact CB-CB 4.44Å; F234-H259 HydrophobicContact CD1-CB 3.64Å; F234-H259 HydrophobicContact CD2-CB 3.94Å; F234-H259 AromaticContact CD2-CE1 3.81Å; F234-H259 AromaticContact CD2-CG 3.53Å; F234-H259 AromaticContact CD2-ND1 3.37Å; F234-H259 WeakPolarHBondContact CD2-ND1 3.26Å; F234-H259 HydrophobicContact CE1-CB 3.75Å; F234-H259 HydrophobicContact CE2-CB 4.05Å; F234-H259 AromaticContact CE2-CG 3.99Å; F234-H259 AromaticContact CE2-ND1 3.7Å; F234-H259 HydrophobicContact CG-CB 3.73Å; F234-H259 AromaticContact CG-CD2 3.81Å; F234-H259 AromaticContact CG-CG 3.55Å; F234-H259 AromaticContact CG-ND1 3.9Å; F234-H259 HydrophobicContact CZ-CB 3.96Å; C239-H259 PolarHBondContact SG-NE2 3.19Å; H251-H259 AromaticContact CD2-CE1 3.89Å; H251-H259 AromaticContact NE2-CE1 3.46Å; H251-H259 PolarHBondContact NE2-CE1 2.57Å; H251-H259 AromaticContact NE2-NE2 3.25Å; H251-H259 PolarHBondContact NE2-NE2 2.7Å; S255-H259 PolarHBondContact O-N 3Å; S255-H259 VanDerWaalsContact O-N 3.09Å; A256-H259 PolarHBondContact O-N 3.48Å; H259-N261 VanDerWaalsContact C-N 3.34Å; H259-L262 PolarHBondContact O-N 3.37Å; H259-L263 WeakPolarHBondContact O-CG 3.38Å; H259-L263 PolarHBondContact O-N 3.48Å
260	V	89.9	Confident	88	Confident	91 Å²	91	73.4 Å²	73.4	55%	0.552	42%	0.418	S	S	*	.	H	α-helix	trans	-64	-39	174.9	171.8	0	0	0	0	111.5	A256 V257 Q258 L263 K264	A256-V260 WeakPolarHBondContact O-CG2 3.44Å; A256-V260 PolarHBondContact O-N 2.74Å; V257-V260 PolarHBondContact O-N 3.26Å; Q258-V260 PolarHBondContact O-N 3.05Å; V260-L263 WeakPolarHBondContact O-CB 3.35Å; V260-L263 PolarHBondContact O-N 3.23Å; V260-K264 PolarHBondContact O-N 3.12Å
261	N	88.5	Confident	88.5	Confident	87 Å²	87	76.2 Å²	76.2	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-64.7	-41.7	175.7	-73.6	-28.1	0	0	0	112.3	V257 Q258 H259 L263 K264 E265	V257-N261 PolarHBondContact O-N 3.02Å; V257-N261 VanDerWaalsContact O-N 3.15Å; V257-N261 PolarHBondContact O-ND2 2.98Å; Q258-N261 PolarHBondContact O-N 2.77Å; H259-N261 VanDerWaalsContact C-N 3.34Å; N261-L263 VanDerWaalsContact C-N 3.32Å; N261-L263 PolarHBondContact O-N 3.33Å; N261-K264 WeakPolarHBondContact O-CB 3.31Å; N261-K264 PolarHBondContact O-N 3.15Å; N261-E265 PolarHBondContact O-N 3.23Å
262	L	90.6	Very high	88.9	Confident	29 Å²	29	82.5 Å²	82.5	15%	0.152	45%	0.447	C	S	.	.	H	α-helix	trans	-61.7	-39.4	174.3	-67.5	175.5	0	0	0	112.1	C239 Q258 H259 E265 W266	C239-L262 HydrophobicContact CB-CD1 4.18Å; Q258-L262 WeakPolarHBondContact O-CG 3.46Å; Q258-L262 PolarHBondContact O-N 2.86Å; Q258-L262 VanDerWaalsContact O-N 3.12Å; H259-L262 PolarHBondContact O-N 3.37Å; L262-E265 PolarHBondContact O-N 3.46Å; L262-W266 WeakPolarHBondContact O-CB 3.45Å; L262-W266 PolarHBondContact O-N 3.23Å
263	L	89.5	Confident	89.4	Confident	63 Å²	63	84.8 Å²	84.8	33%	0.33	46%	0.456	S	S	.	.	H	α-helix	trans	-63	-40.7	173.9	-74.8	179.3	0	0	0	112.3	F234 Y237 H259 V260 N261 W266 S267	F234-L263 HydrophobicContact CD1-CD2 4.45Å; F234-L263 HydrophobicContact CD1-CG 4.27Å; F234-L263 HydrophobicContact CE1-CD1 3.76Å; F234-L263 HydrophobicContact CE1-CD2 4.21Å; F234-L263 HydrophobicContact CE1-CG 3.87Å; Y237-L263 HydrophobicContact CD1-CD2 3.97Å; Y237-L263 HydrophobicContact CD2-CD2 3.69Å; Y237-L263 HydrophobicContact CE1-CD2 3.78Å; Y237-L263 HydrophobicContact CE2-CD2 3.48Å; Y237-L263 VanDerWaalsContact CE2-CD2 3.48Å; Y237-L263 HydrophobicContact CG-CD2 3.92Å; H259-L263 WeakPolarHBondContact O-CG 3.38Å; H259-L263 PolarHBondContact O-N 3.48Å; V260-L263 WeakPolarHBondContact O-CB 3.35Å; V260-L263 PolarHBondContact O-N 3.23Å; N261-L263 VanDerWaalsContact C-N 3.32Å; N261-L263 PolarHBondContact O-N 3.33Å; L263-W266 PolarHBondContact O-N 3.16Å; L263-S267 WeakPolarHBondContact O-CB 3.2Å; L263-S267 PolarHBondContact O-N 3.03Å
264	K	90.6	Very high	90.1	Very high	134 Å²	134	84.5 Å²	84.5	58%	0.583	45%	0.446	S	S	*	.	H	α-helix	trans	-62.2	-47.1	177.2	-178.1	-175.6	177.4	-177.1	0	111.5	V260 N261 W266 S267 N268	V260-K264 PolarHBondContact O-N 3.12Å; N261-K264 WeakPolarHBondContact O-CB 3.31Å; N261-K264 PolarHBondContact O-N 3.15Å; K264-W266 VanDerWaalsContact C-N 3.34Å; K264-W266 PolarHBondContact O-N 3.02Å; K264-S267 PolarHBondContact O-N 3.45Å; K264-N268 VanDerWaalsContact O-CG 3.3Å; K264-N268 PolarHBondContact O-N 3.06Å; K264-N268 PolarHBondContact O-ND2 3.46Å
265	E	89.1	Confident	90.5	Very high	132 Å²	132	83 Å²	83	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-62.1	-42.7	177.2	-71.3	178.3	179.3	0	0	111.9	N261 L262 N268 S269	N261-E265 PolarHBondContact O-N 3.23Å; L262-E265 PolarHBondContact O-N 3.46Å; E265-N268 PolarHBondContact O-N 3.41Å; E265-S269 PolarHBondContact O-N 3.02Å
266	W	90.5	Very high	90.8	Very high	113 Å²	113	87.1 Å²	87.1	43%	0.428	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175	-175.5	-95.1	0	0	0	112.4	Y237 L262 L263 K264 N268 S269 L270	Y237-W266 HydrophobicContact CD1-CB 3.89Å; Y237-W266 AromaticContact CD1-CD1 3.82Å; Y237-W266 AromaticContact CD1-CD2 3.95Å; Y237-W266 HydrophobicContact CD1-CD2 3.95Å; Y237-W266 AromaticContact CD1-CG 3.58Å; Y237-W266 HydrophobicContact CD1-CG 3.58Å; Y237-W266 HydrophobicContact CE1-CB 4.48Å; Y237-W266 AromaticContact CE1-CD1 3.61Å; Y237-W266 HydrophobicContact CE1-CD2 4.32Å; Y237-W266 AromaticContact CE1-CG 3.88Å; Y237-W266 HydrophobicContact CE1-CG 3.88Å; Y237-W266 AromaticContact CE1-NE1 3.88Å; L262-W266 WeakPolarHBondContact O-CB 3.45Å; L262-W266 PolarHBondContact O-N 3.23Å; L263-W266 PolarHBondContact O-N 3.16Å; K264-W266 VanDerWaalsContact C-N 3.34Å; K264-W266 PolarHBondContact O-N 3.02Å; W266-N268 PolarHBondContact O-N 3.44Å; W266-S269 WeakPolarHBondContact O-CB 3.45Å; W266-S269 PolarHBondContact O-N 2.89Å; W266-S269 VanDerWaalsContact O-N 3.17Å; W266-L270 WeakPolarHBondContact O-CB 3.04Å; W266-L270 PolarHBondContact O-N 2.71Å
267	S	90	Very high	91.1	Very high	54 Å²	54	89.8 Å²	89.8	38%	0.378	46%	0.462	S	S	.	.	H	α-helix	trans	-58.9	-47.4	176.3	-165.6	0	0	0	0	111.4	L263 K264 S269 L270 E271	L263-S267 WeakPolarHBondContact O-CB 3.2Å; L263-S267 PolarHBondContact O-N 3.03Å; K264-S267 PolarHBondContact O-N 3.45Å; S267-S269 VanDerWaalsContact C-N 3.28Å; S267-S269 PolarHBondContact O-N 2.93Å; S267-L270 WeakPolarHBondContact O-CB 3.49Å; S267-L270 PolarHBondContact O-N 2.78Å; S267-L270 VanDerWaalsContact O-N 3.11Å; S267-E271 WeakPolarHBondContact O-CG 3.43Å; S267-E271 PolarHBondContact O-N 2.89Å
268	N	91.3	Very high	91.4	Very high	75 Å²	75	90.5 Å²	90.5	40%	0.401	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-37.1	176.3	-66.3	-16.3	0	0	0	112.2	K264 E265 W266 K272	K264-N268 VanDerWaalsContact O-CG 3.3Å; K264-N268 PolarHBondContact O-N 3.06Å; K264-N268 PolarHBondContact O-ND2 3.46Å; E265-N268 PolarHBondContact O-N 3.41Å; W266-N268 PolarHBondContact O-N 3.44Å; N268-K272 WeakPolarHBondContact O-CG 3.35Å; N268-K272 PolarHBondContact O-N 3.07Å
269	S	89.9	Confident	91.7	Very high	49 Å²	49	89.7 Å²	89.7	34%	0.343	46%	0.457	S	S	.	.	H	α-helix	trans	-66.8	-40	174.9	-170.2	0	0	0	0	111.8	E265 W266 S267 K272 K273	E265-S269 PolarHBondContact O-N 3.02Å; W266-S269 WeakPolarHBondContact O-CB 3.45Å; W266-S269 PolarHBondContact O-N 2.89Å; W266-S269 VanDerWaalsContact O-N 3.17Å; S267-S269 VanDerWaalsContact C-N 3.28Å; S267-S269 PolarHBondContact O-N 2.93Å; S269-K272 PolarHBondContact O-N 3.04Å; S269-K273 PolarHBondContact O-N 3.12Å; S269-K273 VanDerWaalsContact O-N 3.09Å
270	L	90.6	Very high	91.8	Very high	90 Å²	90	94.9 Å²	94.9	47%	0.471	48%	0.481	S	S	.	.	H	α-helix	trans	-66.5	-44.4	178.8	-169.6	67.3	0	0	0	111.4	W266 S267 K272 K273 V274	W266-L270 WeakPolarHBondContact O-CB 3.04Å; W266-L270 PolarHBondContact O-N 2.71Å; S267-L270 WeakPolarHBondContact O-CB 3.49Å; S267-L270 PolarHBondContact O-N 2.78Å; S267-L270 VanDerWaalsContact O-N 3.11Å; L270-K272 VanDerWaalsContact C-N 3.29Å; L270-K272 PolarHBondContact O-N 3.02Å; L270-K273 PolarHBondContact O-N 3.46Å; L270-K273 VanDerWaalsContact O-N 3.1Å; L270-V274 WeakPolarHBondContact O-CG2 3.37Å; L270-V274 PolarHBondContact O-N 3.27Å
271	E	93.6	Very high	92	Very high	123 Å²	123	93.7 Å²	93.7	58%	0.575	48%	0.476	S	S	*	.	H	α-helix	trans	-56.2	-43.3	175.2	-75.1	172.5	-168.7	0	0	111.8	S267 V274 S275	S267-E271 WeakPolarHBondContact O-CG 3.43Å; S267-E271 PolarHBondContact O-N 2.89Å; E271-V274 PolarHBondContact O-N 2.83Å; E271-S275 PolarHBondContact O-N 3.4Å
272	K	93.1	Very high	92.3	Very high	153 Å²	153	92.9 Å²	92.9	67%	0.665	47%	0.474	S	S	*	.	H	α-helix	trans	-61.5	-44.8	174.7	-71.8	176.5	-178	-178.4	0	112.2	N268 S269 L270 S275 L276	N268-K272 WeakPolarHBondContact O-CG 3.35Å; N268-K272 PolarHBondContact O-N 3.07Å; S269-K272 PolarHBondContact O-N 3.04Å; L270-K272 VanDerWaalsContact C-N 3.29Å; L270-K272 PolarHBondContact O-N 3.02Å; K272-S275 PolarHBondContact O-N 3.09Å; K272-L276 WeakPolarHBondContact O-CG 3.27Å; K272-L276 PolarHBondContact O-N 2.83Å
273	K	93.4	Very high	92.5	Very high	110 Å²	110	97.7 Å²	97.7	48%	0.478	50%	0.496	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178.1	-75.1	179.3	179.8	176.7	0	112.1	S269 L270 L276 L277	S269-K273 PolarHBondContact O-N 3.12Å; S269-K273 VanDerWaalsContact O-N 3.09Å; L270-K273 PolarHBondContact O-N 3.46Å; L270-K273 VanDerWaalsContact O-N 3.1Å; K273-L276 PolarHBondContact O-N 2.87Å; K273-L277 WeakPolarHBondContact O-CG 3.33Å; K273-L277 PolarHBondContact O-N 2.97Å
274	V	94.9	Very high	92.6	Very high	77 Å²	77	101.6 Å²	101.6	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-62	-45.4	176.5	171.1	0	0	0	0	110.3	L270 E271 L276 L277 Q278	L270-V274 WeakPolarHBondContact O-CG2 3.37Å; L270-V274 PolarHBondContact O-N 3.27Å; E271-V274 PolarHBondContact O-N 2.83Å; V274-L276 VanDerWaalsContact C-N 3.34Å; V274-L276 PolarHBondContact O-N 3.16Å; V274-L277 PolarHBondContact O-N 2.6Å; V274-Q278 WeakPolarHBondContact O-CB 3.5Å; V274-Q278 PolarHBondContact O-N 3.06Å
275	S	93.9	Very high	92.8	Very high	62 Å²	62	99.9 Å²	99.9	43%	0.434	51%	0.508	S	S	.	.	H	α-helix	trans	-60.3	-41.9	176.4	179.2	0	0	0	0	112.6	E271 K272 Q278 N279	E271-S275 PolarHBondContact O-N 3.4Å; K272-S275 PolarHBondContact O-N 3.09Å; S275-Q278 PolarHBondContact O-N 3.17Å; S275-N279 PolarHBondContact O-N 3.37Å; S275-N279 PolarHBondContact O-ND2 3.43Å
276	L	93.6	Very high	93	Very high	107 Å²	107	100.2 Å²	100.2	56%	0.56	51%	0.507	S	S	*	.	H	α-helix	trans	-62.3	-49.4	175.5	-73.5	168	0	0	0	112.1	K272 K273 V274 Q278 N279 E280	K272-L276 WeakPolarHBondContact O-CG 3.27Å; K272-L276 PolarHBondContact O-N 2.83Å; K273-L276 PolarHBondContact O-N 2.87Å; V274-L276 VanDerWaalsContact C-N 3.34Å; V274-L276 PolarHBondContact O-N 3.16Å; L276-Q278 VanDerWaalsContact C-N 3.25Å; L276-Q278 PolarHBondContact O-N 2.89Å; L276-N279 WeakPolarHBondContact O-CB 3.49Å; L276-N279 PolarHBondContact O-N 3.29Å; L276-N279 VanDerWaalsContact O-N 3.16Å; L276-E280 PolarHBondContact O-N 3.07Å
277	L	92.9	Very high	93.2	Very high	108 Å²	108	98 Å²	98	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-61.7	-35.7	178.5	-72	173.2	0	0	0	112.1	K273 V274 E280 S281	K273-L277 WeakPolarHBondContact O-CG 3.33Å; K273-L277 PolarHBondContact O-N 2.97Å; V274-L277 PolarHBondContact O-N 2.6Å; L277-E280 PolarHBondContact O-N 3.25Å; L277-S281 WeakPolarHBondContact O-CB 3.41Å; L277-S281 PolarHBondContact O-N 3.06Å
278	Q	95.2	Very high	93.4	Very high	129 Å²	129	100.3 Å²	100.3	60%	0.603	52%	0.516	S	S	*	.	H	α-helix	trans	-66.7	-40.5	176.9	-165	168.8	-3.9	0	0	111.5	V274 S275 L276 S281 V282	V274-Q278 WeakPolarHBondContact O-CB 3.5Å; V274-Q278 PolarHBondContact O-N 3.06Å; S275-Q278 PolarHBondContact O-N 3.17Å; L276-Q278 VanDerWaalsContact C-N 3.25Å; L276-Q278 PolarHBondContact O-N 2.89Å; Q278-S281 PolarHBondContact O-N 3.43Å; Q278-V282 WeakPolarHBondContact O-CG2 3.44Å; Q278-V282 PolarHBondContact O-N 2.95Å; Q278-V282 VanDerWaalsContact O-N 3.09Å
279	N	93.6	Very high	93.6	Very high	94 Å²	94	103 Å²	103	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-46.4	174.2	-69.4	-21.2	0	0	0	111.7	S275 L276 S281 V282 E283	S275-N279 PolarHBondContact O-N 3.37Å; S275-N279 PolarHBondContact O-ND2 3.43Å; L276-N279 WeakPolarHBondContact O-CB 3.49Å; L276-N279 PolarHBondContact O-N 3.29Å; L276-N279 VanDerWaalsContact O-N 3.16Å; N279-S281 VanDerWaalsContact C-N 3.3Å; N279-S281 PolarHBondContact O-N 3.16Å; N279-V282 PolarHBondContact O-N 2.92Å; N279-V282 VanDerWaalsContact O-N 3.16Å; N279-E283 PolarHBondContact O-N 3.46Å
280	E	93.5	Very high	93.8	Very high	112 Å²	112	103.6 Å²	103.6	52%	0.523	53%	0.53	S	S	.	.	H	α-helix	trans	-58.8	-42.7	175.4	-72.7	-179.4	179.6	0	0	111.4	L276 L277 V282 E283 K284	L276-E280 PolarHBondContact O-N 3.07Å; L277-E280 PolarHBondContact O-N 3.25Å; E280-V282 VanDerWaalsContact C-N 3.31Å; E280-V282 PolarHBondContact O-N 3.04Å; E280-E283 PolarHBondContact O-N 3.37Å; E280-K284 VanDerWaalsContact O-CG 3.27Å; E280-K284 WeakPolarHBondContact O-CG 3.47Å; E280-K284 PolarHBondContact O-N 3.36Å
281	S	92.9	Very high	94	Very high	66 Å²	66	104 Å²	104	46%	0.462	53%	0.532	S	S	.	.	H	α-helix	trans	-60.9	-39.3	177.3	-173.8	0	0	0	0	112.3	L277 Q278 N279 N285	L277-S281 WeakPolarHBondContact O-CB 3.41Å; L277-S281 PolarHBondContact O-N 3.06Å; Q278-S281 PolarHBondContact O-N 3.43Å; N279-S281 VanDerWaalsContact C-N 3.3Å; N279-S281 PolarHBondContact O-N 3.16Å; S281-N285 WeakPolarHBondContact O-CB 3.44Å; S281-N285 PolarHBondContact O-N 3.49Å
282	V	96.5	Very high	94.1	Very high	70 Å²	70	103.4 Å²	103.4	42%	0.424	53%	0.529	S	S	.	.	H	α-helix	trans	-66.7	-42.7	177	170.4	0	0	0	0	111	Q278 N279 E280 N285 K286	Q278-V282 WeakPolarHBondContact O-CG2 3.44Å; Q278-V282 PolarHBondContact O-N 2.95Å; Q278-V282 VanDerWaalsContact O-N 3.09Å; N279-V282 PolarHBondContact O-N 2.92Å; N279-V282 VanDerWaalsContact O-N 3.16Å; E280-V282 VanDerWaalsContact C-N 3.31Å; E280-V282 PolarHBondContact O-N 3.04Å; V282-N285 PolarHBondContact O-N 3.11Å; V282-K286 WeakPolarHBondContact O-CG 3.34Å; V282-K286 PolarHBondContact O-N 3.38Å
283	E	93.3	Very high	94.1	Very high	130 Å²	130	101 Å²	101	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-41.2	176.7	-71.7	-175	167.3	0	0	112.7	N279 E280 K286 S287	N279-E283 PolarHBondContact O-N 3.46Å; E280-E283 PolarHBondContact O-N 3.37Å; E283-K286 PolarHBondContact O-N 3.35Å; E283-S287 PolarHBondContact O-N 2.92Å; E283-S287 PolarHBondContact O-OG 3.26Å; E283-S287 VanDerWaalsContact O-OG 3.11Å
284	K	92.6	Very high	94.2	Very high	145 Å²	145	100.3 Å²	100.3	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-42.4	174.3	-67.3	-64.5	-179.7	-174.7	0	111.3	E280 K286 S287 I288	E280-K284 VanDerWaalsContact O-CG 3.27Å; E280-K284 WeakPolarHBondContact O-CG 3.47Å; E280-K284 PolarHBondContact O-N 3.36Å; K284-K286 PolarHBondContact O-N 3.11Å; K284-S287 WeakPolarHBondContact O-CB 3.35Å; K284-S287 PolarHBondContact O-N 3.47Å; K284-S287 VanDerWaalsContact O-N 3.15Å; K284-I288 WeakPolarHBondContact O-CG1 3.41Å; K284-I288 PolarHBondContact O-N 2.75Å
285	N	93.6	Very high	94	Very high	99 Å²	99	100.9 Å²	100.9	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-40.6	175.1	-87.4	-7.3	0	0	0	112.8	S281 V282 S287 I288 Q289	S281-N285 WeakPolarHBondContact O-CB 3.44Å; S281-N285 PolarHBondContact O-N 3.49Å; V282-N285 PolarHBondContact O-N 3.11Å; N285-S287 VanDerWaalsContact C-N 3.3Å; N285-S287 PolarHBondContact O-N 3.12Å; N285-I288 PolarHBondContact O-N 3.13Å; N285-Q289 PolarHBondContact O-N 3.18Å
286	K	94.9	Very high	94.1	Very high	138 Å²	138	100.1 Å²	100.1	60%	0.6	52%	0.516	S	S	*	.	H	α-helix	trans	-61	-40.8	173.8	-71.3	175.2	-178.2	175.7	0	111.8	V282 E283 K284 Q289 S290	V282-K286 WeakPolarHBondContact O-CG 3.34Å; V282-K286 PolarHBondContact O-N 3.38Å; E283-K286 PolarHBondContact O-N 3.35Å; K284-K286 PolarHBondContact O-N 3.11Å; K286-Q289 PolarHBondContact O-N 3.23Å; K286-S290 PolarHBondContact O-N 2.79Å
287	S	94.6	Very high	94.1	Very high	66 Å²	66	98.1 Å²	98.1	46%	0.462	51%	0.511	S	S	.	.	H	α-helix	trans	-65.5	-42.8	177.3	-61.9	0	0	0	0	111.7	E283 K284 N285 Q289 S290 L291	E283-S287 PolarHBondContact O-N 2.92Å; E283-S287 PolarHBondContact O-OG 3.26Å; E283-S287 VanDerWaalsContact O-OG 3.11Å; K284-S287 WeakPolarHBondContact O-CB 3.35Å; K284-S287 PolarHBondContact O-N 3.47Å; K284-S287 VanDerWaalsContact O-N 3.15Å; N285-S287 VanDerWaalsContact C-N 3.3Å; N285-S287 PolarHBondContact O-N 3.12Å; S287-Q289 VanDerWaalsContact C-N 3.32Å; S287-Q289 PolarHBondContact O-N 3.36Å; S287-S290 PolarHBondContact O-N 2.98Å; S287-L291 WeakPolarHBondContact O-CG 3.42Å; S287-L291 PolarHBondContact O-N 3.09Å
288	I	94.4	Very high	94.1	Very high	104 Å²	104	99.3 Å²	99.3	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-59.1	-44.6	174.6	-69.8	166.4	0	0	0	110.6	K284 N285 S290 L291 H292	K284-I288 WeakPolarHBondContact O-CG1 3.41Å; K284-I288 PolarHBondContact O-N 2.75Å; N285-I288 PolarHBondContact O-N 3.13Å; I288-S290 VanDerWaalsContact C-N 3.34Å; I288-S290 PolarHBondContact O-N 2.76Å; I288-L291 PolarHBondContact O-N 2.88Å; I288-H292 WeakPolarHBondContact O-CB 3.39Å; I288-H292 PolarHBondContact O-N 2.83Å
289	Q	95.1	Very high	94	Very high	131 Å²	131	98.8 Å²	98.8	61%	0.612	51%	0.509	S	S	*	.	H	α-helix	trans	-65.5	-37.6	179.8	-163.4	164.6	18.4	0	0	112.3	N285 K286 S287 H292 N293	N285-Q289 PolarHBondContact O-N 3.18Å; K286-Q289 PolarHBondContact O-N 3.23Å; S287-Q289 VanDerWaalsContact C-N 3.32Å; S287-Q289 PolarHBondContact O-N 3.36Å; Q289-H292 PolarHBondContact O-N 2.86Å; Q289-N293 VanDerWaalsContact O-CG 3.32Å; Q289-N293 PolarHBondContact O-N 2.79Å; Q289-N293 VanDerWaalsContact O-N 3.11Å; Q289-N293 PolarHBondContact O-ND2 3.36Å
290	S	94.1	Very high	94.1	Very high	62 Å²	62	100.3 Å²	100.3	43%	0.434	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-44.5	173.3	-179	0	0	0	0	112.2	K286 S287 I288 N293 Q294	K286-S290 PolarHBondContact O-N 2.79Å; S287-S290 PolarHBondContact O-N 2.98Å; I288-S290 VanDerWaalsContact C-N 3.34Å; I288-S290 PolarHBondContact O-N 2.76Å; S290-N293 PolarHBondContact O-N 2.89Å; S290-Q294 PolarHBondContact O-N 2.83Å; S290-Q294 VanDerWaalsContact O-N 3.14Å
291	L	94.2	Very high	94.1	Very high	98 Å²	98	98.4 Å²	98.4	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-64	-40.4	176.4	-71.5	171.6	0	0	0	111.9	S287 I288 N293 Q294 I295	S287-L291 WeakPolarHBondContact O-CG 3.42Å; S287-L291 PolarHBondContact O-N 3.09Å; I288-L291 PolarHBondContact O-N 2.88Å; L291-N293 VanDerWaalsContact C-N 3.33Å; L291-N293 PolarHBondContact O-N 2.84Å; L291-Q294 WeakPolarHBondContact O-CB 3.33Å; L291-Q294 PolarHBondContact O-N 2.9Å; L291-Q294 VanDerWaalsContact O-N 3.16Å; L291-I295 WeakPolarHBondContact O-CG1 3.45Å; L291-I295 PolarHBondContact O-N 2.8Å
292	H	95.3	Very high	94.1	Very high	110 Å²	110	99.8 Å²	99.8	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-59.5	-44.6	176	-176.7	66.5	0	0	0	111.7	I288 Q289 Q294 I295 C296	I288-H292 WeakPolarHBondContact O-CB 3.39Å; I288-H292 PolarHBondContact O-N 2.83Å; Q289-H292 PolarHBondContact O-N 2.86Å; H292-Q294 VanDerWaalsContact C-N 3.29Å; H292-Q294 PolarHBondContact O-N 2.74Å; H292-I295 PolarHBondContact O-N 2.93Å; H292-I295 VanDerWaalsContact O-N 3.15Å; H292-C296 PolarHBondContact O-N 3.22Å; H292-C296 PolarHBondContact O-SG 3.15Å; H292-C296 VanDerWaalsContact O-SG 3.4Å
293	N	93.6	Very high	94	Very high	104 Å²	104	100.6 Å²	100.6	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-35.6	176.1	-68.2	-16.5	0	0	0	112.6	Q289 S290 L291 S297	Q289-N293 VanDerWaalsContact O-CG 3.32Å; Q289-N293 PolarHBondContact O-N 2.79Å; Q289-N293 VanDerWaalsContact O-N 3.11Å; Q289-N293 PolarHBondContact O-ND2 3.36Å; S290-N293 PolarHBondContact O-N 2.89Å; L291-N293 VanDerWaalsContact C-N 3.33Å; L291-N293 PolarHBondContact O-N 2.84Å; N293-S297 PolarHBondContact O-N 3.4Å
294	Q	95.2	Very high	94.1	Very high	94 Å²	94	100.7 Å²	100.7	44%	0.439	50%	0.502	S	S	.	.	H	α-helix	trans	-68.8	-38	174.2	-70.6	178.6	0.5	0	0	112.3	S290 L291 H292 S297 F298	S290-Q294 PolarHBondContact O-N 2.83Å; S290-Q294 VanDerWaalsContact O-N 3.14Å; L291-Q294 WeakPolarHBondContact O-CB 3.33Å; L291-Q294 PolarHBondContact O-N 2.9Å; L291-Q294 VanDerWaalsContact O-N 3.16Å; H292-Q294 VanDerWaalsContact C-N 3.29Å; H292-Q294 PolarHBondContact O-N 2.74Å; Q294-S297 PolarHBondContact O-N 2.95Å; Q294-S297 PolarHBondContact O-OG 3.28Å; Q294-F298 HydrophobicContact CB-CE2 4.43Å; Q294-F298 WeakPolarHBondContact O-CD2 3.49Å; Q294-F298 WeakPolarHBondContact O-CG 3.42Å; Q294-F298 PolarHBondContact O-N 3.42Å
295	I	91.6	Very high	94.1	Very high	90 Å²	90	98 Å²	98	46%	0.462	49%	0.492	S	S	.	.	H	α-helix	trans	-62.7	-47.7	175.9	-69.1	166.6	0	0	0	109.9	L291 H292 S297 F298 E299	L291-I295 WeakPolarHBondContact O-CG1 3.45Å; L291-I295 PolarHBondContact O-N 2.8Å; H292-I295 PolarHBondContact O-N 2.93Å; H292-I295 VanDerWaalsContact O-N 3.15Å; I295-S297 VanDerWaalsContact C-N 3.28Å; I295-S297 PolarHBondContact O-N 3.02Å; I295-F298 PolarHBondContact O-N 3.47Å; I295-F298 VanDerWaalsContact O-N 3.11Å; I295-E299 HydrophobicContact CG2-CG 4.38Å; I295-E299 WeakPolarHBondContact O-CG 3.34Å; I295-E299 PolarHBondContact O-N 2.91Å
296	C	95.4	Very high	94.1	Very high	45 Å²	45	97.9 Å²	97.9	30%	0.304	49%	0.487	S	S	.	.	H	α-helix	trans	-58	-39	177.6	-67.6	0	0	0	0	112.5	H292 E299 I300	H292-C296 PolarHBondContact O-N 3.22Å; H292-C296 PolarHBondContact O-SG 3.15Å; H292-C296 VanDerWaalsContact O-SG 3.4Å; C296-E299 PolarHBondContact O-N 3.25Å; C296-I300 WeakPolarHBondContact O-CG1 3.14Å; C296-I300 PolarHBondContact O-N 3.27Å
297	S	93.5	Very high	94.1	Very high	65 Å²	65	95.9 Å²	95.9	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-69.9	-36.5	177.2	69.7	0	0	0	0	112.6	N293 Q294 I295 I300 E301	N293-S297 PolarHBondContact O-N 3.4Å; Q294-S297 PolarHBondContact O-N 2.95Å; Q294-S297 PolarHBondContact O-OG 3.28Å; I295-S297 VanDerWaalsContact C-N 3.28Å; I295-S297 PolarHBondContact O-N 3.02Å; S297-I300 PolarHBondContact O-N 3.18Å; S297-E301 PolarHBondContact O-N 2.85Å
298	F	92.9	Very high	94.2	Very high	134 Å²	134	96.2 Å²	96.2	59%	0.588	48%	0.475	S	S	*	.	H	α-helix	trans	-67.1	-37	173.7	-71.2	-46.6	0	0	0	112.8	Q294 I295 I300 E301 I302	Q294-F298 HydrophobicContact CB-CE2 4.43Å; Q294-F298 WeakPolarHBondContact O-CD2 3.49Å; Q294-F298 WeakPolarHBondContact O-CG 3.42Å; Q294-F298 PolarHBondContact O-N 3.42Å; I295-F298 PolarHBondContact O-N 3.47Å; I295-F298 VanDerWaalsContact O-N 3.11Å; F298-I300 VanDerWaalsContact C-N 3.34Å; F298-I300 PolarHBondContact O-N 2.86Å; F298-E301 PolarHBondContact O-N 2.92Å; F298-I302 WeakPolarHBondContact O-CB 3.27Å; F298-I302 VanDerWaalsContact O-CG1 3.27Å; F298-I302 WeakPolarHBondContact O-CG1 3.31Å; F298-I302 PolarHBondContact O-N 3.13Å
299	E	93.3	Very high	94.1	Very high	118 Å²	118	96.2 Å²	96.2	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-60.8	-42.6	175.9	-73.7	175.4	164.1	0	0	111.8	I295 C296 I302 E303	I295-E299 HydrophobicContact CG2-CG 4.38Å; I295-E299 WeakPolarHBondContact O-CG 3.34Å; I295-E299 PolarHBondContact O-N 2.91Å; C296-E299 PolarHBondContact O-N 3.25Å; E299-I302 PolarHBondContact O-N 3.14Å; E299-E303 PolarHBondContact O-N 2.83Å; E299-E303 VanDerWaalsContact O-N 3.11Å
300	I	95.8	Very high	94.1	Very high	125 Å²	125	94.8 Å²	94.8	64%	0.641	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-45.1	175.5	-65.8	167.8	0	0	0	111.1	C296 S297 F298 E303 R304	C296-I300 WeakPolarHBondContact O-CG1 3.14Å; C296-I300 PolarHBondContact O-N 3.27Å; S297-I300 PolarHBondContact O-N 3.18Å; F298-I300 VanDerWaalsContact C-N 3.34Å; F298-I300 PolarHBondContact O-N 2.86Å; I300-E303 PolarHBondContact O-N 3.05Å; I300-R304 PolarHBondContact O-N 3.23Å; I300-R304 VanDerWaalsContact O-N 3.08Å
301	E	94	Very high	94.2	Very high	73 Å²	73	96.2 Å²	96.2	34%	0.341	47%	0.467	S	S	.	.	H	α-helix	trans	-67.7	-37.2	179.7	-176.8	57.9	-156.6	0	0	112	S297 F298 E303 R304 Q305	S297-E301 PolarHBondContact O-N 2.85Å; F298-E301 PolarHBondContact O-N 2.92Å; E301-E303 VanDerWaalsContact C-N 3.31Å; E301-E303 PolarHBondContact O-N 2.82Å; E301-R304 WeakPolarHBondContact O-CB 3.36Å; E301-R304 PolarHBondContact O-N 3.16Å; E301-R304 IonicContact OE1-CZ 3.4Å; E301-R304 IonicContact OE1-NE 3.2Å; E301-R304 PolarHBondContact OE1-NE 2.87Å; E301-R304 IonicContact OE1-NH2 2.76Å; E301-R304 PolarHBondContact OE1-NH2 3.33Å; E301-R304 IonicContact OE2-CZ 3.69Å; E301-R304 IonicContact OE2-NE 2.87Å; E301-R304 PolarHBondContact OE2-NE 2.8Å; E301-R304 IonicContact OE2-NH2 3.64Å; E301-Q305 VanDerWaalsContact O-CG 3.3Å; E301-Q305 WeakPolarHBondContact O-CG 3.47Å; E301-Q305 PolarHBondContact O-N 3.34Å; E301-Q305 PolarHBondContact OE1-NE2 2.72Å
302	I	92.3	Very high	94	Very high	95 Å²	95	95.3 Å²	95.3	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-59.4	-44.9	174.5	-74.4	167.4	0	0	0	110.5	F298 E299 R304 Q305 K306	F298-I302 WeakPolarHBondContact O-CB 3.27Å; F298-I302 VanDerWaalsContact O-CG1 3.27Å; F298-I302 WeakPolarHBondContact O-CG1 3.31Å; F298-I302 PolarHBondContact O-N 3.13Å; E299-I302 PolarHBondContact O-N 3.14Å; I302-R304 VanDerWaalsContact C-N 3.33Å; I302-R304 PolarHBondContact O-N 3.3Å; I302-Q305 PolarHBondContact O-N 3.31Å; I302-K306 WeakPolarHBondContact O-CG 3.36Å; I302-K306 PolarHBondContact O-N 3.42Å
303	E	95	Very high	93.9	Very high	87 Å²	87	95.1 Å²	95.1	41%	0.407	46%	0.462	S	S	.	.	H	α-helix	trans	-66.8	-37.3	-179.9	-157	54.2	-134.9	0	0	111.7	E299 I300 E301 Q305 K306 E307 R310	E299-E303 PolarHBondContact O-N 2.83Å; E299-E303 VanDerWaalsContact O-N 3.11Å; I300-E303 PolarHBondContact O-N 3.05Å; E301-E303 VanDerWaalsContact C-N 3.31Å; E301-E303 PolarHBondContact O-N 2.82Å; E303-Q305 VanDerWaalsContact C-N 3.35Å; E303-Q305 PolarHBondContact O-N 2.96Å; E303-K306 PolarHBondContact O-N 2.71Å; E303-K306 WeakPolarHBondContact OE2-CD 3.14Å; E303-K306 IonicContact OE2-NZ 2.77Å; E303-K306 PolarHBondContact OE2-NZ 3.21Å; E303-E307 PolarHBondContact O-N 3.43Å; E303-E307 VanDerWaalsContact O-N 3.12Å; E303-R310 IonicContact OE1-NH2 3.74Å
304	R	95.6	Very high	94	Very high	131 Å²	131	93.8 Å²	93.8	49%	0.494	46%	0.461	S	S	.	.	H	α-helix	trans	-59.9	-42.9	172.1	-164.9	-178.2	79.2	89.5	2.4	112.3	I300 E301 I302 E307 M308	I300-R304 PolarHBondContact O-N 3.23Å; I300-R304 VanDerWaalsContact O-N 3.08Å; E301-R304 WeakPolarHBondContact O-CB 3.36Å; E301-R304 PolarHBondContact O-N 3.16Å; E301-R304 IonicContact OE1-CZ 3.4Å; E301-R304 IonicContact OE1-NE 3.2Å; E301-R304 PolarHBondContact OE1-NE 2.87Å; E301-R304 IonicContact OE1-NH2 2.76Å; E301-R304 PolarHBondContact OE1-NH2 3.33Å; E301-R304 IonicContact OE2-CZ 3.69Å; E301-R304 IonicContact OE2-NE 2.87Å; E301-R304 PolarHBondContact OE2-NE 2.8Å; E301-R304 IonicContact OE2-NH2 3.64Å; I302-R304 VanDerWaalsContact C-N 3.33Å; I302-R304 PolarHBondContact O-N 3.3Å; R304-E307 PolarHBondContact O-N 3.33Å; R304-M308 PolarHBondContact O-N 3.03Å
305	Q	92.3	Very high	93.9	Very high	89 Å²	89	95.6 Å²	95.6	42%	0.416	47%	0.467	S	S	.	.	H	α-helix	trans	-66.4	-38.8	178.1	-68.7	-68.4	-27.8	0	0	112.1	E301 I302 E303 E307 M308 L309	E301-Q305 VanDerWaalsContact O-CG 3.3Å; E301-Q305 WeakPolarHBondContact O-CG 3.47Å; E301-Q305 PolarHBondContact O-N 3.34Å; E301-Q305 PolarHBondContact OE1-NE2 2.72Å; I302-Q305 PolarHBondContact O-N 3.31Å; E303-Q305 VanDerWaalsContact C-N 3.35Å; E303-Q305 PolarHBondContact O-N 2.96Å; Q305-E307 VanDerWaalsContact C-N 3.34Å; Q305-E307 PolarHBondContact O-N 3.49Å; Q305-M308 VanDerWaalsContact CD-CE 3.46Å; Q305-M308 PolarHBondContact O-N 3.32Å; Q305-L309 PolarHBondContact O-N 3.43Å
306	K	93.3	Very high	94	Very high	97 Å²	97	96.4 Å²	96.4	42%	0.422	47%	0.472	S	S	.	.	H	α-helix	trans	-61.5	-41.7	175	-70.8	178.1	-166.8	159.9	0	112.1	I302 E303 M308 L309 R310	I302-K306 WeakPolarHBondContact O-CG 3.36Å; I302-K306 PolarHBondContact O-N 3.42Å; E303-K306 PolarHBondContact O-N 2.71Å; E303-K306 WeakPolarHBondContact OE2-CD 3.14Å; E303-K306 IonicContact OE2-NZ 2.77Å; E303-K306 PolarHBondContact OE2-NZ 3.21Å; K306-M308 VanDerWaalsContact C-N 3.34Å; K306-M308 PolarHBondContact O-N 3.1Å; K306-L309 WeakPolarHBondContact O-CB 3.47Å; K306-L309 PolarHBondContact O-N 3.07Å; K306-R310 PolarHBondContact O-N 3.17Å
307	E	95.6	Very high	93.9	Very high	95 Å²	95	99.5 Å²	99.5	44%	0.444	48%	0.484	S	S	.	.	H	α-helix	trans	-61	-43	175.8	-163.8	71.3	-105.5	0	0	111.6	E303 R304 Q305 L309 R310 N311	E303-E307 PolarHBondContact O-N 3.43Å; E303-E307 VanDerWaalsContact O-N 3.12Å; R304-E307 PolarHBondContact O-N 3.33Å; Q305-E307 VanDerWaalsContact C-N 3.34Å; Q305-E307 PolarHBondContact O-N 3.49Å; E307-L309 VanDerWaalsContact C-N 3.33Å; E307-L309 PolarHBondContact O-N 3.19Å; E307-R310 PolarHBondContact O-N 3.01Å; E307-R310 IonicContact OE1-CZ 3.64Å; E307-R310 IonicContact OE1-NE 2.86Å; E307-R310 PolarHBondContact OE1-NE 2.89Å; E307-R310 VanDerWaalsContact OE1-NE 3.09Å; E307-R310 IonicContact OE1-NH2 3.82Å; E307-R310 PolarHBondContact OE1-NH2 3.26Å; E307-R310 IonicContact OE2-CZ 3.51Å; E307-R310 IonicContact OE2-NE 2.75Å; E307-R310 IonicContact OE2-NH2 2.6Å; E307-R310 PolarHBondContact OE2-NH2 3.48Å; E307-N311 PolarHBondContact O-N 2.67Å; E307-N311 VanDerWaalsContact O-N 3.1Å
308	M	95.2	Very high	93.9	Very high	73 Å²	73	101.5 Å²	101.5	36%	0.36	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-38.5	175.1	-67.8	-162.6	-45.8	0	0	112.5	R304 Q305 K306 N311 N312	R304-M308 PolarHBondContact O-N 3.03Å; Q305-M308 VanDerWaalsContact CD-CE 3.46Å; Q305-M308 PolarHBondContact O-N 3.32Å; K306-M308 VanDerWaalsContact C-N 3.34Å; K306-M308 PolarHBondContact O-N 3.1Å; M308-N311 PolarHBondContact O-N 3.25Å; M308-N312 VanDerWaalsContact O-CG 3.3Å; M308-N312 PolarHBondContact O-N 2.96Å; M308-N312 PolarHBondContact O-ND2 3.38Å
309	L	93.6	Very high	93.9	Very high	104 Å²	104	100.1 Å²	100.1	55%	0.545	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-47.7	177	-161.7	94.6	0	0	0	110.9	Q305 K306 E307 N311 N312 E313	Q305-L309 PolarHBondContact O-N 3.43Å; K306-L309 WeakPolarHBondContact O-CB 3.47Å; K306-L309 PolarHBondContact O-N 3.07Å; E307-L309 VanDerWaalsContact C-N 3.33Å; E307-L309 PolarHBondContact O-N 3.19Å; L309-N311 VanDerWaalsContact C-N 3.29Å; L309-N311 PolarHBondContact O-N 2.81Å; L309-N312 PolarHBondContact O-N 2.89Å; L309-E313 WeakPolarHBondContact O-CG 3.2Å; L309-E313 PolarHBondContact O-N 2.89Å
310	R	95.2	Very high	93.8	Very high	101 Å²	101	99.3 Å²	99.3	38%	0.381	48%	0.481	S	S	.	.	H	α-helix	trans	-55.4	-44.4	175.3	-72.1	-172.1	-73.2	-93.9	10	111.9	E303 K306 E307 N312 E313 S314	E303-R310 IonicContact OE1-NH2 3.74Å; K306-R310 PolarHBondContact O-N 3.17Å; E307-R310 PolarHBondContact O-N 3.01Å; E307-R310 IonicContact OE1-CZ 3.64Å; E307-R310 IonicContact OE1-NE 2.86Å; E307-R310 PolarHBondContact OE1-NE 2.89Å; E307-R310 VanDerWaalsContact OE1-NE 3.09Å; E307-R310 IonicContact OE1-NH2 3.82Å; E307-R310 PolarHBondContact OE1-NH2 3.26Å; E307-R310 IonicContact OE2-CZ 3.51Å; E307-R310 IonicContact OE2-NE 2.75Å; E307-R310 IonicContact OE2-NH2 2.6Å; E307-R310 PolarHBondContact OE2-NH2 3.48Å; R310-N312 VanDerWaalsContact C-N 3.34Å; R310-N312 PolarHBondContact O-N 3.03Å; R310-E313 PolarHBondContact O-N 3.04Å; R310-S314 PolarHBondContact O-N 3.19Å; R310-S314 VanDerWaalsContact O-N 3.08Å
311	N	94.6	Very high	93.8	Very high	92 Å²	92	100.3 Å²	100.3	49%	0.492	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-38.5	176.8	-80.7	-23.1	0	0	0	112.6	E307 M308 L309 K315	E307-N311 PolarHBondContact O-N 2.67Å; E307-N311 VanDerWaalsContact O-N 3.1Å; M308-N311 PolarHBondContact O-N 3.25Å; L309-N311 VanDerWaalsContact C-N 3.29Å; L309-N311 PolarHBondContact O-N 2.81Å; N311-K315 WeakPolarHBondContact O-CG 3.44Å; N311-K315 PolarHBondContact O-N 2.82Å
312	N	90.8	Very high	93.8	Very high	80 Å²	80	99.9 Å²	99.9	43%	0.428	48%	0.479	S	S	.	.	H	α-helix	trans	-71.6	-39.4	178	-70.9	-18.7	0	0	0	112.2	M308 L309 R310 S314 K315 I316	M308-N312 VanDerWaalsContact O-CG 3.3Å; M308-N312 PolarHBondContact O-N 2.96Å; M308-N312 PolarHBondContact O-ND2 3.38Å; L309-N312 PolarHBondContact O-N 2.89Å; R310-N312 VanDerWaalsContact C-N 3.34Å; R310-N312 PolarHBondContact O-N 3.03Å; N312-S314 VanDerWaalsContact C-N 3.32Å; N312-S314 PolarHBondContact O-N 2.78Å; N312-K315 WeakPolarHBondContact O-CB 3.33Å; N312-K315 PolarHBondContact O-N 2.79Å; N312-I316 WeakPolarHBondContact O-CG1 3.29Å; N312-I316 PolarHBondContact O-N 3.18Å
313	E	93.6	Very high	93.8	Very high	106 Å²	106	100.2 Å²	100.2	50%	0.495	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-44	173.3	-74.4	176.6	165.8	0	0	111.4	L309 R310 K315 I316 L317	L309-E313 WeakPolarHBondContact O-CG 3.2Å; L309-E313 PolarHBondContact O-N 2.89Å; R310-E313 PolarHBondContact O-N 3.04Å; E313-K315 VanDerWaalsContact C-N 3.32Å; E313-K315 PolarHBondContact O-N 2.87Å; E313-I316 PolarHBondContact O-N 2.81Å; E313-L317 PolarHBondContact O-N 2.86Å
314	S	94.3	Very high	93.7	Very high	75 Å²	75	100.1 Å²	100.1	52%	0.524	48%	0.483	S	S	.	.	H	α-helix	trans	-59.2	-41.6	175.2	-175.8	0	0	0	0	112.4	R310 N312 L317 H318	R310-S314 PolarHBondContact O-N 3.19Å; R310-S314 VanDerWaalsContact O-N 3.08Å; N312-S314 VanDerWaalsContact C-N 3.32Å; N312-S314 PolarHBondContact O-N 2.78Å; S314-L317 PolarHBondContact O-N 2.82Å; S314-H318 PolarHBondContact O-N 3.19Å
315	K	94.7	Very high	93.5	Very high	132 Å²	132	97 Å²	97	57%	0.574	48%	0.481	S	S	*	.	H	α-helix	trans	-64.9	-42.6	175.3	-69.9	171.9	-175.2	173.7	0	112.3	N311 N312 E313 L317 H318 L319	N311-K315 WeakPolarHBondContact O-CG 3.44Å; N311-K315 PolarHBondContact O-N 2.82Å; N312-K315 WeakPolarHBondContact O-CB 3.33Å; N312-K315 PolarHBondContact O-N 2.79Å; E313-K315 VanDerWaalsContact C-N 3.32Å; E313-K315 PolarHBondContact O-N 2.87Å; K315-L317 VanDerWaalsContact C-N 3.35Å; K315-H318 WeakPolarHBondContact O-CB 3.41Å; K315-H318 PolarHBondContact O-N 2.91Å; K315-L319 WeakPolarHBondContact O-CG 3.35Å; K315-L319 PolarHBondContact O-N 3.37Å
316	I	92.3	Very high	93.5	Very high	108 Å²	108	98.5 Å²	98.5	55%	0.554	49%	0.488	S	S	*	.	H	α-helix	trans	-62.3	-44.9	177.1	-69	167.7	0	0	0	110.1	N312 E313 H318 L319 Q320	N312-I316 WeakPolarHBondContact O-CG1 3.29Å; N312-I316 PolarHBondContact O-N 3.18Å; E313-I316 PolarHBondContact O-N 2.81Å; I316-H318 PolarHBondContact O-N 3.19Å; I316-L319 PolarHBondContact O-N 2.9Å; I316-L319 VanDerWaalsContact O-N 3.15Å; I316-Q320 PolarHBondContact O-N 3.07Å
317	L	93.9	Very high	93.4	Very high	110 Å²	110	95.8 Å²	95.8	58%	0.576	48%	0.484	S	S	*	.	H	α-helix	trans	-60.7	-33.2	175.6	-108.7	125.5	0	0	0	113.1	E313 S314 K315 R321	E313-L317 PolarHBondContact O-N 2.86Å; S314-L317 PolarHBondContact O-N 2.82Å; K315-L317 VanDerWaalsContact C-N 3.35Å; L317-R321 WeakPolarHBondContact O-CG 3.43Å; L317-R321 PolarHBondContact O-N 2.58Å; L317-R321 PolarHBondContact O-NE 3.03Å
318	H	94.3	Very high	93.2	Very high	106 Å²	106	96 Å²	96	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-70	-46.2	173.4	-178.8	69.3	0	0	0	111.5	S314 K315 I316 Q320 R321 V322	S314-H318 PolarHBondContact O-N 3.19Å; K315-H318 WeakPolarHBondContact O-CB 3.41Å; K315-H318 PolarHBondContact O-N 2.91Å; I316-H318 PolarHBondContact O-N 3.19Å; H318-Q320 VanDerWaalsContact C-N 3.34Å; H318-Q320 PolarHBondContact O-N 3.26Å; H318-R321 WeakPolarHBondContact O-CB 3.3Å; H318-R321 PolarHBondContact O-N 2.82Å; H318-V322 WeakPolarHBondContact O-CG2 3.34Å; H318-V322 PolarHBondContact O-N 3.34Å; H318-V322 VanDerWaalsContact O-N 3.15Å
319	L	92.8	Very high	93.1	Very high	105 Å²	105	99.4 Å²	99.4	55%	0.55	50%	0.497	S	S	.	.	H	α-helix	trans	-61.9	-40.3	177.5	-70.5	172.7	0	0	0	112.3	K315 I316 R321 V322 I323	K315-L319 WeakPolarHBondContact O-CG 3.35Å; K315-L319 PolarHBondContact O-N 3.37Å; I316-L319 PolarHBondContact O-N 2.9Å; I316-L319 VanDerWaalsContact O-N 3.15Å; L319-R321 VanDerWaalsContact C-N 3.32Å; L319-R321 PolarHBondContact O-N 3.08Å; L319-V322 WeakPolarHBondContact O-CB 3.34Å; L319-V322 PolarHBondContact O-N 3.01Å; L319-V322 VanDerWaalsContact O-N 3.12Å; L319-I323 WeakPolarHBondContact O-CG1 3.48Å; L319-I323 PolarHBondContact O-N 2.99Å
320	Q	91.4	Very high	92.9	Very high	101 Å²	101	99.9 Å²	99.9	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-57.3	-46.4	175.9	-165.7	69.2	37.5	0	0	111.2	I316 H318 V322 I323 D324	I316-Q320 PolarHBondContact O-N 3.07Å; H318-Q320 VanDerWaalsContact C-N 3.34Å; H318-Q320 PolarHBondContact O-N 3.26Å; Q320-V322 VanDerWaalsContact C-N 3.3Å; Q320-V322 PolarHBondContact O-N 3.37Å; Q320-I323 PolarHBondContact O-N 3.46Å; Q320-I323 VanDerWaalsContact O-N 3.16Å; Q320-D324 VanDerWaalsContact O-CG 3.28Å; Q320-D324 PolarHBondContact O-N 2.78Å
321	R	94.8	Very high	92.6	Very high	146 Å²	146	100.5 Å²	100.5	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-60.3	-37.8	176	-77.5	178.3	-88.5	160.6	-12.8	112.9	L317 H318 L319 S325	L317-R321 WeakPolarHBondContact O-CG 3.43Å; L317-R321 PolarHBondContact O-N 2.58Å; L317-R321 PolarHBondContact O-NE 3.03Å; H318-R321 WeakPolarHBondContact O-CB 3.3Å; H318-R321 PolarHBondContact O-N 2.82Å; L319-R321 VanDerWaalsContact C-N 3.32Å; L319-R321 PolarHBondContact O-N 3.08Å; R321-S325 WeakPolarHBondContact O-CB 3.21Å; R321-S325 PolarHBondContact O-N 3.13Å; R321-S325 VanDerWaalsContact O-N 3.09Å
322	V	95.2	Very high	92.4	Very high	65 Å²	65	100.7 Å²	100.7	39%	0.394	50%	0.503	S	S	.	.	H	α-helix	trans	-66.6	-43.2	176	174.2	0	0	0	0	110.9	H318 L319 Q320 S325 Q326	H318-V322 WeakPolarHBondContact O-CG2 3.34Å; H318-V322 PolarHBondContact O-N 3.34Å; H318-V322 VanDerWaalsContact O-N 3.15Å; L319-V322 WeakPolarHBondContact O-CB 3.34Å; L319-V322 PolarHBondContact O-N 3.01Å; L319-V322 VanDerWaalsContact O-N 3.12Å; Q320-V322 VanDerWaalsContact C-N 3.3Å; Q320-V322 PolarHBondContact O-N 3.37Å; V322-S325 PolarHBondContact O-N 3.36Å; V322-Q326 WeakPolarHBondContact O-CG 3.45Å; V322-Q326 PolarHBondContact O-N 3.23Å
323	I	92.1	Very high	92.3	Very high	102 Å²	102	101.1 Å²	101.1	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-46.9	177.5	-68.9	168.6	0	0	0	110.7	L319 Q320 S325 Q326 A327	L319-I323 WeakPolarHBondContact O-CG1 3.48Å; L319-I323 PolarHBondContact O-N 2.99Å; Q320-I323 PolarHBondContact O-N 3.46Å; Q320-I323 VanDerWaalsContact O-N 3.16Å; I323-S325 VanDerWaalsContact C-N 3.29Å; I323-S325 PolarHBondContact O-N 2.75Å; I323-Q326 PolarHBondContact O-N 3.42Å; I323-Q326 VanDerWaalsContact O-N 3.1Å; I323-A327 PolarHBondContact O-N 2.89Å
324	D	91.6	Very high	91.8	Very high	85 Å²	85	99.5 Å²	99.5	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-41.6	178.7	-64.1	-24.2	0	0	0	110.9	Q320 Q326 A327 E328	Q320-D324 VanDerWaalsContact O-CG 3.28Å; Q320-D324 PolarHBondContact O-N 2.78Å; D324-Q326 PolarHBondContact O-N 3.02Å; D324-A327 PolarHBondContact O-N 2.88Å; D324-E328 PolarHBondContact O-N 3.18Å; D324-E328 VanDerWaalsContact O-N 3.12Å
325	S	92.9	Very high	91.5	Very high	64 Å²	64	101.3 Å²	101.3	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-39.8	174.4	-178.4	0	0	0	0	112.8	R321 V322 I323 K329	R321-S325 WeakPolarHBondContact O-CB 3.21Å; R321-S325 PolarHBondContact O-N 3.13Å; R321-S325 VanDerWaalsContact O-N 3.09Å; V322-S325 PolarHBondContact O-N 3.36Å; I323-S325 VanDerWaalsContact C-N 3.29Å; I323-S325 PolarHBondContact O-N 2.75Å; S325-K329 WeakPolarHBondContact O-CG 3.46Å; S325-K329 PolarHBondContact O-N 3.41Å
326	Q	91.7	Very high	91.1	Very high	122 Å²	122	101.1 Å²	101.1	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-68	-38	175.9	-69.5	-124.7	-14.4	0	0	112.2	V322 I323 D324 E328 K329 L330	V322-Q326 WeakPolarHBondContact O-CG 3.45Å; V322-Q326 PolarHBondContact O-N 3.23Å; I323-Q326 PolarHBondContact O-N 3.42Å; I323-Q326 VanDerWaalsContact O-N 3.1Å; D324-Q326 PolarHBondContact O-N 3.02Å; Q326-E328 VanDerWaalsContact C-N 3.35Å; Q326-E328 PolarHBondContact O-N 3.41Å; Q326-K329 PolarHBondContact O-N 3.33Å; Q326-L330 PolarHBondContact O-N 3.23Å
327	A	90.5	Very high	90.7	Very high	40 Å²	40	99.7 Å²	99.7	33%	0.331	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-40.9	177.3	0	0	0	0	0	112	I323 D324 L330 K331	I323-A327 PolarHBondContact O-N 2.89Å; D324-A327 PolarHBondContact O-N 2.88Å; A327-L330 PolarHBondContact O-N 2.89Å; A327-K331 PolarHBondContact O-N 3.38Å; A327-K331 VanDerWaalsContact O-N 3.1Å
328	E	92.1	Very high	90.1	Very high	99 Å²	99	101.3 Å²	101.3	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-66	-39.7	175.2	-69.3	-53.7	129.1	0	0	112.3	D324 Q326 L330 K331 E332	D324-E328 PolarHBondContact O-N 3.18Å; D324-E328 VanDerWaalsContact O-N 3.12Å; Q326-E328 VanDerWaalsContact C-N 3.35Å; Q326-E328 PolarHBondContact O-N 3.41Å; E328-L330 VanDerWaalsContact C-N 3.32Å; E328-L330 PolarHBondContact O-N 2.93Å; E328-K331 PolarHBondContact O-N 3.2Å; E328-K331 IonicContact OE1-NZ 2.75Å; E328-K331 PolarHBondContact OE1-NZ 2.81Å; E328-K331 IonicContact OE2-NZ 3.4Å; E328-E332 PolarHBondContact O-N 3Å; E328-E332 VanDerWaalsContact O-N 3.07Å
329	K	91.9	Very high	89.5	Confident	144 Å²	144	99.1 Å²	99.1	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-60.7	-40.3	173.5	-70.9	179	-177.5	-177.4	0	112.5	S325 Q326 K331 E332 L333	S325-K329 WeakPolarHBondContact O-CG 3.46Å; S325-K329 PolarHBondContact O-N 3.41Å; Q326-K329 PolarHBondContact O-N 3.33Å; K329-K331 VanDerWaalsContact C-N 3.34Å; K329-E332 PolarHBondContact O-N 2.83Å; K329-L333 PolarHBondContact O-N 3.29Å
330	L	89.4	Confident	88.7	Confident	114 Å²	114	101.4 Å²	101.4	60%	0.597	49%	0.492	S	S	*	.	H	α-helix	trans	-64.4	-37.9	176.5	-76	169.2	0	0	0	112.2	Q326 A327 E328 L333 D334	Q326-L330 PolarHBondContact O-N 3.23Å; A327-L330 PolarHBondContact O-N 2.89Å; E328-L330 VanDerWaalsContact C-N 3.32Å; E328-L330 PolarHBondContact O-N 2.93Å; L330-L333 PolarHBondContact O-N 2.9Å; L330-D334 PolarHBondContact O-N 3.25Å
331	K	89.8	Confident	87.9	Confident	114 Å²	114	103.9 Å²	103.9	50%	0.496	50%	0.496	S	S	.	.	H	α-helix	trans	-65.1	-41.4	175.1	-72.6	176.4	-173	165.4	0	112.3	A327 E328 K329 D334 K335	A327-K331 PolarHBondContact O-N 3.38Å; A327-K331 VanDerWaalsContact O-N 3.1Å; E328-K331 PolarHBondContact O-N 3.2Å; E328-K331 IonicContact OE1-NZ 2.75Å; E328-K331 PolarHBondContact OE1-NZ 2.81Å; E328-K331 IonicContact OE2-NZ 3.4Å; K329-K331 VanDerWaalsContact C-N 3.34Å; K331-D334 PolarHBondContact O-N 3.27Å; K331-K335 PolarHBondContact O-N 3.34Å; K331-K335 VanDerWaalsContact O-N 3.12Å
332	E	90.3	Very high	86.9	Confident	96 Å²	96	102.7 Å²	102.7	45%	0.449	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-43.7	175.5	-73.9	-56.6	133.6	0	0	111.2	E328 K329 D334 K335 E336	E328-E332 PolarHBondContact O-N 3Å; E328-E332 VanDerWaalsContact O-N 3.07Å; K329-E332 PolarHBondContact O-N 2.83Å; E332-D334 VanDerWaalsContact C-N 3.3Å; E332-D334 PolarHBondContact O-N 3.41Å; E332-K335 WeakPolarHBondContact O-CB 3.44Å; E332-K335 PolarHBondContact O-N 2.87Å; E332-K335 VanDerWaalsContact O-N 3.11Å; E332-K335 IonicContact OE1-NZ 3.51Å; E332-K335 PolarHBondContact OE1-NZ 3.39Å; E332-K335 IonicContact OE2-NZ 3.37Å; E332-E336 PolarHBondContact O-N 3.25Å; E332-E336 VanDerWaalsContact O-N 3.13Å
333	L	87.9	Confident	86.1	Confident	90 Å²	90	104.3 Å²	104.3	47%	0.471	50%	0.504	S	S	.	.	H	α-helix	trans	-60.9	-38.5	175.5	-160.5	76.6	0	0	0	112.3	K329 L330 K335 E336 I337	K329-L333 PolarHBondContact O-N 3.29Å; L330-L333 PolarHBondContact O-N 2.9Å; L333-K335 VanDerWaalsContact C-N 3.34Å; L333-K335 PolarHBondContact O-N 2.99Å; L333-E336 PolarHBondContact O-N 3.46Å; L333-I337 HydrophobicContact CG-CD1 4.29Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 3.12Å; L333-I337 VanDerWaalsContact O-N 3.09Å
334	D	84.8	Confident	85.1	Confident	72 Å²	72	107.1 Å²	107.1	39%	0.385	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-36.7	175.3	-178.3	76	0	0	0	112.6	L330 K331 E332 E336 I337 R338	L330-D334 PolarHBondContact O-N 3.25Å; K331-D334 PolarHBondContact O-N 3.27Å; E332-D334 VanDerWaalsContact C-N 3.3Å; E332-D334 PolarHBondContact O-N 3.41Å; D334-E336 VanDerWaalsContact C-N 3.34Å; D334-I337 PolarHBondContact O-N 3.48Å; D334-R338 PolarHBondContact O-N 2.87Å; D334-R338 VanDerWaalsContact O-N 3.16Å; D334-R338 IonicContact OD2-CZ 2.71Å; D334-R338 IonicContact OD2-NE 2.79Å; D334-R338 IonicContact OD2-NH2 2.68Å; D334-R338 PolarHBondContact OD2-NH2 3.1Å
335	K	87.3	Confident	84.3	Confident	113 Å²	113	108.9 Å²	108.9	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-63.6	-40.2	173.7	-70.9	175.9	-173.2	166.3	0	111.6	K331 E332 L333 R338 P339	K331-K335 PolarHBondContact O-N 3.34Å; K331-K335 VanDerWaalsContact O-N 3.12Å; E332-K335 WeakPolarHBondContact O-CB 3.44Å; E332-K335 PolarHBondContact O-N 2.87Å; E332-K335 VanDerWaalsContact O-N 3.11Å; E332-K335 IonicContact OE1-NZ 3.51Å; E332-K335 PolarHBondContact OE1-NZ 3.39Å; E332-K335 IonicContact OE2-NZ 3.37Å; L333-K335 VanDerWaalsContact C-N 3.34Å; L333-K335 PolarHBondContact O-N 2.99Å; K335-R338 PolarHBondContact O-N 2.94Å; K335-P339 WeakPolarHBondContact O-CD 3.34Å
336	E	87.1	Confident	83.5	Confident	127 Å²	127	111.7 Å²	111.7	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-65.9	-36.5	177.2	-69.4	-178	-178.5	0	0	112.5	E332 L333 D334 P339 F340	E332-E336 PolarHBondContact O-N 3.25Å; E332-E336 VanDerWaalsContact O-N 3.13Å; L333-E336 PolarHBondContact O-N 3.46Å; D334-E336 VanDerWaalsContact C-N 3.34Å; E336-P339 WeakPolarHBondContact O-CD 3.31Å; E336-P339 WeakPolarHBondContact O-CG 3.24Å; E336-F340 WeakPolarHBondContact O-CD2 3.42Å
337	I	83.3	Confident	82.5	Confident	78 Å²	78	108.4 Å²	108.4	40%	0.4	51%	0.513	S	S	.	.	H	α-helix	trans	-74.1	-27.4	-179.8	-68.2	167.4	0	0	0	112.3	L333 D334 F340 R341	L333-I337 HydrophobicContact CG-CD1 4.29Å; L333-I337 WeakPolarHBondContact O-CG1 3.48Å; L333-I337 PolarHBondContact O-N 3.12Å; L333-I337 VanDerWaalsContact O-N 3.09Å; D334-I337 PolarHBondContact O-N 3.48Å; I337-F340 WeakPolarHBondContact O-CB 3.34Å; I337-F340 PolarHBondContact O-N 2.96Å; I337-R341 PolarHBondContact O-N 3.17Å; I337-R341 VanDerWaalsContact O-N 3.15Å
338	R	81.3	Confident	81.7	Confident	144 Å²	144	109.8 Å²	109.8	54%	0.543	52%	0.515	S	S	.	.	H	α-helix	trans	-56.8	-48.6	-174.4	-146.7	177.1	-67.2	-158.4	-2	115.2	D334 K335 F340 R341 Q342	D334-R338 PolarHBondContact O-N 2.87Å; D334-R338 VanDerWaalsContact O-N 3.16Å; D334-R338 IonicContact OD2-CZ 2.71Å; D334-R338 IonicContact OD2-NE 2.79Å; D334-R338 IonicContact OD2-NH2 2.68Å; D334-R338 PolarHBondContact OD2-NH2 3.1Å; K335-R338 PolarHBondContact O-N 2.94Å; R338-F340 VanDerWaalsContact C-N 3.33Å; R338-F340 PolarHBondContact O-N 2.53Å; R338-R341 WeakPolarHBondContact O-CB 3.47Å; R338-R341 PolarHBondContact O-N 3.18Å; R338-R341 VanDerWaalsContact O-N 3.12Å; R338-Q342 PolarHBondContact O-N 3.33Å
339	P	81.1	Confident	80.9	Confident	60 Å²	60	108.7 Å²	108.7	39%	0.39	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-34.5	177	23.7	-34	0	0	0	112.8	K335 E336 R341 Q342 N343	K335-P339 WeakPolarHBondContact O-CD 3.34Å; E336-P339 WeakPolarHBondContact O-CD 3.31Å; E336-P339 WeakPolarHBondContact O-CG 3.24Å; P339-R341 PolarHBondContact O-N 2.9Å; P339-Q342 PolarHBondContact O-N 3.42Å; P339-N343 PolarHBondContact O-N 2.94Å; P339-N343 PolarHBondContact O-OD1 2.88Å
340	F	76.4	Confident	80.1	Confident	154 Å²	154	107.8 Å²	107.8	68%	0.675	52%	0.518	S	S	*	.	H	α-helix	trans	-61.8	-34.3	173.3	-73	-78.9	0	0	0	111.8	E336 I337 R338 W344	E336-F340 WeakPolarHBondContact O-CD2 3.42Å; I337-F340 WeakPolarHBondContact O-CB 3.34Å; I337-F340 PolarHBondContact O-N 2.96Å; R338-F340 VanDerWaalsContact C-N 3.33Å; R338-F340 PolarHBondContact O-N 2.53Å; F340-W344 WeakPolarHBondContact O-CB 3.31Å; F340-W344 PolarHBondContact O-N 2.84Å; F340-W344 VanDerWaalsContact O-N 3.12Å
341	R	75.5	Confident	79.5	Confident	152 Å²	152	106.7 Å²	106.7	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-69.6	-41.9	177.2	-156.8	-174.2	-68.7	-111.7	5.3	112.2	I337 R338 P339 W344 E345	I337-R341 PolarHBondContact O-N 3.17Å; I337-R341 VanDerWaalsContact O-N 3.15Å; R338-R341 WeakPolarHBondContact O-CB 3.47Å; R338-R341 PolarHBondContact O-N 3.18Å; R338-R341 VanDerWaalsContact O-N 3.12Å; P339-R341 PolarHBondContact O-N 2.9Å; R341-W344 WeakPolarHBondContact O-CB 3.19Å; R341-W344 PolarHBondContact O-N 2.97Å; R341-E345 PolarHBondContact O-N 3.17Å; R341-E345 VanDerWaalsContact O-N 3.09Å
342	Q	73.3	Confident	78.8	Confident	121 Å²	121	104.3 Å²	104.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-63.2	-46.4	174.3	-96	175.8	-30.2	0	0	112.4	R338 P339 W344 E345 E346	R338-Q342 PolarHBondContact O-N 3.33Å; P339-Q342 PolarHBondContact O-N 3.42Å; Q342-W344 PolarHBondContact O-N 2.87Å; Q342-E345 PolarHBondContact O-N 3.43Å; Q342-E345 VanDerWaalsContact O-N 3.13Å; Q342-E346 PolarHBondContact O-N 3.31Å
343	N	77.3	Confident	78.3	Confident	99 Å²	99	103 Å²	103	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-31.7	175.6	-71.9	3.3	0	0	0	112	P339 A347	P339-N343 PolarHBondContact O-N 2.94Å; P339-N343 PolarHBondContact O-OD1 2.88Å; N343-A347 WeakPolarHBondContact O-CB 3.33Å; N343-A347 PolarHBondContact O-N 3.23Å
344	W	71.2	Confident	77.6	Confident	161 Å²	161	102.1 Å²	102.1	61%	0.61	51%	0.505	S	S	*	.	H	α-helix	trans	-71.2	-40.1	177.2	-154.8	93.2	0	0	0	112.2	F340 R341 Q342 A347 D348	F340-W344 WeakPolarHBondContact O-CB 3.31Å; F340-W344 PolarHBondContact O-N 2.84Å; F340-W344 VanDerWaalsContact O-N 3.12Å; R341-W344 WeakPolarHBondContact O-CB 3.19Å; R341-W344 PolarHBondContact O-N 2.97Å; Q342-W344 PolarHBondContact O-N 2.87Å; W344-A347 PolarHBondContact O-N 3.21Å; W344-D348 HydrophobicContact CE3-CB 4.47Å; W344-D348 HydrophobicContact CZ3-CB 4.32Å; W344-D348 WeakPolarHBondContact O-CB 3.37Å; W344-D348 PolarHBondContact O-N 2.87Å
345	E	74.6	Confident	77	Confident	122 Å²	122	102.8 Å²	102.8	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-39.4	174.9	-71.6	170.9	179.9	0	0	112	R341 Q342 D348 S349	R341-E345 PolarHBondContact O-N 3.17Å; R341-E345 VanDerWaalsContact O-N 3.09Å; Q342-E345 PolarHBondContact O-N 3.43Å; Q342-E345 VanDerWaalsContact O-N 3.13Å; E345-D348 PolarHBondContact O-N 3.32Å; E345-S349 PolarHBondContact O-N 3.41Å
346	E	76.1	Confident	76.3	Confident	123 Å²	123	100.8 Å²	100.8	58%	0.575	51%	0.507	S	S	*	.	H	α-helix	trans	-63.6	-42.4	173.2	-71.1	179.4	-176.1	0	0	111.8	Q342 D348 S349 M350	Q342-E346 PolarHBondContact O-N 3.31Å; E346-D348 VanDerWaalsContact C-N 3.33Å; E346-D348 PolarHBondContact O-N 3.05Å; E346-S349 PolarHBondContact O-N 2.79Å; E346-M350 WeakPolarHBondContact O-CB 3.17Å; E346-M350 PolarHBondContact O-N 3.08Å
347	A	71.5	Confident	75.4	Confident	54 Å²	54	99.8 Å²	99.8	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-36.1	175.4	0	0	0	0	0	112.4	N343 W344 M350 K351	N343-A347 WeakPolarHBondContact O-CB 3.33Å; N343-A347 PolarHBondContact O-N 3.23Å; W344-A347 PolarHBondContact O-N 3.21Å; A347-M350 PolarHBondContact O-N 3.07Å; A347-K351 WeakPolarHBondContact O-CB 3.34Å; A347-K351 PolarHBondContact O-N 3.08Å
348	D	74.2	Confident	74.2	Confident	69 Å²	69	101.2 Å²	101.2	37%	0.369	51%	0.51	S	S	.	.	H	α-helix	trans	-69.6	-40.9	176.8	-160.9	52	0	0	0	111.7	W344 E345 E346 M350 K351 S352	W344-D348 HydrophobicContact CE3-CB 4.47Å; W344-D348 HydrophobicContact CZ3-CB 4.32Å; W344-D348 WeakPolarHBondContact O-CB 3.37Å; W344-D348 PolarHBondContact O-N 2.87Å; E345-D348 PolarHBondContact O-N 3.32Å; E346-D348 VanDerWaalsContact C-N 3.33Å; E346-D348 PolarHBondContact O-N 3.05Å; D348-M350 VanDerWaalsContact C-N 3.3Å; D348-M350 PolarHBondContact O-N 3.42Å; D348-K351 WeakPolarHBondContact O-CB 3.23Å; D348-K351 PolarHBondContact O-N 2.69Å; D348-S352 PolarHBondContact O-N 3.47Å; D348-S352 PolarHBondContact O-OG 3.09Å
349	S	74.4	Confident	73.1	Confident	76 Å²	76	99.8 Å²	99.8	53%	0.531	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-37.9	171.8	-177	0	0	0	0	112.4	E345 E346 S353	E345-S349 PolarHBondContact O-N 3.41Å; E346-S349 PolarHBondContact O-N 2.79Å; S349-S353 PolarHBondContact O-N 3.34Å; S349-S353 PolarHBondContact O-OG 3.25Å
350	M	75.2	Confident	72.1	Confident	124 Å²	124	105.9 Å²	105.9	61%	0.611	53%	0.528	S	S	*	.	H	α-helix	trans	-67.8	-39.9	176.5	-147.5	177	-51.5	0	0	110.9	E346 A347 D348 S353 V354	E346-M350 WeakPolarHBondContact O-CB 3.17Å; E346-M350 PolarHBondContact O-N 3.08Å; A347-M350 PolarHBondContact O-N 3.07Å; D348-M350 VanDerWaalsContact C-N 3.3Å; D348-M350 PolarHBondContact O-N 3.42Å; M350-S353 WeakPolarHBondContact O-CB 3.47Å; M350-S353 PolarHBondContact O-N 3.38Å; M350-V354 WeakPolarHBondContact O-CG2 3.44Å; M350-V354 PolarHBondContact O-N 3.24Å
351	K	77.4	Confident	70.9	Confident	92 Å²	92	103.1 Å²	103.1	40%	0.4	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-44	174.4	-178.6	-172.3	167.6	-156.7	0	112.2	A347 D348 S353 V354 E355	A347-K351 WeakPolarHBondContact O-CB 3.34Å; A347-K351 PolarHBondContact O-N 3.08Å; D348-K351 WeakPolarHBondContact O-CB 3.23Å; D348-K351 PolarHBondContact O-N 2.69Å; K351-S353 VanDerWaalsContact C-N 3.27Å; K351-S353 PolarHBondContact O-N 3.44Å; K351-V354 PolarHBondContact O-N 2.98Å; K351-V354 VanDerWaalsContact O-N 3.17Å; K351-E355 WeakPolarHBondContact CE-OE1 3.43Å; K351-E355 WeakPolarHBondContact O-CG 3.4Å; K351-E355 PolarHBondContact O-N 2.73Å
352	S	75.4	Confident	69.5	Low	63 Å²	63	100.4 Å²	100.4	44%	0.441	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-33.9	174.7	-60.4	0	0	0	0	112.8	D348 E355 S356	D348-S352 PolarHBondContact O-N 3.47Å; D348-S352 PolarHBondContact O-OG 3.09Å; S352-E355 PolarHBondContact O-N 2.67Å; S352-S356 PolarHBondContact O-N 3.16Å; S352-S356 VanDerWaalsContact O-N 3.11Å
353	S	79	Confident	68.2	Low	68 Å²	68	103.2 Å²	103.2	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-68.9	-38.3	174.9	-57	0	0	0	0	111.8	S349 M350 K351 S356 L357	S349-S353 PolarHBondContact O-N 3.34Å; S349-S353 PolarHBondContact O-OG 3.25Å; M350-S353 WeakPolarHBondContact O-CB 3.47Å; M350-S353 PolarHBondContact O-N 3.38Å; K351-S353 VanDerWaalsContact C-N 3.27Å; K351-S353 PolarHBondContact O-N 3.44Å; S353-S356 PolarHBondContact O-N 2.97Å; S353-L357 PolarHBondContact O-N 3.41Å
354	V	72.9	Confident	66.6	Low	72 Å²	72	105.5 Å²	105.5	44%	0.436	55%	0.549	S	S	.	.	H	α-helix	trans	-67.2	-39.6	174.1	171.1	0	0	0	0	111.4	M350 K351 S356 L357 Q358	M350-V354 WeakPolarHBondContact O-CG2 3.44Å; M350-V354 PolarHBondContact O-N 3.24Å; K351-V354 PolarHBondContact O-N 2.98Å; K351-V354 VanDerWaalsContact O-N 3.17Å; V354-S356 VanDerWaalsContact C-N 3.33Å; V354-S356 PolarHBondContact O-N 3.35Å; V354-L357 PolarHBondContact O-N 3.44Å; V354-Q358 WeakPolarHBondContact O-CB 3.38Å; V354-Q358 WeakPolarHBondContact O-CG 3.24Å; V354-Q358 PolarHBondContact O-N 2.86Å; V354-Q358 PolarHBondContact O-OE1 3.4Å
355	E	72.3	Confident	65	Low	87 Å²	87	105.8 Å²	105.8	41%	0.407	56%	0.557	S	S	.	*	H	α-helix	trans	-63	-37.2	174.8	-77.7	173	176.9	0	0	112.1	K351 S352 Q358 N359	K351-E355 WeakPolarHBondContact CE-OE1 3.43Å; K351-E355 WeakPolarHBondContact O-CG 3.4Å; K351-E355 PolarHBondContact O-N 2.73Å; S352-E355 PolarHBondContact O-N 2.67Å; E355-Q358 PolarHBondContact O-N 2.95Å; E355-N359 VanDerWaalsContact O-CG 3.26Å; E355-N359 PolarHBondContact O-N 3.12Å; E355-N359 PolarHBondContact O-ND2 3.41Å
356	S	72.9	Confident	63.7	Low	71 Å²	71	105.3 Å²	105.3	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-66.4	-39	174.1	-178	0	0	0	0	112.8	S352 S353 V354 R360	S352-S356 PolarHBondContact O-N 3.16Å; S352-S356 VanDerWaalsContact O-N 3.11Å; S353-S356 PolarHBondContact O-N 2.97Å; V354-S356 VanDerWaalsContact C-N 3.33Å; V354-S356 PolarHBondContact O-N 3.35Å; S356-R360 PolarHBondContact O-N 2.8Å
357	L	68	Low	61.8	Low	106 Å²	106	105.8 Å²	105.8	56%	0.555	58%	0.578	S	S	*	*	H	α-helix	trans	-69.9	-37.1	174.2	-71.4	169	0	0	0	111.6	S353 V354 R360 V361	S353-L357 PolarHBondContact O-N 3.41Å; V354-L357 PolarHBondContact O-N 3.44Å; L357-R360 PolarHBondContact O-N 2.79Å; L357-V361 WeakPolarHBondContact O-CG2 3.41Å; L357-V361 PolarHBondContact O-N 3.4Å
358	Q	59.2	Low	60	Low	108 Å²	108	109.4 Å²	109.4	51%	0.505	59%	0.589	S	S	.	*	H	α-helix	trans	-64.8	-37.2	174.3	-84	169.3	-46.3	0	0	112.7	V354 E355 R360 V361 T362	V354-Q358 WeakPolarHBondContact O-CB 3.38Å; V354-Q358 WeakPolarHBondContact O-CG 3.24Å; V354-Q358 PolarHBondContact O-N 2.86Å; V354-Q358 PolarHBondContact O-OE1 3.4Å; E355-Q358 PolarHBondContact O-N 2.95Å; Q358-R360 PolarHBondContact O-N 3.47Å; Q358-V361 PolarHBondContact O-N 3.28Å; Q358-V361 VanDerWaalsContact O-N 3.12Å; Q358-T362 PolarHBondContact O-N 3.18Å; Q358-T362 PolarHBondContact O-OG1 2.92Å
359	N	57.8	Low	58.3	Low	113 Å²	113	114.5 Å²	114.5	60%	0.604	61%	0.608	S	S	*	*	H	α-helix	trans	-63.3	-26.2	174.3	-73.7	-18	0	0	0	113.1	E355 T362	E355-N359 VanDerWaalsContact O-CG 3.26Å; E355-N359 PolarHBondContact O-N 3.12Å; E355-N359 PolarHBondContact O-ND2 3.41Å; N359-T362 VanDerWaalsContact CA-OG1 3.26Å; N359-T362 WeakPolarHBondContact CA-OG1 3.48Å; N359-T362 PolarHBondContact O-OG1 3.15Å
360	R	58.8	Low	56.7	Low	189 Å²	189	116 Å²	116	71%	0.713	62%	0.618	S	S	*	*	H	α-helix	trans	-84.1	-21.1	174.9	-66.8	178.2	62.2	-175.3	-1.9	113.4	S356 L357 Q358	S356-R360 PolarHBondContact O-N 2.8Å; L357-R360 PolarHBondContact O-N 2.79Å; Q358-R360 PolarHBondContact O-N 3.47Å
361	V	51	Low	55.4	Low	96 Å²	96	115 Å²	115	58%	0.582	63%	0.63	S	S	*	*	H	α-helix	trans	-86.1	-27	176.2	172.4	0	0	0	0	111.1	L357 Q358 L364	L357-V361 WeakPolarHBondContact O-CG2 3.41Å; L357-V361 PolarHBondContact O-N 3.4Å; Q358-V361 PolarHBondContact O-N 3.28Å; Q358-V361 VanDerWaalsContact O-N 3.12Å; V361-L364 PolarHBondContact O-N 3.15Å
362	T	47	Very low	54	Low	95 Å²	95	114 Å²	114	58%	0.583	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-9.3	-178	31.3	0	0	0	0	115.4	Q358 N359 L364	Q358-T362 PolarHBondContact O-N 3.18Å; Q358-T362 PolarHBondContact O-OG1 2.92Å; N359-T362 VanDerWaalsContact CA-OG1 3.26Å; N359-T362 WeakPolarHBondContact CA-OG1 3.48Å; N359-T362 PolarHBondContact O-OG1 3.15Å; T362-L364 PolarHBondContact O-N 3.25Å
363	E	46.7	Very low	52.4	Low	179 Å²	179	119.3 Å²	119.3	84%	0.836	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-6.6	166.8	-81.3	-174.1	160	0	0	113.3
364	L	42.7	Very low	51	Low	148 Å²	148	121.7 Å²	121.7	78%	0.775	68%	0.675	S	S	*	*	S	Bend	trans	-108.6	-17	-173.7	-79.1	170.5	0	0	0	116.6	V361 T362	V361-L364 PolarHBondContact O-N 3.15Å; T362-L364 PolarHBondContact O-N 3.25Å
365	E	38	Very low	49.7	Very low	167 Å²	167	122.2 Å²	122.2	78%	0.78	69%	0.687	S	S	*	*			trans	-140.4	119.3	-172.5	-65.7	-176.3	160.1	0	0	113
366	S	47	Very low	48.6	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	71%	0.708	S	S	*	*			trans	-76.8	154.2	176.3	57.3	0	0	0	0	113.5
367	V	36.8	Very low	47.5	Very low	133 Å²	133	129.8 Å²	129.8	81%	0.806	71%	0.708	S	S	*	*			trans	107.7	96.7	155.8	-171.6	0	0	0	0	117.4
368	D	33.8	Very low	46.8	Very low	130 Å²	130	127.8 Å²	127.8	70%	0.695	70%	0.701	S	S	*	*				39.9	139.1	126.3	-148.3	18.4	0	0	0	124.3
369	K	37.4	Very low	46.7	Very low	177 Å²	177	124.3 Å²	124.3	77%	0.77	69%	0.694	S	S	*	*			trans	73.5	133.9	165.7	-51.2	-170	-175.3	173.8	0	117.5
370	S	41.9	Very low	46.7	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	69%	0.688	S	S	*	*			cis	-167.5	150.3	8.6	38.4	0	0	0	0	110.8
371	A	47.2	Very low	46.6	Very low	104 Å²	104	119.8 Å²	119.8	86%	0.86	68%	0.683	S	S	*	*			trans	27	109.9	138	0	0	0	0	0	118.8
372	G	48.8	Very low	47.2	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	68%	0.683	S	S	*	*			trans	-173.6	-27	165.3	0	0	0	0	0	115.9
373	Q	42.1	Very low	48	Very low	174 Å²	174	119.8 Å²	119.8	81%	0.813	68%	0.677	S	S	*	*	S	Bend	trans	-100.6	-13.1	-171.7	-106.4	158.3	-23	0	0	116.1	A375	Q373-A375 VanDerWaalsContact C-N 3.28Å; Q373-A375 PolarHBondContact O-N 3.35Å
374	V	48.2	Very low	49.1	Very low	118 Å²	118	116.2 Å²	116.2	72%	0.715	66%	0.661	S	S	*	*	H	α-helix	trans	-67.5	-28.1	179.5	-179.3	0	0	0	0	111.8	R376 T378	V374-R376 PolarHBondContact O-N 3.17Å; V374-T378 WeakPolarHBondContact O-CB 3.48Å; V374-T378 PolarHBondContact O-N 2.81Å; V374-T378 PolarHBondContact O-OG1 2.91Å
375	A	46.8	Very low	50.6	Low	83 Å²	83	114.7 Å²	114.7	69%	0.686	65%	0.653	S	S	*	*	H	α-helix	trans	-71.3	-28.6	-177.5	0	0	0	0	0	114.7	Q373	Q373-A375 VanDerWaalsContact C-N 3.28Å; Q373-A375 PolarHBondContact O-N 3.35Å
376	R	48.7	Very low	52.2	Low	221 Å²	221	109.8 Å²	109.8	83%	0.834	64%	0.637	S	S	*	*	H	α-helix	trans	-87	-36.1	-175.1	-108.1	178.4	165.2	171.2	-5.1	113.8	V374 L380	V374-R376 PolarHBondContact O-N 3.17Å; R376-L380 PolarHBondContact O-N 3.2Å
377	N	48.8	Very low	53.5	Low	96 Å²	96	110.1 Å²	110.1	51%	0.513	62%	0.621	S	S	.	*	H	α-helix	trans	-75.8	-31.8	175.3	-76.7	4.6	0	0	0	112	L380 L381	N377-L380 PolarHBondContact O-N 3.49Å; N377-L381 WeakPolarHBondContact O-CD1 3.44Å; N377-L381 PolarHBondContact O-N 3.12Å
378	T	53.4	Low	55.4	Low	64 Å²	64	108.1 Å²	108.1	39%	0.393	60%	0.603	S	S	.	*	H	α-helix	trans	-63.6	-42.2	174.2	-50.1	0	0	0	0	110.9	V374 L380 L381 E382	V374-T378 WeakPolarHBondContact O-CB 3.48Å; V374-T378 PolarHBondContact O-N 2.81Å; V374-T378 PolarHBondContact O-OG1 2.91Å; T378-L380 VanDerWaalsContact C-N 3.33Å; T378-L380 PolarHBondContact O-N 3.47Å; T378-L381 PolarHBondContact O-N 3.25Å; T378-E382 HydrophobicContact CG2-CG 4.44Å; T378-E382 VanDerWaalsContact O-CB 3.31Å; T378-E382 WeakPolarHBondContact O-CB 3.23Å; T378-E382 WeakPolarHBondContact O-CG 3.49Å; T378-E382 PolarHBondContact O-N 3.02Å
379	G	58.6	Low	57.5	Low	35 Å²	35	107.2 Å²	107.2	36%	0.361	60%	0.598	S	S	.	*	H	α-helix	trans	-65.1	-30.9	176.3	0	0	0	0	0	114.5	S383	G379-S383 WeakPolarHBondContact O-CB 3.39Å; G379-S383 PolarHBondContact O-N 2.92Å
380	L	57.8	Low	59.4	Low	92 Å²	92	105.1 Å²	105.1	48%	0.482	59%	0.591	S	S	.	*	H	α-helix	trans	-77.7	-39.7	177.7	-145.5	140.2	0	0	0	111.2	R376 N377 T378 S383 Q384	R376-L380 PolarHBondContact O-N 3.2Å; N377-L380 PolarHBondContact O-N 3.49Å; T378-L380 VanDerWaalsContact C-N 3.33Å; T378-L380 PolarHBondContact O-N 3.47Å; L380-S383 PolarHBondContact O-N 3.29Å; L380-S383 PolarHBondContact O-OG 3.47Å; L380-Q384 WeakPolarHBondContact O-CG 3.49Å; L380-Q384 PolarHBondContact O-N 3.42Å
381	L	56.5	Low	61.2	Low	116 Å²	116	104.4 Å²	104.4	61%	0.607	58%	0.577	S	S	*	*	H	α-helix	trans	-65.5	-38.4	169.7	-94.6	111.2	0	0	0	112.5	N377 T378 S383 Q384 L385	N377-L381 WeakPolarHBondContact O-CD1 3.44Å; N377-L381 PolarHBondContact O-N 3.12Å; T378-L381 PolarHBondContact O-N 3.25Å; L381-S383 VanDerWaalsContact C-N 3.34Å; L381-Q384 PolarHBondContact O-N 3.15Å; L381-L385 VanDerWaalsContact O-CB 3.32Å; L381-L385 WeakPolarHBondContact O-CB 3.26Å; L381-L385 WeakPolarHBondContact O-CG 3.29Å; L381-L385 PolarHBondContact O-N 3.21Å
382	E	62.8	Low	62.8	Low	123 Å²	123	104.2 Å²	104.2	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-62.4	-40.5	172.8	-82.1	175.5	155.5	0	0	111.4	T378 L385 S386	T378-E382 HydrophobicContact CG2-CG 4.44Å; T378-E382 VanDerWaalsContact O-CB 3.31Å; T378-E382 WeakPolarHBondContact O-CB 3.23Å; T378-E382 WeakPolarHBondContact O-CG 3.49Å; T378-E382 PolarHBondContact O-N 3.02Å; E382-L385 PolarHBondContact O-N 2.95Å; E382-S386 VanDerWaalsContact O-CB 3.26Å; E382-S386 WeakPolarHBondContact O-CB 3.33Å; E382-S386 PolarHBondContact O-N 2.93Å
383	S	63.1	Low	64.5	Low	68 Å²	68	103.8 Å²	103.8	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-35.7	175.8	77.7	0	0	0	0	112.8	G379 L380 L381 R387	G379-S383 WeakPolarHBondContact O-CB 3.39Å; G379-S383 PolarHBondContact O-N 2.92Å; L380-S383 PolarHBondContact O-N 3.29Å; L380-S383 PolarHBondContact O-OG 3.47Å; L381-S383 VanDerWaalsContact C-N 3.34Å; S383-R387 WeakPolarHBondContact O-CB 3.48Å; S383-R387 PolarHBondContact O-N 3.17Å
384	Q	71.1	Confident	66.5	Low	103 Å²	103	99 Å²	99	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-72.5	-40.6	175	-72.1	-138.8	-2.7	0	0	112.4	L380 L381 R387 H388	L380-Q384 WeakPolarHBondContact O-CG 3.49Å; L380-Q384 PolarHBondContact O-N 3.42Å; L381-Q384 PolarHBondContact O-N 3.15Å; Q384-R387 PolarHBondContact O-N 3.3Å; Q384-H388 PolarHBondContact O-N 3.39Å
385	L	72.8	Confident	68.1	Low	116 Å²	116	97.5 Å²	97.5	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-61.3	-44.5	172.7	-84.1	162.2	0	0	0	110.8	L381 E382 R387 H388 D389	L381-L385 VanDerWaalsContact O-CB 3.32Å; L381-L385 WeakPolarHBondContact O-CB 3.26Å; L381-L385 WeakPolarHBondContact O-CG 3.29Å; L381-L385 PolarHBondContact O-N 3.21Å; E382-L385 PolarHBondContact O-N 2.95Å; L385-R387 VanDerWaalsContact C-N 3.33Å; L385-R387 PolarHBondContact O-N 3.19Å; L385-H388 PolarHBondContact O-N 3.03Å; L385-D389 VanDerWaalsContact O-CB 3.29Å; L385-D389 WeakPolarHBondContact O-CB 3.32Å; L385-D389 PolarHBondContact O-N 3.05Å
386	S	71.9	Confident	69.7	Low	65 Å²	65	98.5 Å²	98.5	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-37.9	175.9	-176.9	0	0	0	0	112.6	E382 D389 Q390	E382-S386 VanDerWaalsContact O-CB 3.26Å; E382-S386 WeakPolarHBondContact O-CB 3.33Å; E382-S386 PolarHBondContact O-N 2.93Å; S386-D389 PolarHBondContact O-N 3.14Å; S386-Q390 WeakPolarHBondContact O-CG 3.31Å; S386-Q390 PolarHBondContact O-N 2.86Å
387	R	75.3	Confident	71.5	Confident	117 Å²	117	93.2 Å²	93.2	44%	0.442	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-40.9	174.7	-171.7	-177.2	67.3	85.8	4.7	112.4	S383 Q384 L385 M391	S383-R387 WeakPolarHBondContact O-CB 3.48Å; S383-R387 PolarHBondContact O-N 3.17Å; Q384-R387 PolarHBondContact O-N 3.3Å; L385-R387 VanDerWaalsContact C-N 3.33Å; L385-R387 PolarHBondContact O-N 3.19Å; R387-M391 PolarHBondContact O-N 3.2Å
388	H	76.6	Confident	73	Confident	91 Å²	91	96.8 Å²	96.8	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-68	-37.7	175.3	-79.2	-160.3	0	0	0	111.4	Q384 L385 M391 L392	Q384-H388 PolarHBondContact O-N 3.39Å; L385-H388 PolarHBondContact O-N 3.03Å; H388-M391 WeakPolarHBondContact O-CB 3.48Å; H388-M391 PolarHBondContact O-N 3.03Å; H388-L392 WeakPolarHBondContact O-CB 3.07Å; H388-L392 WeakPolarHBondContact O-CG 3.39Å; H388-L392 PolarHBondContact O-N 2.95Å
389	D	76.8	Confident	74.2	Confident	111 Å²	111	98.6 Å²	98.6	59%	0.594	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-42.7	175.5	-165.7	58.9	0	0	0	111.8	L385 S386 M391 L392 S393	L385-D389 VanDerWaalsContact O-CB 3.29Å; L385-D389 WeakPolarHBondContact O-CB 3.32Å; L385-D389 PolarHBondContact O-N 3.05Å; S386-D389 PolarHBondContact O-N 3.14Å; D389-M391 VanDerWaalsContact C-N 3.33Å; D389-M391 PolarHBondContact O-N 3.35Å; D389-L392 PolarHBondContact O-N 3.4Å; D389-S393 WeakPolarHBondContact O-CB 3.36Å; D389-S393 PolarHBondContact O-N 2.97Å
390	Q	77.3	Confident	75.1	Confident	133 Å²	133	99.9 Å²	99.9	62%	0.621	52%	0.516	S	S	*	.	H	α-helix	trans	-61.1	-40.3	170.6	-78.9	-178.9	-4	0	0	112.6	S386 S393 V394	S386-Q390 WeakPolarHBondContact O-CG 3.31Å; S386-Q390 PolarHBondContact O-N 2.86Å; Q390-S393 PolarHBondContact O-N 3.15Å; Q390-V394 WeakPolarHBondContact O-CG2 3.36Å; Q390-V394 PolarHBondContact O-N 3.48Å
391	M	80	Confident	76.1	Confident	92 Å²	92	100.6 Å²	100.6	45%	0.453	52%	0.52	S	S	.	.	H	α-helix	trans	-67.5	-40.8	177.8	-173.6	179.1	-68.5	0	0	112	R387 H388 D389 V394 H395	R387-M391 PolarHBondContact O-N 3.2Å; H388-M391 WeakPolarHBondContact O-CB 3.48Å; H388-M391 PolarHBondContact O-N 3.03Å; D389-M391 VanDerWaalsContact C-N 3.33Å; D389-M391 PolarHBondContact O-N 3.35Å; M391-V394 PolarHBondContact O-N 3.49Å; M391-H395 PolarHBondContact O-N 3.14Å
392	L	81.1	Confident	76.9	Confident	100 Å²	100	99.6 Å²	99.6	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-43.2	174.2	-73	170.7	0	0	0	110.8	H388 D389 V394 H395 D396	H388-L392 WeakPolarHBondContact O-CB 3.07Å; H388-L392 WeakPolarHBondContact O-CG 3.39Å; H388-L392 PolarHBondContact O-N 2.95Å; D389-L392 PolarHBondContact O-N 3.4Å; L392-V394 VanDerWaalsContact C-N 3.32Å; L392-V394 PolarHBondContact O-N 3.45Å; L392-H395 CarbonylContact O-C 3.56Å; L392-H395 PolarHBondContact O-N 2.85Å; L392-H395 VanDerWaalsContact O-N 3.08Å; L392-D396 PolarHBondContact O-N 3.46Å
393	S	84.7	Confident	77.5	Confident	62 Å²	62	99 Å²	99	43%	0.434	51%	0.514	S	S	.	.	H	α-helix	trans	-58.3	-41.9	173.8	-178.1	0	0	0	0	112.4	D389 Q390 D396 I397	D389-S393 WeakPolarHBondContact O-CB 3.36Å; D389-S393 PolarHBondContact O-N 2.97Å; Q390-S393 PolarHBondContact O-N 3.15Å; S393-D396 PolarHBondContact O-N 3.08Å; S393-I397 WeakPolarHBondContact O-CD1 3.37Å; S393-I397 WeakPolarHBondContact O-CG1 3.28Å; S393-I397 PolarHBondContact O-N 3.44Å
394	V	84.8	Confident	78	Confident	72 Å²	72	100.4 Å²	100.4	44%	0.436	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-39.3	174.6	172.4	0	0	0	0	111.8	Q390 M391 L392 I397 R398	Q390-V394 WeakPolarHBondContact O-CG2 3.36Å; Q390-V394 PolarHBondContact O-N 3.48Å; M391-V394 PolarHBondContact O-N 3.49Å; L392-V394 VanDerWaalsContact C-N 3.32Å; L392-V394 PolarHBondContact O-N 3.45Å; V394-I397 PolarHBondContact O-N 3.41Å; V394-R398 WeakPolarHBondContact O-CG 3.48Å; V394-R398 PolarHBondContact O-N 3.48Å
395	H	81.8	Confident	78.4	Confident	87 Å²	87	103.8 Å²	103.8	40%	0.403	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-39.9	175	-72.6	160.8	0	0	0	112.3	M391 L392 I397 R398 L399	M391-H395 PolarHBondContact O-N 3.14Å; L392-H395 CarbonylContact O-C 3.56Å; L392-H395 PolarHBondContact O-N 2.85Å; L392-H395 VanDerWaalsContact O-N 3.08Å; H395-I397 VanDerWaalsContact C-N 3.32Å; H395-I397 PolarHBondContact O-N 3.42Å; H395-R398 PolarHBondContact O-N 3.27Å; H395-R398 VanDerWaalsContact O-N 3.15Å; H395-L399 WeakPolarHBondContact O-CB 3.16Å; H395-L399 WeakPolarHBondContact O-CG 3.5Å; H395-L399 PolarHBondContact O-N 2.87Å
396	D	80.5	Confident	78.6	Confident	104 Å²	104	103.4 Å²	103.4	56%	0.556	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-41.6	174.7	-73.8	-22.9	0	0	0	111.2	L392 S393 R398 L399 A400	L392-D396 PolarHBondContact O-N 3.46Å; S393-D396 PolarHBondContact O-N 3.08Å; D396-R398 PolarHBondContact O-N 2.95Å; D396-L399 PolarHBondContact O-N 3.05Å; D396-A400 WeakPolarHBondContact O-CB 3.47Å; D396-A400 PolarHBondContact O-N 2.97Å
397	I	85.1	Confident	78.8	Confident	111 Å²	111	105.4 Å²	105.4	57%	0.569	52%	0.52	S	S	*	.	H	α-helix	trans	-61.4	-43.7	173.9	-67.1	163	0	0	0	110.9	S393 V394 H395 A400 D401	S393-I397 WeakPolarHBondContact O-CD1 3.37Å; S393-I397 WeakPolarHBondContact O-CG1 3.28Å; S393-I397 PolarHBondContact O-N 3.44Å; V394-I397 PolarHBondContact O-N 3.41Å; H395-I397 VanDerWaalsContact C-N 3.32Å; H395-I397 PolarHBondContact O-N 3.42Å; I397-A400 PolarHBondContact O-N 3.34Å; I397-D401 WeakPolarHBondContact O-CB 3.08Å; I397-D401 PolarHBondContact O-N 3.33Å
398	R	82.1	Confident	79	Confident	171 Å²	171	102.1 Å²	102.1	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-67.5	-39.2	177.8	-76.4	-177.2	176.5	-176.1	-0	112.8	V394 H395 D396 A400 D401 M402	V394-R398 WeakPolarHBondContact O-CG 3.48Å; V394-R398 PolarHBondContact O-N 3.48Å; H395-R398 PolarHBondContact O-N 3.27Å; H395-R398 VanDerWaalsContact O-N 3.15Å; D396-R398 PolarHBondContact O-N 2.95Å; R398-A400 VanDerWaalsContact C-N 3.34Å; R398-D401 PolarHBondContact O-N 3.1Å; R398-M402 VanDerWaalsContact O-CB 3.3Å; R398-M402 WeakPolarHBondContact O-CB 3.49Å; R398-M402 PolarHBondContact O-N 3.39Å
399	L	78.1	Confident	79.1	Confident	101 Å²	101	102.4 Å²	102.4	53%	0.529	52%	0.517	S	S	.	.	H	α-helix	trans	-64.6	-42.1	175.8	-73.6	173.1	0	0	0	110.3	H395 D396 M402 D403	H395-L399 WeakPolarHBondContact O-CB 3.16Å; H395-L399 WeakPolarHBondContact O-CG 3.5Å; H395-L399 PolarHBondContact O-N 2.87Å; D396-L399 PolarHBondContact O-N 3.05Å; L399-M402 HydrophobicContact CD2-CE 4.19Å; L399-M402 PolarHBondContact O-N 3.02Å; L399-D403 WeakPolarHBondContact O-CB 3.47Å; L399-D403 PolarHBondContact O-N 3.22Å
400	A	77	Confident	79.3	Confident	63 Å²	63	105 Å²	105	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-41.6	174.2	0	0	0	0	0	112.7	D396 I397 R398 D403 L404	D396-A400 WeakPolarHBondContact O-CB 3.47Å; D396-A400 PolarHBondContact O-N 2.97Å; I397-A400 PolarHBondContact O-N 3.34Å; R398-A400 VanDerWaalsContact C-N 3.34Å; A400-D403 PolarHBondContact O-N 3.46Å; A400-L404 WeakPolarHBondContact O-CB 3.26Å; A400-L404 PolarHBondContact O-N 2.9Å
401	D	78.8	Confident	79.4	Confident	107 Å²	107	101.7 Å²	101.7	57%	0.572	51%	0.514	S	S	*	.	H	α-helix	trans	-64.1	-41.1	174.6	-175.8	63.7	0	0	0	111.8	I397 R398 L404 R405	I397-D401 WeakPolarHBondContact O-CB 3.08Å; I397-D401 PolarHBondContact O-N 3.33Å; R398-D401 PolarHBondContact O-N 3.1Å; D401-L404 PolarHBondContact O-N 3.24Å; D401-R405 WeakPolarHBondContact O-CB 3.49Å; D401-R405 PolarHBondContact O-N 2.86Å
402	M	73.7	Confident	79.6	Confident	94 Å²	94	98.3 Å²	98.3	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-67.9	-40.1	177.8	-161.1	179.4	65	0	0	111.8	R398 L399 R405 F406	R398-M402 VanDerWaalsContact O-CB 3.3Å; R398-M402 WeakPolarHBondContact O-CB 3.49Å; R398-M402 PolarHBondContact O-N 3.39Å; L399-M402 HydrophobicContact CD2-CE 4.19Å; L399-M402 PolarHBondContact O-N 3.02Å; M402-R405 WeakPolarHBondContact O-CB 3.44Å; M402-R405 PolarHBondContact O-N 3.45Å; M402-F406 HydrophobicContact CE-CE2 3.99Å; M402-F406 HydrophobicContact CG-CD2 4.04Å; M402-F406 HydrophobicContact CG-CE2 3.68Å; M402-F406 WeakPolarHBondContact O-CD2 3.46Å; M402-F406 PolarHBondContact O-N 3.46Å; M402-F406 HydrophobicContact SD-CE2 4.06Å
403	D	75.9	Confident	80.2	Confident	112 Å²	112	94.9 Å²	94.9	60%	0.599	49%	0.485	S	S	*	.	H	α-helix	trans	-62.9	-42.6	174.8	-164.5	51.5	0	0	0	111.4	L399 A400 R405 F406 Q407	L399-D403 WeakPolarHBondContact O-CB 3.47Å; L399-D403 PolarHBondContact O-N 3.22Å; A400-D403 PolarHBondContact O-N 3.46Å; D403-R405 VanDerWaalsContact C-N 3.32Å; D403-R405 PolarHBondContact O-N 3.2Å; D403-F406 PolarHBondContact O-N 3.37Å; D403-Q407 PolarHBondContact O-N 3.46Å
404	L	73.9	Confident	80.6	Confident	96 Å²	96	95.9 Å²	95.9	50%	0.503	48%	0.48	S	S	.	.	H	α-helix	trans	-59.9	-42.5	172.3	-177	65	0	0	0	111.5	A400 D401 Q407 V408	A400-L404 WeakPolarHBondContact O-CB 3.26Å; A400-L404 PolarHBondContact O-N 2.9Å; D401-L404 PolarHBondContact O-N 3.24Å; L404-Q407 PolarHBondContact O-N 3.27Å; L404-V408 WeakPolarHBondContact O-CG2 3.41Å; L404-V408 PolarHBondContact O-N 3.13Å
405	R	78.8	Confident	81	Confident	175 Å²	175	96.9 Å²	96.9	66%	0.66	48%	0.483	S	S	*	.	H	α-helix	trans	-64.6	-39.7	176.9	-171.1	175.2	179.2	176.8	0.3	112.1	D401 M402 D403 V408 L409	D401-R405 WeakPolarHBondContact O-CB 3.49Å; D401-R405 PolarHBondContact O-N 2.86Å; M402-R405 WeakPolarHBondContact O-CB 3.44Å; M402-R405 PolarHBondContact O-N 3.45Å; D403-R405 VanDerWaalsContact C-N 3.32Å; D403-R405 PolarHBondContact O-N 3.2Å; R405-V408 PolarHBondContact O-N 3.36Å; R405-L409 HydrophobicContact CG-CD1 4.48Å; R405-L409 WeakPolarHBondContact O-CG 3.34Å; R405-L409 PolarHBondContact O-N 3.47Å
406	F	77	Confident	81.6	Confident	107 Å²	107	92.7 Å²	92.7	47%	0.469	46%	0.464	S	S	.	.	H	α-helix	trans	-63.2	-46.8	174.1	-82.9	-64.8	0	0	0	111.5	M402 D403 V408 L409 E410	M402-F406 HydrophobicContact CE-CE2 3.99Å; M402-F406 HydrophobicContact CG-CD2 4.04Å; M402-F406 HydrophobicContact CG-CE2 3.68Å; M402-F406 WeakPolarHBondContact O-CD2 3.46Å; M402-F406 PolarHBondContact O-N 3.46Å; M402-F406 HydrophobicContact SD-CE2 4.06Å; D403-F406 PolarHBondContact O-N 3.37Å; F406-V408 VanDerWaalsContact C-N 3.27Å; F406-V408 PolarHBondContact O-N 3.16Å; F406-L409 PolarHBondContact O-N 3.18Å; F406-E410 WeakPolarHBondContact O-CG 3.47Å; F406-E410 PolarHBondContact O-N 3.45Å
407	Q	75.9	Confident	82.4	Confident	108 Å²	108	89.6 Å²	89.6	51%	0.505	45%	0.448	S	S	.	.	H	α-helix	trans	-59.9	-38	178.1	-168.9	177.3	34.3	0	0	112.5	D403 L404 T411	D403-Q407 PolarHBondContact O-N 3.46Å; L404-Q407 PolarHBondContact O-N 3.27Å; Q407-T411 PolarHBondContact O-N 2.82Å; Q407-T411 PolarHBondContact O-OG1 2.78Å
408	V	79.8	Confident	83	Confident	47 Å²	47	84.3 Å²	84.3	29%	0.285	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-43.2	173.9	167.2	0	0	0	0	111.4	L404 R405 F406 T411 A412 P444	L404-V408 WeakPolarHBondContact O-CG2 3.41Å; L404-V408 PolarHBondContact O-N 3.13Å; R405-V408 PolarHBondContact O-N 3.36Å; F406-V408 VanDerWaalsContact C-N 3.27Å; F406-V408 PolarHBondContact O-N 3.16Å; V408-T411 PolarHBondContact O-N 2.68Å; V408-T411 PolarHBondContact O-OG1 2.69Å; V408-A412 WeakPolarHBondContact O-CB 3.43Å; V408-A412 PolarHBondContact O-N 3.09Å; V408-P444 HydrophobicContact CG1-CG 4.33Å
409	L	77.4	Confident	83.7	Confident	97 Å²	97	80.2 Å²	80.2	51%	0.508	41%	0.411	S	S	.	.	H	α-helix	trans	-67.2	-39.9	179.3	-74.3	169.3	0	0	0	112.8	R405 F406 T411 A412	R405-L409 HydrophobicContact CG-CD1 4.48Å; R405-L409 WeakPolarHBondContact O-CG 3.34Å; R405-L409 PolarHBondContact O-N 3.47Å; F406-L409 PolarHBondContact O-N 3.18Å; L409-T411 PolarHBondContact O-N 3.4Å; L409-A412 PolarHBondContact O-N 3.18Å
410	E	81.1	Confident	84.6	Confident	167 Å²	167	76.4 Å²	76.4	78%	0.78	39%	0.39	S	S	*	.	H	α-helix	trans	-64.4	-25.6	178.1	-72.9	-174.7	152.2	0	0	113.1	F406	F406-E410 WeakPolarHBondContact O-CG 3.47Å; F406-E410 PolarHBondContact O-N 3.45Å
411	T	80.9	Confident	85.4	Confident	62 Å²	62	77.7 Å²	77.7	38%	0.38	38%	0.384	S	S	.	.	H	α-helix	trans	-108.9	-1.5	-175.2	58.4	0	0	0	0	113.7	Q407 V408 L409 Q443	Q407-T411 PolarHBondContact O-N 2.82Å; Q407-T411 PolarHBondContact O-OG1 2.78Å; V408-T411 PolarHBondContact O-N 2.68Å; V408-T411 PolarHBondContact O-OG1 2.69Å; L409-T411 PolarHBondContact O-N 3.4Å; T411-Q443 PolarHBondContact O-NE2 3.29Å; T411-Q443 WeakPolarHBondContact OG1-CB 3.23Å; T411-Q443 WeakPolarHBondContact OG1-CG 3.49Å
412	A	84	Confident	86.3	Confident	22 Å²	22	72.8 Å²	72.8	18%	0.182	36%	0.358	C	S	.	.			trans	-68.1	141.6	177.3	0	0	0	0	0	111.3	V408 L409 Y414 Y446	V408-A412 WeakPolarHBondContact O-CB 3.43Å; V408-A412 PolarHBondContact O-N 3.09Å; L409-A412 PolarHBondContact O-N 3.18Å; A412-Y414 HydrophobicContact CB-CE2 4.18Å; A412-Y446 HydrophobicContact CB-CE2 4.42Å
413	S	92.5	Very high	87.3	Confident	28 Å²	28	74.3 Å²	74.3	20%	0.196	36%	0.358	C	S	.	.			trans	-125.2	145.8	178.5	177.2	0	0	0	0	110.2	N415 V417 Y446	S413-N415 PolarHBondContact OG-OD1 3.33Å; S413-V417 WeakPolarHBondContact CB-O 3.32Å; S413-V417 PolarHBondContact OG-O 3.24Å; S413-Y446 WeakPolarHBondContact O-CD2 3.32Å; S413-Y446 PolarHBondContact O-N 3.27Å
414	Y	93.9	Very high	88.3	Confident	83 Å²	83	72 Å²	72	33%	0.325	35%	0.346	S	S	.	.	S	Bend	trans	-125	25.1	-171.7	-61.2	-86.2	0	0	0	113.5	A412 Y446 G448 Y449	A412-Y414 HydrophobicContact CB-CE2 4.18Å; Y414-Y446 CarbonylContact C-O 3.46Å; Y414-Y446 WeakPolarHBondContact CA-O 3.42Å; Y414-Y446 AromaticContact CD1-CD2 3.77Å; Y414-Y446 HydrophobicContact CD1-CD2 3.77Å; Y414-Y446 AromaticContact CD1-CG 3.93Å; Y414-Y446 HydrophobicContact CD1-CG 3.93Å; Y414-Y446 AromaticContact CE1-CD2 3.58Å; Y414-Y446 HydrophobicContact CE1-CD2 3.58Å; Y414-Y446 AromaticContact CE1-CE2 3.96Å; Y414-Y446 HydrophobicContact CE1-CE2 3.96Å; Y414-Y446 HydrophobicContact CE1-CG 4Å; Y414-G448 WeakPolarHBondContact O-CA 3.34Å; Y414-Y449 HydrophobicContact CD1-CD1 4.17Å; Y414-Y449 HydrophobicContact CD2-CE1 4.3Å; Y414-Y449 HydrophobicContact CG-CD1 4.14Å; Y414-Y449 HydrophobicContact CG-CE1 4.3Å
415	N	92.9	Very high	89.4	Confident	92 Å²	92	67.5 Å²	67.5	49%	0.492	32%	0.322	S	S	.	.	S	Bend	trans	-129.9	19.1	-177.4	67.4	-2.6	0	0	0	113.1	S413 V417 Y446	S413-N415 PolarHBondContact OG-OD1 3.33Å; N415-V417 VanDerWaalsContact C-N 3.26Å; N415-V417 PolarHBondContact O-N 3.04Å; N415-V417 VanDerWaalsContact OD1-CB 3.31Å; N415-V417 WeakPolarHBondContact OD1-CB 3.33Å; N415-V417 PolarHBondContact OD1-N 3.11Å; N415-Y446 PolarHBondContact N-O 3.15Å
416	G	95	Very high	90.1	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	75.6	7.2	-176.4	0	0	0	0	0	114.6	F445 Y446 I559 V560	G416-F445 WeakPolarHBondContact O-CE2 3.44Å; G416-Y446 WeakPolarHBondContact CA-O 3.31Å; G416-Y446 PolarHBondContact N-O 3.47Å; G416-I559 CarbonylContact O-C 3.57Å; G416-I559 WeakPolarHBondContact O-CA 3.38Å; G416-V560 PolarHBondContact O-N 3.44Å
417	V	96.9	Very high	91.1	Very high	38 Å²	38	67.4 Å²	67.4	23%	0.23	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.9	-179.9	-174	0	0	0	0	111.5	S413 N415 K557 V558 I559	S413-V417 WeakPolarHBondContact CB-O 3.32Å; S413-V417 PolarHBondContact OG-O 3.24Å; N415-V417 VanDerWaalsContact C-N 3.26Å; N415-V417 PolarHBondContact O-N 3.04Å; N415-V417 VanDerWaalsContact OD1-CB 3.31Å; N415-V417 WeakPolarHBondContact OD1-CB 3.33Å; N415-V417 PolarHBondContact OD1-N 3.11Å; V417-K557 HydrophobicContact CG1-CG 4.47Å; V417-V558 WeakPolarHBondContact CA-O 3.44Å; V417-I559 HydrophobicContact CG1-CG1 4.49Å; V417-I559 HydrophobicContact CG2-CG2 4.4Å
418	L	97.3	Very high	92.1	Very high	1 Å²	1	66 Å²	66	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.3	169.8	175.5	66.7	0	0	0	110.1	W420 S442 Q443 F445 A456 K557 V558	L418-W420 HydrophobicContact CD2-CB 4.33Å; L418-W420 HydrophobicContact CG-CB 4.27Å; L418-S442 VanDerWaalsContact CD2-OG 3.31Å; L418-S442 WeakPolarHBondContact CD2-OG 3.48Å; L418-Q443 HydrophobicContact CD1-CG 4.03Å; L418-F445 HydrophobicContact CB-CB 4.22Å; L418-F445 HydrophobicContact CB-CD1 3.74Å; L418-F445 HydrophobicContact CB-CD2 3.93Å; L418-F445 HydrophobicContact CB-CE1 4.02Å; L418-F445 HydrophobicContact CB-CE2 4.19Å; L418-F445 HydrophobicContact CB-CG 3.7Å; L418-F445 HydrophobicContact CB-CZ 4.24Å; L418-F445 HydrophobicContact CD1-CB 4.27Å; L418-F445 HydrophobicContact CD1-CD1 4.25Å; L418-F445 HydrophobicContact CD1-CG 4.43Å; L418-F445 HydrophobicContact CD2-CD1 3.92Å; L418-F445 HydrophobicContact CD2-CE1 3.99Å; L418-F445 HydrophobicContact CG-CD1 4.18Å; L418-F445 HydrophobicContact CG-CG 4.48Å; L418-A456 HydrophobicContact CD2-CB 3.82Å; L418-K557 VanDerWaalsContact O-CA 3.27Å; L418-K557 WeakPolarHBondContact O-CA 3.37Å; L418-V558 HydrophobicContact CB-CB 4.06Å; L418-V558 HydrophobicContact CD2-CB 4.3Å; L418-V558 HydrophobicContact CD2-CG2 4.08Å; L418-V558 PolarHBondContact N-O 3.03Å; L418-V558 PolarHBondContact O-N 3.48Å
419	I	96.6	Very high	92.8	Very high	85 Å²	85	64.6 Å²	64.6	44%	0.436	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.9	162	-57.6	-66.8	0	0	0	107.8	Q443 F555 K557	I419-Q443 PolarHBondContact O-NE2 3.11Å; I419-Q443 VanDerWaalsContact O-NE2 3.12Å; I419-F555 HydrophobicContact CG2-CD1 4.25Å; I419-K557 HydrophobicContact CD1-CB 3.81Å; I419-K557 HydrophobicContact CD1-CD 3.67Å; I419-K557 HydrophobicContact CD1-CG 3.55Å
420	W	96.6	Very high	93.7	Very high	20 Å²	20	65.4 Å²	65.4	8%	0.076	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	114.9	-175.9	-175.9	29.4	0	0	0	111	L418 I422 L440 Y441 S442 A456 V458 F555 I556	L418-W420 HydrophobicContact CD2-CB 4.33Å; L418-W420 HydrophobicContact CG-CB 4.27Å; W420-I422 HydrophobicContact CD2-CD1 3.89Å; W420-I422 HydrophobicContact CD2-CG1 3.83Å; W420-I422 HydrophobicContact CE3-CD1 3.93Å; W420-I422 HydrophobicContact CE3-CG1 4.39Å; W420-I422 HydrophobicContact CG-CG1 4.24Å; W420-I422 HydrophobicContact CH2-CD1 3.93Å; W420-I422 HydrophobicContact CZ2-CD1 3.84Å; W420-I422 HydrophobicContact CZ2-CG1 3.95Å; W420-I422 HydrophobicContact CZ3-CD1 3.96Å; W420-L440 HydrophobicContact CH2-CB 3.82Å; W420-L440 WeakPolarHBondContact CH2-O 3.1Å; W420-L440 HydrophobicContact CZ2-CB 3.82Å; W420-Y441 VanDerWaalsContact CZ2-O 3.31Å; W420-Y441 WeakPolarHBondContact CZ2-O 3.29Å; W420-S442 VanDerWaalsContact CD2-CB 3.49Å; W420-A456 HydrophobicContact CE3-CB 4.22Å; W420-A456 HydrophobicContact CZ3-CB 4.24Å; W420-V458 HydrophobicContact CH2-CB 4.03Å; W420-V458 HydrophobicContact CH2-CG1 3.37Å; W420-V458 HydrophobicContact CZ2-CG1 4.35Å; W420-V458 HydrophobicContact CZ3-CB 3.76Å; W420-V458 HydrophobicContact CZ3-CG1 3.57Å; W420-F555 WeakPolarHBondContact O-CA 2.99Å; W420-I556 HydrophobicContact CB-CB 4.34Å; W420-I556 HydrophobicContact CE3-CB 4.31Å; W420-I556 HydrophobicContact CE3-CD1 3.94Å; W420-I556 HydrophobicContact CE3-CG2 4.45Å; W420-I556 HydrophobicContact CZ3-CD1 4.21Å; W420-I556 PolarHBondContact N-O 3.38Å; W420-I556 PolarHBondContact O-N 3.01Å
421	K	95.4	Very high	94.4	Very high	91 Å²	91	60 Å²	60	40%	0.396	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	111.8	177.9	-177.4	177.9	-178.9	172.6	0	110.1	R423 T553 F555	K421-R423 HydrophobicContact CD-CG 4.44Å; K421-R423 HydrophobicContact CG-CG 4.26Å; K421-T553 HydrophobicContact CD-CG2 4.3Å; K421-T553 HydrophobicContact CG-CG2 3.61Å; K421-F555 HydrophobicContact CB-CD1 3.91Å; K421-F555 HydrophobicContact CB-CE1 3.6Å; K421-F555 HydrophobicContact CB-CZ 4.38Å; K421-F555 HydrophobicContact CD-CE1 3.73Å; K421-F555 HydrophobicContact CD-CZ 3.79Å; K421-F555 HydrophobicContact CG-CD1 4.15Å; K421-F555 HydrophobicContact CG-CE1 3.52Å; K421-F555 HydrophobicContact CG-CZ 3.78Å
422	I	96.1	Very high	95.1	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	108.2	176	-56	171.8	0	0	0	108.2	W420 L440 V458 T553 I554 I556	W420-I422 HydrophobicContact CD2-CD1 3.89Å; W420-I422 HydrophobicContact CD2-CG1 3.83Å; W420-I422 HydrophobicContact CE3-CD1 3.93Å; W420-I422 HydrophobicContact CE3-CG1 4.39Å; W420-I422 HydrophobicContact CG-CG1 4.24Å; W420-I422 HydrophobicContact CH2-CD1 3.93Å; W420-I422 HydrophobicContact CZ2-CD1 3.84Å; W420-I422 HydrophobicContact CZ2-CG1 3.95Å; W420-I422 HydrophobicContact CZ3-CD1 3.96Å; I422-L440 HydrophobicContact CG2-CD1 4.07Å; I422-V458 HydrophobicContact CD1-CG1 3.82Å; I422-T553 VanDerWaalsContact O-CA 3.28Å; I422-T553 WeakPolarHBondContact O-CA 3.47Å; I422-T553 WeakPolarHBondContact O-CG2 3.49Å; I422-I554 HydrophobicContact CB-CD1 4.4Å; I422-I554 HydrophobicContact CB-CG1 3.76Å; I422-I554 HydrophobicContact CD1-CD1 4.08Å; I422-I554 HydrophobicContact CD1-CG1 4.23Å; I422-I554 HydrophobicContact CG1-CG1 4.41Å; I422-I554 HydrophobicContact CG2-CG1 4.43Å; I422-I554 PolarHBondContact N-O 2.98Å; I422-I554 PolarHBondContact O-N 3.39Å; I422-I556 HydrophobicContact CD1-CD1 3.79Å
423	R	95.4	Very high	95.6	Very high	126 Å²	126	59.8 Å²	59.8	48%	0.475	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	163.6	176.7	-56.5	178.9	-175	85.9	-7.2	111	K421 R428 T553	K421-R423 HydrophobicContact CD-CG 4.44Å; K421-R423 HydrophobicContact CG-CG 4.26Å; R423-R428 WeakPolarHBondContact O-CD 3.47Å; R423-R428 PolarHBondContact O-NE 3.12Å; R423-T553 HydrophobicContact CG-CG2 4.41Å
424	D	96.3	Very high	95.7	Very high	62 Å²	62	64.2 Å²	64.2	33%	0.332	30%	0.295	S	S	.	.			trans	58.6	44.6	177.7	-45.5	-37.5	0	0	0	112.1	K426 R427 R428 D552	D424-K426 VanDerWaalsContact C-N 3.3Å; D424-K426 PolarHBondContact O-N 3.39Å; D424-R427 HydrophobicContact CB-CB 4.32Å; D424-R427 PolarHBondContact O-N 3.49Å; D424-R427 IonicContact OD2-CZ 3.29Å; D424-R427 IonicContact OD2-NH1 3.96Å; D424-R427 PolarHBondContact OD2-NH1 3.44Å; D424-R427 IonicContact OD2-NH2 3.21Å; D424-R427 PolarHBondContact OD2-NH2 2.77Å; D424-R428 WeakPolarHBondContact O-CG 3.25Å; D424-R428 PolarHBondContact O-N 3.29Å; D424-D552 WeakPolarHBondContact CA-OD2 3.4Å; D424-D552 PolarHBondContact N-O 3.41Å
425	Y	96.9	Very high	95.5	Very high	3 Å²	3	62.4 Å²	62.4	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-53.3	-46.8	-173.6	176.6	-88.7	0	0	0	111.7	R427 R428 K429 L460 L543 E544 I549 D552 I554	Y425-R427 PolarHBondContact O-N 3.19Å; Y425-R428 PolarHBondContact O-N 3.16Å; Y425-K429 HydrophobicContact CE1-CB 4.22Å; Y425-K429 HydrophobicContact CE1-CD 3.8Å; Y425-K429 VanDerWaalsContact O-CB 3.27Å; Y425-K429 WeakPolarHBondContact O-CB 3.44Å; Y425-K429 PolarHBondContact O-N 3.29Å; Y425-L460 HydrophobicContact CD2-CD1 4.46Å; Y425-L460 HydrophobicContact CD2-CD2 4.34Å; Y425-L460 HydrophobicContact CE2-CD2 3.99Å; Y425-L543 HydrophobicContact CE2-CD2 3.87Å; Y425-L543 WeakPolarHBondContact OH-CD2 3.5Å; Y425-E544 HydrophobicContact CE1-CG 4.29Å; Y425-I549 HydrophobicContact CD1-CD1 3.62Å; Y425-I549 HydrophobicContact CE1-CD1 3.57Å; Y425-I549 HydrophobicContact CE2-CD1 4.48Å; Y425-I549 HydrophobicContact CG-CD1 4.13Å; Y425-D552 PolarHBondContact N-O 3.5Å; Y425-D552 PolarHBondContact N-OD1 2.92Å; Y425-I554 HydrophobicContact CD2-CD1 3.84Å; Y425-I554 HydrophobicContact CD2-CG1 4.17Å; Y425-I554 HydrophobicContact CD2-CG2 3.91Å; Y425-I554 HydrophobicContact CE2-CD1 3.98Å; Y425-I554 HydrophobicContact CE2-CG2 4.38Å; Y425-I554 HydrophobicContact CG-CG2 4.46Å
426	K	94.8	Very high	95.4	Very high	154 Å²	154	65 Å²	65	67%	0.67	31%	0.308	S	S	*	.	H	α-helix	trans	-56.3	-49.7	179	-74.7	174	-173.7	179.4	0	112.3	D424 Q430 D552	D424-K426 VanDerWaalsContact C-N 3.3Å; D424-K426 PolarHBondContact O-N 3.39Å; K426-Q430 WeakPolarHBondContact O-CG 3.46Å; K426-Q430 PolarHBondContact O-N 3.08Å; K426-D552 WeakPolarHBondContact CG-OD1 3.49Å; K426-D552 PolarHBondContact N-OD1 3.11Å
427	R	96.9	Very high	95.3	Very high	125 Å²	125	67.8 Å²	67.8	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-50.4	-180	-172.9	-174	70.8	-136	-14.7	110.7	D424 Y425 K429 Q430 E431	D424-R427 HydrophobicContact CB-CB 4.32Å; D424-R427 PolarHBondContact O-N 3.49Å; D424-R427 IonicContact OD2-CZ 3.29Å; D424-R427 IonicContact OD2-NH1 3.96Å; D424-R427 PolarHBondContact OD2-NH1 3.44Å; D424-R427 IonicContact OD2-NH2 3.21Å; D424-R427 PolarHBondContact OD2-NH2 2.77Å; Y425-R427 PolarHBondContact O-N 3.19Å; R427-K429 VanDerWaalsContact C-N 3.33Å; R427-K429 PolarHBondContact O-N 2.9Å; R427-Q430 PolarHBondContact O-N 3.06Å; R427-E431 WeakPolarHBondContact CG-OE1 3.38Å; R427-E431 IonicContact NE-OE1 3.67Å; R427-E431 WeakPolarHBondContact O-CG 3.18Å; R427-E431 PolarHBondContact O-N 2.87Å
428	R	96.4	Very high	95.1	Very high	78 Å²	78	71 Å²	71	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-35.9	-177.6	-67.7	179.2	-178	-94	-1.4	112.4	R423 D424 Y425 A432 L460	R423-R428 WeakPolarHBondContact O-CD 3.47Å; R423-R428 PolarHBondContact O-NE 3.12Å; D424-R428 WeakPolarHBondContact O-CG 3.25Å; D424-R428 PolarHBondContact O-N 3.29Å; Y425-R428 PolarHBondContact O-N 3.16Å; R428-A432 PolarHBondContact O-N 3.48Å; R428-A432 VanDerWaalsContact O-N 3.09Å; R428-L460 HydrophobicContact CB-CD1 3.57Å
429	K	96.1	Very high	95.1	Very high	18 Å²	18	71.9 Å²	71.9	8%	0.078	35%	0.347	C	S	.	.	H	α-helix	trans	-65	-45.7	173.3	-177.4	179.3	178.2	173	0	110.9	Y425 R427 E431 A432 V433 L460 E544	Y425-K429 HydrophobicContact CE1-CB 4.22Å; Y425-K429 HydrophobicContact CE1-CD 3.8Å; Y425-K429 VanDerWaalsContact O-CB 3.27Å; Y425-K429 WeakPolarHBondContact O-CB 3.44Å; Y425-K429 PolarHBondContact O-N 3.29Å; R427-K429 VanDerWaalsContact C-N 3.33Å; R427-K429 PolarHBondContact O-N 2.9Å; K429-E431 VanDerWaalsContact C-N 3.34Å; K429-E431 PolarHBondContact O-N 2.76Å; K429-A432 WeakPolarHBondContact O-CB 3.46Å; K429-A432 PolarHBondContact O-N 3.39Å; K429-A432 VanDerWaalsContact O-N 3.13Å; K429-V433 WeakPolarHBondContact O-CG2 3.47Å; K429-V433 PolarHBondContact O-N 2.95Å; K429-L460 HydrophobicContact CB-CB 4.43Å; K429-E544 VanDerWaalsContact CD-OE1 3.31Å; K429-E544 WeakPolarHBondContact CD-OE1 3.37Å; K429-E544 WeakPolarHBondContact CE-OE1 3.49Å; K429-E544 IonicContact NZ-OE1 3.09Å; K429-E544 PolarHBondContact NZ-OE1 3.44Å; K429-E544 IonicContact NZ-OE2 3.11Å; K429-E544 PolarHBondContact NZ-OE2 3.28Å
430	Q	95.7	Very high	95.1	Very high	115 Å²	115	69 Å²	69	54%	0.537	33%	0.332	S	S	.	.	H	α-helix	trans	-61.1	-42.3	176.6	-74	-63.6	-30.6	0	0	111.9	K426 R427 A432 V433 M434	K426-Q430 WeakPolarHBondContact O-CG 3.46Å; K426-Q430 PolarHBondContact O-N 3.08Å; R427-Q430 PolarHBondContact O-N 3.06Å; Q430-A432 VanDerWaalsContact C-N 3.27Å; Q430-A432 PolarHBondContact O-N 3.24Å; Q430-V433 PolarHBondContact O-N 3.46Å; Q430-V433 VanDerWaalsContact O-N 3.16Å; Q430-M434 WeakPolarHBondContact O-CB 3.36Å; Q430-M434 VanDerWaalsContact O-CG 3.24Å; Q430-M434 WeakPolarHBondContact O-CG 3.25Å; Q430-M434 PolarHBondContact O-N 3.24Å
431	E	95.3	Very high	95	Very high	52 Å²	52	72.8 Å²	72.8	24%	0.243	35%	0.347	C	S	.	.	H	α-helix	trans	-58.8	-37.9	173.5	-72.3	166	-178.7	0	0	112.6	R427 K429 G435 K436 T437	R427-E431 WeakPolarHBondContact CG-OE1 3.38Å; R427-E431 IonicContact NE-OE1 3.67Å; R427-E431 WeakPolarHBondContact O-CG 3.18Å; R427-E431 PolarHBondContact O-N 2.87Å; K429-E431 VanDerWaalsContact C-N 3.34Å; K429-E431 PolarHBondContact O-N 2.76Å; E431-G435 PolarHBondContact O-N 2.86Å; E431-K436 HydrophobicContact CB-CB 4.34Å; E431-K436 PolarHBondContact O-N 3.2Å; E431-T437 PolarHBondContact O-N 3.08Å
432	A	95.4	Very high	95	Very high	6 Å²	6	69 Å²	69	5%	0.05	33%	0.332	C	S	.	.	H	α-helix	trans	-70.1	-37.8	175	0	0	0	0	0	112.8	R428 K429 Q430 G435 T437 N461	R428-A432 PolarHBondContact O-N 3.48Å; R428-A432 VanDerWaalsContact O-N 3.09Å; K429-A432 WeakPolarHBondContact O-CB 3.46Å; K429-A432 PolarHBondContact O-N 3.39Å; K429-A432 VanDerWaalsContact O-N 3.13Å; Q430-A432 VanDerWaalsContact C-N 3.27Å; Q430-A432 PolarHBondContact O-N 3.24Å; A432-G435 PolarHBondContact O-N 3.18Å; A432-T437 VanDerWaalsContact CA-O 3.23Å; A432-T437 WeakPolarHBondContact CA-O 3.33Å; A432-T437 WeakPolarHBondContact CB-O 3.4Å; A432-N461 HydrophobicContact CB-CB 3.86Å
433	V	95	Very high	94.9	Very high	75 Å²	75	70.2 Å²	70.2	46%	0.455	34%	0.338	S	S	.	.	H	α-helix	trans	-65.3	-42.8	174.1	172.9	0	0	0	0	111	K429 Q430 G435 N461	K429-V433 WeakPolarHBondContact O-CG2 3.47Å; K429-V433 PolarHBondContact O-N 2.95Å; Q430-V433 PolarHBondContact O-N 3.46Å; Q430-V433 VanDerWaalsContact O-N 3.16Å; V433-G435 PolarHBondContact O-N 3.3Å; V433-N461 HydrophobicContact CG2-CB 4.17Å
434	M	94.4	Very high	94.9	Very high	121 Å²	121	65 Å²	65	60%	0.596	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.7	176.7	-65.2	177.7	78	0	0	113.5	Q430 K436	Q430-M434 WeakPolarHBondContact O-CB 3.36Å; Q430-M434 VanDerWaalsContact O-CG 3.24Å; Q430-M434 WeakPolarHBondContact O-CG 3.25Å; Q430-M434 PolarHBondContact O-N 3.24Å; M434-K436 VanDerWaalsContact C-N 3.26Å; M434-K436 HydrophobicContact CB-CG 4.29Å; M434-K436 PolarHBondContact O-N 2.92Å
435	G	90.1	Very high	94.9	Very high	44 Å²	44	62.1 Å²	62.1	45%	0.454	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	7.8	-178.7	0	0	0	0	0	115.3	E431 A432 V433	E431-G435 PolarHBondContact O-N 2.86Å; A432-G435 PolarHBondContact O-N 3.18Å; V433-G435 PolarHBondContact O-N 3.3Å
436	K	90.9	Very high	94.9	Very high	148 Å²	148	64.2 Å²	64.2	64%	0.643	31%	0.313	S	S	*	.	S	Bend	trans	-69.9	-42.4	178.2	-67.7	-176.1	178.4	179.6	0	111.9	E431 M434	E431-K436 HydrophobicContact CB-CB 4.34Å; E431-K436 PolarHBondContact O-N 3.2Å; M434-K436 VanDerWaalsContact C-N 3.26Å; M434-K436 HydrophobicContact CB-CG 4.29Å; M434-K436 PolarHBondContact O-N 2.92Å
437	T	92.3	Very high	94.9	Very high	58 Å²	58	57.5 Å²	57.5	36%	0.356	28%	0.284	S	S	.	.			trans	-142.7	94.4	-179.9	-55.1	0	0	0	0	109.6	E431 A432 L440	E431-T437 PolarHBondContact O-N 3.08Å; A432-T437 VanDerWaalsContact CA-O 3.23Å; A432-T437 WeakPolarHBondContact CA-O 3.33Å; A432-T437 WeakPolarHBondContact CB-O 3.4Å; T437-L440 HydrophobicContact CG2-CD2 3.9Å
438	L	94.1	Very high	94.6	Very high	104 Å²	104	52.6 Å²	52.6	55%	0.545	27%	0.273	S	S	.	.			trans	-69.8	-36.6	-171.6	-61.9	175.4	0	0	0	113.4	Y459	L438-Y459 HydrophobicContact CB-CD1 4.46Å; L438-Y459 HydrophobicContact CB-CE1 4.31Å; L438-Y459 WeakPolarHBondContact O-CD1 3.38Å
439	S	96.5	Very high	94.3	Very high	20 Å²	20	57.3 Å²	57.3	14%	0.14	29%	0.292	C	S	.	.			trans	-142.3	154.9	-176	65.2	0	0	0	0	112.1	R457 V458	S439-R457 PolarHBondContact OG-NE 3.44Å; S439-R457 PolarHBondContact OG-NH2 3.44Å; S439-V458 CarbonylContact C-O 3.57Å; S439-V458 WeakPolarHBondContact CA-O 3.48Å; S439-V458 WeakPolarHBondContact CB-O 3.5Å
440	L	95.9	Very high	94.1	Very high	26 Å²	26	62.7 Å²	62.7	14%	0.136	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	152.2	173.1	-52.9	169.5	0	0	0	109.4	W420 I422 T437 R457 V458 L460	W420-L440 HydrophobicContact CH2-CB 3.82Å; W420-L440 WeakPolarHBondContact CH2-O 3.1Å; W420-L440 HydrophobicContact CZ2-CB 3.82Å; I422-L440 HydrophobicContact CG2-CD1 4.07Å; T437-L440 HydrophobicContact CG2-CD2 3.9Å; L440-R457 VanDerWaalsContact O-CA 3.31Å; L440-R457 WeakPolarHBondContact O-CA 3.41Å; L440-V458 HydrophobicContact CB-CG1 4.02Å; L440-V458 HydrophobicContact CD1-CG1 4.46Å; L440-V458 PolarHBondContact N-O 3.16Å; L440-V458 PolarHBondContact O-N 2.96Å; L440-L460 HydrophobicContact CD1-CD1 4.11Å; L440-L460 HydrophobicContact CD1-CG 4.49Å
441	Y	95.6	Very high	94	Very high	99 Å²	99	57.7 Å²	57.7	39%	0.388	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	143.2	170.1	-67.8	-90.7	0	0	0	109.9	W420 A456 R457 M528	W420-Y441 VanDerWaalsContact CZ2-O 3.31Å; W420-Y441 WeakPolarHBondContact CZ2-O 3.29Å; Y441-A456 CarbonylContact C-O 3.53Å; Y441-A456 WeakPolarHBondContact CA-O 3.48Å; Y441-R457 HydrophobicContact CD1-CB 3.93Å; Y441-R457 HydrophobicContact CD1-CG 3.99Å; Y441-R457 HydrophobicContact CE1-CB 3.85Å; Y441-R457 HydrophobicContact CE1-CG 3.68Å; Y441-R457 HydrophobicContact CE2-CG 4.43Å; Y441-R457 PolarHBondContact OH-NE 2.89Å; Y441-R457 PolarHBondContact OH-NH1 3.5Å; Y441-M528 HydrophobicContact CD1-SD 4.15Å; Y441-M528 HydrophobicContact CE1-SD 3.84Å
442	S	95.4	Very high	94.1	Very high	10 Å²	10	55.2 Å²	55.2	7%	0.07	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-75.1	168.8	170.8	75.3	0	0	0	0	111.2	L418 W420 A456	L418-S442 VanDerWaalsContact CD2-OG 3.31Å; L418-S442 WeakPolarHBondContact CD2-OG 3.48Å; W420-S442 VanDerWaalsContact CD2-CB 3.49Å; S442-A456 PolarHBondContact N-O 2.98Å; S442-A456 PolarHBondContact OG-N 3.01Å
443	Q	93.4	Very high	94.1	Very high	31 Å²	31	57.2 Å²	57.2	15%	0.145	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-58.3	149.6	160	72.2	-83	22	0	0	110.6	T411 L418 I419	T411-Q443 PolarHBondContact O-NE2 3.29Å; T411-Q443 WeakPolarHBondContact OG1-CB 3.23Å; T411-Q443 WeakPolarHBondContact OG1-CG 3.49Å; L418-Q443 HydrophobicContact CD1-CG 4.03Å; I419-Q443 PolarHBondContact O-NE2 3.11Å; I419-Q443 VanDerWaalsContact O-NE2 3.12Å
444	P	95.2	Very high	94.2	Very high	17 Å²	17	53.6 Å²	53.6	11%	0.11	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-60.2	145.8	170.3	-24.3	33.8	0	0	0	112.9	V408 Y446 K453 M454 M478	V408-P444 HydrophobicContact CG1-CG 4.33Å; P444-Y446 HydrophobicContact CB-CE2 4.38Å; P444-K453 HydrophobicContact CB-CG 4.3Å; P444-M454 CarbonylContact C-O 3.58Å; P444-M454 VanDerWaalsContact CA-O 3.24Å; P444-M454 WeakPolarHBondContact CA-O 3.28Å; P444-M478 HydrophobicContact CB-SD 4.22Å; P444-M478 HydrophobicContact CG-SD 4.04Å
445	F	96.6	Very high	94.4	Very high	1 Å²	1	48 Å²	48	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	158.2	169.3	75	-70.9	0	0	0	110	G416 L418 M454 F475 V558 V560	G416-F445 WeakPolarHBondContact O-CE2 3.44Å; L418-F445 HydrophobicContact CB-CB 4.22Å; L418-F445 HydrophobicContact CB-CD1 3.74Å; L418-F445 HydrophobicContact CB-CD2 3.93Å; L418-F445 HydrophobicContact CB-CE1 4.02Å; L418-F445 HydrophobicContact CB-CE2 4.19Å; L418-F445 HydrophobicContact CB-CG 3.7Å; L418-F445 HydrophobicContact CB-CZ 4.24Å; L418-F445 HydrophobicContact CD1-CB 4.27Å; L418-F445 HydrophobicContact CD1-CD1 4.25Å; L418-F445 HydrophobicContact CD1-CG 4.43Å; L418-F445 HydrophobicContact CD2-CD1 3.92Å; L418-F445 HydrophobicContact CD2-CE1 3.99Å; L418-F445 HydrophobicContact CG-CD1 4.18Å; L418-F445 HydrophobicContact CG-CG 4.48Å; F445-M454 HydrophobicContact CD1-CB 4.15Å; F445-M454 WeakPolarHBondContact CD1-O 3.4Å; F445-M454 HydrophobicContact CD2-CE 3.84Å; F445-M454 HydrophobicContact CE1-CB 3.7Å; F445-M454 HydrophobicContact CE2-CE 3.53Å; F445-M454 HydrophobicContact CG-CE 4.48Å; F445-M454 HydrophobicContact CZ-CB 3.96Å; F445-M454 HydrophobicContact CZ-CE 3.93Å; F445-M454 HydrophobicContact CZ-SD 4.43Å; F445-M454 PolarHBondContact N-O 3.29Å; F445-M454 PolarHBondContact O-N 2.91Å; F445-F475 HydrophobicContact CZ-CD2 4.42Å; F445-F475 HydrophobicContact CZ-CE2 4.04Å; F445-V558 HydrophobicContact CE1-CG1 4.44Å; F445-V558 HydrophobicContact CE2-CG1 4.39Å; F445-V558 HydrophobicContact CZ-CB 4.1Å; F445-V558 HydrophobicContact CZ-CG1 3.69Å; F445-V560 HydrophobicContact CE2-CG2 3.81Å; F445-V560 HydrophobicContact CZ-CG2 3.94Å
446	Y	96.1	Very high	94.7	Very high	47 Å²	47	45.9 Å²	45.9	18%	0.184	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.1	-167.7	-53.8	-100.4	0	0	0	111	A412 S413 Y414 N415 G416 P444 G448 Y452 K453	A412-Y446 HydrophobicContact CB-CE2 4.42Å; S413-Y446 WeakPolarHBondContact O-CD2 3.32Å; S413-Y446 PolarHBondContact O-N 3.27Å; Y414-Y446 CarbonylContact C-O 3.46Å; Y414-Y446 WeakPolarHBondContact CA-O 3.42Å; Y414-Y446 AromaticContact CD1-CD2 3.77Å; Y414-Y446 HydrophobicContact CD1-CD2 3.77Å; Y414-Y446 AromaticContact CD1-CG 3.93Å; Y414-Y446 HydrophobicContact CD1-CG 3.93Å; Y414-Y446 AromaticContact CE1-CD2 3.58Å; Y414-Y446 HydrophobicContact CE1-CD2 3.58Å; Y414-Y446 AromaticContact CE1-CE2 3.96Å; Y414-Y446 HydrophobicContact CE1-CE2 3.96Å; Y414-Y446 HydrophobicContact CE1-CG 4Å; N415-Y446 PolarHBondContact N-O 3.15Å; G416-Y446 WeakPolarHBondContact CA-O 3.31Å; G416-Y446 PolarHBondContact N-O 3.47Å; P444-Y446 HydrophobicContact CB-CE2 4.38Å; Y446-G448 VanDerWaalsContact C-N 3.28Å; Y446-G448 VanDerWaalsContact CB-O 3.3Å; Y446-G448 WeakPolarHBondContact CB-O 3.41Å; Y446-Y452 VanDerWaalsContact CA-O 3.23Å; Y446-Y452 WeakPolarHBondContact CA-O 3.42Å; Y446-K453 HydrophobicContact CD1-CB 3.92Å; Y446-K453 HydrophobicContact CD1-CG 4.13Å; Y446-K453 HydrophobicContact CE1-CB 3.65Å; Y446-K453 HydrophobicContact CE1-CD 3.98Å; Y446-K453 HydrophobicContact CE1-CG 3.48Å; Y446-K453 VanDerWaalsContact CE1-CG 3.48Å
447	T	94.8	Very high	95	Very high	12 Å²	12	41.6 Å²	41.6	7%	0.074	20%	0.199	C	C	.	.	S	Bend	trans	-71	-24.8	171.8	43.9	0	0	0	0	113	G451 Y452 M454 V560 T562 L565	T447-G451 WeakPolarHBondContact OG1-CA 3.16Å; T447-Y452 HydrophobicContact CG2-CD2 4.05Å; T447-Y452 PolarHBondContact N-O 3.45Å; T447-Y452 PolarHBondContact OG1-N 3.2Å; T447-M454 HydrophobicContact CG2-CE 3.59Å; T447-M454 HydrophobicContact CG2-SD 4.1Å; T447-V560 HydrophobicContact CG2-CB 4.41Å; T447-V560 HydrophobicContact CG2-CG1 3.72Å; T447-T562 HydrophobicContact CG2-CG2 3.92Å; T447-T562 WeakPolarHBondContact O-CG2 3.39Å; T447-L565 HydrophobicContact CG2-CD1 3.89Å
448	G	92.5	Very high	95.3	Very high	22 Å²	22	38.9 Å²	38.9	23%	0.227	18%	0.183	C	C	.	.	S	Bend	trans	-163.9	174	-179	0	0	0	0	0	110.1	Y414 Y446 F450 G451	Y414-G448 WeakPolarHBondContact O-CA 3.34Å; Y446-G448 VanDerWaalsContact C-N 3.28Å; Y446-G448 VanDerWaalsContact CB-O 3.3Å; Y446-G448 WeakPolarHBondContact CB-O 3.41Å; G448-F450 PolarHBondContact O-N 3.11Å; G448-G451 PolarHBondContact O-N 2.93Å
449	Y	90.1	Very high	95.5	Very high	177 Å²	177	35.2 Å²	35.2	69%	0.694	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-34.8	174.7	-77.7	-74.7	0	0	0	113.1	Y414	Y414-Y449 HydrophobicContact CD1-CD1 4.17Å; Y414-Y449 HydrophobicContact CD2-CE1 4.3Å; Y414-Y449 HydrophobicContact CG-CD1 4.14Å; Y414-Y449 HydrophobicContact CG-CE1 4.3Å
450	F	91.9	Very high	95.5	Very high	132 Å²	132	34.5 Å²	34.5	58%	0.579	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.4	30	179.6	-50.5	-60.8	0	0	0	111.7	G448 Y482	G448-F450 PolarHBondContact O-N 3.11Å; F450-Y482 HydrophobicContact CB-CD1 4.4Å; F450-Y482 HydrophobicContact CB-CD2 4.05Å; F450-Y482 HydrophobicContact CB-CE2 4.18Å; F450-Y482 HydrophobicContact CB-CG 4.18Å; F450-Y482 HydrophobicContact CD1-CD2 4.34Å; F450-Y482 AromaticContact CD1-CE1 3.94Å; F450-Y482 HydrophobicContact CD1-CE1 3.94Å; F450-Y482 AromaticContact CD1-CE2 3.61Å; F450-Y482 HydrophobicContact CD1-CE2 3.61Å; F450-Y482 AromaticContact CD1-CZ 3.37Å; F450-Y482 WeakPolarHBondContact CD1-OH 3.34Å; F450-Y482 HydrophobicContact CG-CE2 4.39Å
451	G	93.1	Very high	95.6	Very high	9 Å²	9	34.6 Å²	34.6	9%	0.093	16%	0.157	C	C	.	.	S	Bend	trans	-99.4	-171.4	-174.3	0	0	0	0	0	114.7	T447 G448 K453	T447-G451 WeakPolarHBondContact OG1-CA 3.16Å; G448-G451 PolarHBondContact O-N 2.93Å; G451-K453 PolarHBondContact O-N 3.26Å
452	Y	96.2	Very high	95.6	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	14%	0.142	C	C	.	.			trans	-57	135	175.2	-60.5	-80.1	0	0	0	111.6	Y446 T447 L486 P487 W488 F490 L565	Y446-Y452 VanDerWaalsContact CA-O 3.23Å; Y446-Y452 WeakPolarHBondContact CA-O 3.42Å; T447-Y452 HydrophobicContact CG2-CD2 4.05Å; T447-Y452 PolarHBondContact N-O 3.45Å; T447-Y452 PolarHBondContact OG1-N 3.2Å; Y452-L486 HydrophobicContact CD1-CB 4.23Å; Y452-L486 HydrophobicContact CD1-CD1 3.73Å; Y452-L486 HydrophobicContact CD2-CD1 4.46Å; Y452-L486 HydrophobicContact CE1-CB 3.66Å; Y452-L486 HydrophobicContact CE1-CD1 4.05Å; Y452-L486 HydrophobicContact CE1-CG 4.37Å; Y452-L486 HydrophobicContact CE2-CD2 4.44Å; Y452-L486 HydrophobicContact CG-CD1 3.97Å; Y452-P487 WeakPolarHBondContact CE1-O 3.5Å; Y452-P487 WeakPolarHBondContact OH-CD 3.27Å; Y452-P487 PolarHBondContact OH-O 3.02Å; Y452-W488 AromaticContact CD1-CH2 3.61Å; Y452-W488 HydrophobicContact CD1-CH2 3.61Å; Y452-W488 AromaticContact CD1-CZ2 3.68Å; Y452-W488 HydrophobicContact CD1-CZ2 3.68Å; Y452-W488 HydrophobicContact CD1-CZ3 4.33Å; Y452-W488 HydrophobicContact CE1-CD2 4.29Å; Y452-W488 AromaticContact CE1-CE2 3.91Å; Y452-W488 HydrophobicContact CE1-CE3 4.4Å; Y452-W488 AromaticContact CE1-CH2 3.76Å; Y452-W488 HydrophobicContact CE1-CH2 3.76Å; Y452-W488 AromaticContact CE1-CZ2 3.64Å; Y452-W488 HydrophobicContact CE1-CZ2 3.64Å; Y452-W488 HydrophobicContact CE1-CZ3 4.16Å; Y452-F490 HydrophobicContact CD1-CD2 4.03Å; Y452-F490 HydrophobicContact CD2-CD2 4.01Å; Y452-F490 HydrophobicContact CD2-CE2 4.07Å; Y452-F490 HydrophobicContact CE1-CD2 4.16Å; Y452-F490 HydrophobicContact CE2-CD2 4.15Å; Y452-F490 HydrophobicContact CE2-CE2 4.5Å; Y452-F490 AromaticContact CG-CD2 3.94Å; Y452-F490 HydrophobicContact CG-CD2 3.94Å; Y452-F490 HydrophobicContact CG-CE2 4.17Å; Y452-L565 HydrophobicContact CD2-CD1 4.18Å; Y452-L565 HydrophobicContact CE2-CD1 4.1Å; Y452-L565 HydrophobicContact CE2-CD2 3.85Å
453	K	96.9	Very high	95.6	Very high	47 Å²	47	32.7 Å²	32.7	20%	0.204	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	128.4	172.3	-172.3	-178.2	-177.2	-177.9	0	110.1	P444 Y446 G451 M478 R479	P444-K453 HydrophobicContact CB-CG 4.3Å; Y446-K453 HydrophobicContact CD1-CB 3.92Å; Y446-K453 HydrophobicContact CD1-CG 4.13Å; Y446-K453 HydrophobicContact CE1-CB 3.65Å; Y446-K453 HydrophobicContact CE1-CD 3.98Å; Y446-K453 HydrophobicContact CE1-CG 3.48Å; Y446-K453 VanDerWaalsContact CE1-CG 3.48Å; G451-K453 PolarHBondContact O-N 3.26Å; K453-M478 HydrophobicContact CB-CB 4.29Å; K453-M478 HydrophobicContact CD-CB 4.14Å; K453-M478 HydrophobicContact CG-CB 3.96Å; K453-M478 HydrophobicContact CG-SD 4.35Å; K453-M478 PolarHBondContact O-N 3.44Å; K453-M478 VanDerWaalsContact O-O 3.11Å; K453-R479 WeakPolarHBondContact CD-O 3.45Å
454	M	97.1	Very high	95.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	160	-171.5	-53.3	163.1	-63	0	0	110.3	P444 F445 T447 F475 V476 F490 V560	P444-M454 CarbonylContact C-O 3.58Å; P444-M454 VanDerWaalsContact CA-O 3.24Å; P444-M454 WeakPolarHBondContact CA-O 3.28Å; F445-M454 HydrophobicContact CD1-CB 4.15Å; F445-M454 WeakPolarHBondContact CD1-O 3.4Å; F445-M454 HydrophobicContact CD2-CE 3.84Å; F445-M454 HydrophobicContact CE1-CB 3.7Å; F445-M454 HydrophobicContact CE2-CE 3.53Å; F445-M454 HydrophobicContact CG-CE 4.48Å; F445-M454 HydrophobicContact CZ-CB 3.96Å; F445-M454 HydrophobicContact CZ-CE 3.93Å; F445-M454 HydrophobicContact CZ-SD 4.43Å; F445-M454 PolarHBondContact N-O 3.29Å; F445-M454 PolarHBondContact O-N 2.91Å; T447-M454 HydrophobicContact CG2-CE 3.59Å; T447-M454 HydrophobicContact CG2-SD 4.1Å; M454-F475 HydrophobicContact CB-CE2 3.69Å; M454-F475 HydrophobicContact CB-CZ 4.03Å; M454-F475 HydrophobicContact CG-CE2 3.85Å; M454-F475 HydrophobicContact CG-CZ 3.7Å; M454-F475 HydrophobicContact SD-CE2 3.63Å; M454-F475 HydrophobicContact SD-CZ 3.49Å; M454-F475 WeakPolarHBondContact SD-CZ 3.49Å; M454-V476 CarbonylContact C-O 3.55Å; M454-V476 VanDerWaalsContact CA-O 3.29Å; M454-V476 WeakPolarHBondContact CA-O 3.33Å; M454-F490 HydrophobicContact SD-CE2 3.9Å; M454-F490 HydrophobicContact SD-CZ 4.02Å; M454-V560 HydrophobicContact CE-CB 4.3Å; M454-V560 HydrophobicContact CE-CG1 4.48Å; M454-V560 HydrophobicContact CE-CG2 3.98Å; M454-V560 HydrophobicContact SD-CB 4.39Å; M454-V560 HydrophobicContact SD-CG1 4.21Å; M454-V560 HydrophobicContact SD-CG2 3.77Å
455	C	96.8	Very high	95.6	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	174.5	167.7	71.1	0	0	0	0	110.7	V476 M478	C455-V476 PolarHBondContact N-O 3.46Å; C455-V476 PolarHBondContact O-N 3.28Å; C455-M478 HydrophobicContact CB-CG 4.47Å; C455-M478 HydrophobicContact CB-SD 3.78Å
456	A	97.5	Very high	95.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	146.9	172.2	0	0	0	0	0	110.1	L418 W420 Y441 S442 F474 V558	L418-A456 HydrophobicContact CD2-CB 3.82Å; W420-A456 HydrophobicContact CE3-CB 4.22Å; W420-A456 HydrophobicContact CZ3-CB 4.24Å; Y441-A456 CarbonylContact C-O 3.53Å; Y441-A456 WeakPolarHBondContact CA-O 3.48Å; S442-A456 PolarHBondContact N-O 2.98Å; S442-A456 PolarHBondContact OG-N 3.01Å; A456-F474 CarbonylContact C-O 3.59Å; A456-F474 WeakPolarHBondContact CA-O 3.38Å; A456-V558 HydrophobicContact CB-CG2 4.03Å
457	R	97.9	Very high	95.5	Very high	59 Å²	59	45.9 Å²	45.9	22%	0.223	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.9	172.9	-171.3	-176.3	-172.3	176.5	2.7	109.5	S439 L440 Y441 Y459 F474 V476	S439-R457 PolarHBondContact OG-NE 3.44Å; S439-R457 PolarHBondContact OG-NH2 3.44Å; L440-R457 VanDerWaalsContact O-CA 3.31Å; L440-R457 WeakPolarHBondContact O-CA 3.41Å; Y441-R457 HydrophobicContact CD1-CB 3.93Å; Y441-R457 HydrophobicContact CD1-CG 3.99Å; Y441-R457 HydrophobicContact CE1-CB 3.85Å; Y441-R457 HydrophobicContact CE1-CG 3.68Å; Y441-R457 HydrophobicContact CE2-CG 4.43Å; Y441-R457 PolarHBondContact OH-NE 2.89Å; Y441-R457 PolarHBondContact OH-NH1 3.5Å; R457-Y459 HydrophobicContact CG-CE2 4.19Å; R457-Y459 PolarHBondContact NE-OH 2.87Å; R457-Y459 PolarHBondContact NH1-OH 3.14Å; R457-Y459 PolarHBondContact NH2-OH 2.93Å; R457-F474 HydrophobicContact CB-CB 4.41Å; R457-F474 PolarHBondContact N-O 2.94Å; R457-F474 PolarHBondContact O-N 3.36Å; R457-V476 HydrophobicContact CB-CG2 3.86Å
458	V	98	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.2	-179.7	75.2	0	0	0	0	111.3	W420 I422 S439 L440 L460 L471 S472 L473 I556	W420-V458 HydrophobicContact CH2-CB 4.03Å; W420-V458 HydrophobicContact CH2-CG1 3.37Å; W420-V458 HydrophobicContact CZ2-CG1 4.35Å; W420-V458 HydrophobicContact CZ3-CB 3.76Å; W420-V458 HydrophobicContact CZ3-CG1 3.57Å; I422-V458 HydrophobicContact CD1-CG1 3.82Å; S439-V458 CarbonylContact C-O 3.57Å; S439-V458 WeakPolarHBondContact CA-O 3.48Å; S439-V458 WeakPolarHBondContact CB-O 3.5Å; L440-V458 HydrophobicContact CB-CG1 4.02Å; L440-V458 HydrophobicContact CD1-CG1 4.46Å; L440-V458 PolarHBondContact N-O 3.16Å; L440-V458 PolarHBondContact O-N 2.96Å; V458-L460 HydrophobicContact CG1-CD2 4.13Å; V458-L460 HydrophobicContact CG2-CD2 4.2Å; V458-L471 HydrophobicContact CG2-CD1 4.07Å; V458-L471 HydrophobicContact CG2-CD2 3.65Å; V458-L471 HydrophobicContact CG2-CG 3.81Å; V458-S472 WeakPolarHBondContact CA-O 3.47Å; V458-S472 WeakPolarHBondContact CG2-O 3.45Å; V458-L473 HydrophobicContact CB-CD1 3.93Å; V458-L473 HydrophobicContact CG2-CD1 4Å; V458-I556 HydrophobicContact CB-CD1 4.31Å; V458-I556 HydrophobicContact CG2-CD1 3.99Å
459	Y	98.1	Very high	95.7	Very high	28 Å²	28	49.9 Å²	49.9	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	105.7	169	-67.5	-107.4	0	0	0	108.2	L438 R457 N461 G462 D463 L471 S472 F474	L438-Y459 HydrophobicContact CB-CD1 4.46Å; L438-Y459 HydrophobicContact CB-CE1 4.31Å; L438-Y459 WeakPolarHBondContact O-CD1 3.38Å; R457-Y459 HydrophobicContact CG-CE2 4.19Å; R457-Y459 PolarHBondContact NE-OH 2.87Å; R457-Y459 PolarHBondContact NH1-OH 3.14Å; R457-Y459 PolarHBondContact NH2-OH 2.93Å; Y459-N461 PolarHBondContact O-N 3.28Å; Y459-G462 PolarHBondContact O-N 3.34Å; Y459-D463 HydrophobicContact CD1-CB 3.82Å; Y459-D463 HydrophobicContact CD2-CB 3.87Å; Y459-D463 HydrophobicContact CE1-CB 4.06Å; Y459-D463 HydrophobicContact CE2-CB 4.14Å; Y459-D463 HydrophobicContact CG-CB 3.7Å; Y459-L471 WeakPolarHBondContact O-CA 3.42Å; Y459-S472 PolarHBondContact N-O 2.8Å; Y459-S472 PolarHBondContact O-N 3.3Å; Y459-S472 VanDerWaalsContact O-N 3.08Å; Y459-F474 AromaticContact CD2-CD2 3.93Å; Y459-F474 HydrophobicContact CD2-CD2 3.93Å; Y459-F474 AromaticContact CD2-CE2 3.65Å; Y459-F474 HydrophobicContact CD2-CE2 3.65Å; Y459-F474 AromaticContact CE2-CD2 3.97Å; Y459-F474 HydrophobicContact CE2-CD2 3.97Å; Y459-F474 AromaticContact CE2-CE2 3.79Å; Y459-F474 HydrophobicContact CE2-CE2 3.79Å
460	L	97.1	Very high	96	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.021	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-28.6	-177.4	-59.6	-178.1	0	0	0	112.4	Y425 R428 K429 L440 V458 L471 I554	Y425-L460 HydrophobicContact CD2-CD1 4.46Å; Y425-L460 HydrophobicContact CD2-CD2 4.34Å; Y425-L460 HydrophobicContact CE2-CD2 3.99Å; R428-L460 HydrophobicContact CB-CD1 3.57Å; K429-L460 HydrophobicContact CB-CB 4.43Å; L440-L460 HydrophobicContact CD1-CD1 4.11Å; L440-L460 HydrophobicContact CD1-CG 4.49Å; V458-L460 HydrophobicContact CG1-CD2 4.13Å; V458-L460 HydrophobicContact CG2-CD2 4.2Å; L460-L471 HydrophobicContact CD2-CD1 3.84Å; L460-I554 HydrophobicContact CD2-CD1 4.09Å
461	N	97.3	Very high	96.3	Very high	29 Å²	29	37.5 Å²	37.5	16%	0.155	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	11.9	173.4	-166.4	36.5	0	0	0	113	A432 V433 Y459 G468 H470 Q540	A432-N461 HydrophobicContact CB-CB 3.86Å; V433-N461 HydrophobicContact CG2-CB 4.17Å; Y459-N461 PolarHBondContact O-N 3.28Å; N461-G468 WeakPolarHBondContact O-CA 3.46Å; N461-G468 PolarHBondContact O-N 3.41Å; N461-H470 CarbonylContact C-O 3.32Å; N461-Q540 PolarHBondContact OD1-NE2 3.28Å
462	G	95.5	Very high	96.6	Very high	7 Å²	7	37 Å²	37	7%	0.072	20%	0.204	C	C	.	.			trans	76.1	160.2	178.3	0	0	0	0	0	115.2	Y459 H470 S472	Y459-G462 PolarHBondContact O-N 3.34Å; G462-H470 WeakPolarHBondContact CA-O 3.49Å; G462-H470 PolarHBondContact N-O 3.38Å; G462-S472 VanDerWaalsContact CA-OG 3.28Å; G462-S472 WeakPolarHBondContact CA-OG 3.43Å
463	D	95.4	Very high	96.6	Very high	61 Å²	61	37 Å²	37	33%	0.326	20%	0.204	S	C	.	.			trans	-137.6	155.3	-179.9	-174.1	50.7	0	0	0	110.8	Y459 M465 G466 S472 F474	Y459-D463 HydrophobicContact CD1-CB 3.82Å; Y459-D463 HydrophobicContact CD2-CB 3.87Å; Y459-D463 HydrophobicContact CE1-CB 4.06Å; Y459-D463 HydrophobicContact CE2-CB 4.14Å; Y459-D463 HydrophobicContact CG-CB 3.7Å; D463-M465 PolarHBondContact O-N 3.06Å; D463-G466 PolarHBondContact O-N 2.9Å; D463-S472 PolarHBondContact N-OG 3.13Å; D463-F474 HydrophobicContact CB-CE2 4.21Å; D463-F474 HydrophobicContact CB-CZ 4.39Å
464	G	94.3	Very high	96.7	Very high	52 Å²	52	35.5 Å²	35.5	54%	0.536	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	52.5	-127.2	-177.3	0	0	0	0	0	112.8	G466 K467	G464-G466 PolarHBondContact O-N 3.37Å; G464-K467 WeakPolarHBondContact O-CB 3.44Å; G464-K467 PolarHBondContact O-N 3.37Å
465	M	94.4	Very high	96.7	Very high	175 Å²	175	35.6 Å²	35.6	86%	0.862	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-64.9	-18	-179.7	-63.2	-59.3	-66	0	0	114.1	D463	D463-M465 PolarHBondContact O-N 3.06Å
466	G	93.9	Very high	96.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-97.4	1.3	179	0	0	0	0	0	114.4	D463 G464 G468 T469 H470	D463-G466 PolarHBondContact O-N 2.9Å; G464-G466 PolarHBondContact O-N 3.37Å; G466-G468 PolarHBondContact O-N 3.19Å; G466-T469 PolarHBondContact O-N 3.01Å; G466-T469 VanDerWaalsContact O-N 3.13Å; G466-T469 PolarHBondContact O-OG1 3.11Å; G466-H470 PolarHBondContact O-N 3.31Å
467	K	96.3	Very high	96.8	Very high	147 Å²	147	35.6 Å²	35.6	64%	0.639	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	130.6	-176.1	-171.3	176.4	-178.7	-179.9	0	111.6	G464 T469	G464-K467 WeakPolarHBondContact O-CB 3.44Å; G464-K467 PolarHBondContact O-N 3.37Å; K467-T469 PolarHBondContact O-N 3.48Å
468	G	95.2	Very high	96.7	Very high	41 Å²	41	33.8 Å²	33.8	42%	0.423	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	-7	-179.4	0	0	0	0	0	115.6	N461 G466	N461-G468 WeakPolarHBondContact O-CA 3.46Å; N461-G468 PolarHBondContact O-N 3.41Å; G466-G468 PolarHBondContact O-N 3.19Å
469	T	96.6	Very high	96.7	Very high	77 Å²	77	39.8 Å²	39.8	47%	0.472	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.9	-28.5	-172.2	57.2	0	0	0	0	113.5	G466 K467 Q540	G466-T469 PolarHBondContact O-N 3.01Å; G466-T469 VanDerWaalsContact O-N 3.13Å; G466-T469 PolarHBondContact O-OG1 3.11Å; K467-T469 PolarHBondContact O-N 3.48Å; T469-Q540 WeakPolarHBondContact O-CB 3.48Å; T469-Q540 WeakPolarHBondContact O-CG 3.39Å; T469-Q540 PolarHBondContact O-N 3.35Å
470	H	97.7	Very high	96.4	Very high	48 Å²	48	38.9 Å²	38.9	22%	0.222	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	163.8	-177.9	-67	69.6	0	0	0	110.7	N461 G462 G466 V538 A539 Q540	N461-H470 CarbonylContact C-O 3.32Å; G462-H470 WeakPolarHBondContact CA-O 3.49Å; G462-H470 PolarHBondContact N-O 3.38Å; G466-H470 PolarHBondContact O-N 3.31Å; H470-V538 CarbonylContact C-O 3.55Å; H470-V538 VanDerWaalsContact CA-O 3.26Å; H470-V538 WeakPolarHBondContact CA-O 3.38Å; H470-V538 WeakPolarHBondContact CB-O 3.48Å; H470-A539 VanDerWaalsContact CD2-CA 3.5Å; H470-A539 WeakPolarHBondContact CD2-CA 3.4Å; H470-A539 PolarHBondContact CD2-N 3.01Å; H470-Q540 PolarHBondContact O-NE2 3.12Å; H470-Q540 VanDerWaalsContact O-NE2 3.15Å
471	L	97.6	Very high	96.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.1	155.9	177.9	150.9	0	0	0	107	V458 Y459 L460 L473 F537 V538 L543 I554	V458-L471 HydrophobicContact CG2-CD1 4.07Å; V458-L471 HydrophobicContact CG2-CD2 3.65Å; V458-L471 HydrophobicContact CG2-CG 3.81Å; Y459-L471 WeakPolarHBondContact O-CA 3.42Å; L460-L471 HydrophobicContact CD2-CD1 3.84Å; L471-L473 HydrophobicContact CD2-CB 4.3Å; L471-F537 HydrophobicContact CD2-CD1 4.02Å; L471-F537 WeakPolarHBondContact O-CB 3.37Å; L471-F537 PolarHBondContact O-N 3.27Å; L471-V538 PolarHBondContact N-O 3.37Å; L471-V538 PolarHBondContact O-N 3.49Å; L471-L543 HydrophobicContact CB-CD2 4.2Å; L471-L543 HydrophobicContact CD1-CD2 3.67Å; L471-I554 HydrophobicContact CD1-CD1 4.1Å
472	S	98.1	Very high	96.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.2	177.3	-48.5	0	0	0	0	110.1	V458 Y459 G462 D463 P535	V458-S472 WeakPolarHBondContact CA-O 3.47Å; V458-S472 WeakPolarHBondContact CG2-O 3.45Å; Y459-S472 PolarHBondContact N-O 2.8Å; Y459-S472 PolarHBondContact O-N 3.3Å; Y459-S472 VanDerWaalsContact O-N 3.08Å; G462-S472 VanDerWaalsContact CA-OG 3.28Å; G462-S472 WeakPolarHBondContact CA-OG 3.43Å; D463-S472 PolarHBondContact N-OG 3.13Å; S472-P535 WeakPolarHBondContact CB-O 3.47Å; S472-P535 PolarHBondContact OG-O 2.79Å
473	L	97.9	Very high	96.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.2	-176.3	-173.1	59.5	0	0	0	111	V458 L471 L496 C534 F537 I556	V458-L473 HydrophobicContact CB-CD1 3.93Å; V458-L473 HydrophobicContact CG2-CD1 4Å; L471-L473 HydrophobicContact CD2-CB 4.3Å; L473-L496 HydrophobicContact CD2-CB 3.96Å; L473-L496 HydrophobicContact CG-CD1 4.26Å; L473-C534 PolarHBondContact N-O 3.4Å; L473-C534 PolarHBondContact O-N 3.15Å; L473-F537 HydrophobicContact CB-CB 4.24Å; L473-F537 HydrophobicContact CB-CD1 3.71Å; L473-F537 HydrophobicContact CB-CE1 4.27Å; L473-F537 HydrophobicContact CB-CG 4.01Å; L473-F537 HydrophobicContact CD2-CD1 3.92Å; L473-F537 HydrophobicContact CD2-CE1 3.59Å; L473-F537 HydrophobicContact CD2-CZ 4.09Å; L473-F537 HydrophobicContact CG-CD1 4.49Å; L473-I556 HydrophobicContact CD1-CD1 3.96Å; L473-I556 HydrophobicContact CD1-CG2 4.11Å; L473-I556 HydrophobicContact CD2-CG2 3.68Å
474	F	97.6	Very high	96	Very high	15 Å²	15	51 Å²	51	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.9	-175.5	-54.4	-85.8	0	0	0	111.6	A456 R457 Y459 D463 A531 P535	A456-F474 CarbonylContact C-O 3.59Å; A456-F474 WeakPolarHBondContact CA-O 3.38Å; R457-F474 HydrophobicContact CB-CB 4.41Å; R457-F474 PolarHBondContact N-O 2.94Å; R457-F474 PolarHBondContact O-N 3.36Å; Y459-F474 AromaticContact CD2-CD2 3.93Å; Y459-F474 HydrophobicContact CD2-CD2 3.93Å; Y459-F474 AromaticContact CD2-CE2 3.65Å; Y459-F474 HydrophobicContact CD2-CE2 3.65Å; Y459-F474 AromaticContact CE2-CD2 3.97Å; Y459-F474 HydrophobicContact CE2-CD2 3.97Å; Y459-F474 AromaticContact CE2-CE2 3.79Å; Y459-F474 HydrophobicContact CE2-CE2 3.79Å; D463-F474 HydrophobicContact CB-CE2 4.21Å; D463-F474 HydrophobicContact CB-CZ 4.39Å; F474-A531 HydrophobicContact CB-CB 3.75Å; F474-A531 HydrophobicContact CG-CB 4.26Å; F474-P535 HydrophobicContact CE1-CG 4.09Å; F474-P535 HydrophobicContact CZ-CB 4.45Å; F474-P535 HydrophobicContact CZ-CG 4.14Å
475	F	97.7	Very high	95.8	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.009	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	143.6	168	172	-104	0	0	0	109.9	F445 M454 I477 F490 V494 L496 F512 F521 A531 S532 V558 V560	F445-F475 HydrophobicContact CZ-CD2 4.42Å; F445-F475 HydrophobicContact CZ-CE2 4.04Å; M454-F475 HydrophobicContact CB-CE2 3.69Å; M454-F475 HydrophobicContact CB-CZ 4.03Å; M454-F475 HydrophobicContact CG-CE2 3.85Å; M454-F475 HydrophobicContact CG-CZ 3.7Å; M454-F475 HydrophobicContact SD-CE2 3.63Å; M454-F475 HydrophobicContact SD-CZ 3.49Å; M454-F475 WeakPolarHBondContact SD-CZ 3.49Å; F475-I477 HydrophobicContact CD1-CG1 4.48Å; F475-I477 HydrophobicContact CE1-CD1 4.19Å; F475-I477 HydrophobicContact CE1-CG1 3.56Å; F475-I477 HydrophobicContact CZ-CG1 3.97Å; F475-F490 HydrophobicContact CE1-CD1 4.25Å; F475-F490 AromaticContact CE1-CE1 3.73Å; F475-F490 HydrophobicContact CE1-CE1 3.73Å; F475-F490 HydrophobicContact CE1-CZ 4.1Å; F475-F490 AromaticContact CZ-CE1 3.85Å; F475-F490 HydrophobicContact CZ-CE1 3.85Å; F475-F490 HydrophobicContact CZ-CE2 4.45Å; F475-F490 AromaticContact CZ-CZ 3.72Å; F475-F490 HydrophobicContact CZ-CZ 3.72Å; F475-V494 HydrophobicContact CB-CG1 4.09Å; F475-V494 HydrophobicContact CD1-CG1 4.5Å; F475-V494 HydrophobicContact CD1-CG2 4.12Å; F475-V494 HydrophobicContact CD2-CG1 3.87Å; F475-V494 HydrophobicContact CD2-CG2 4.48Å; F475-V494 HydrophobicContact CE1-CG2 4.05Å; F475-V494 HydrophobicContact CE2-CG1 4.4Å; F475-V494 HydrophobicContact CE2-CG2 4.41Å; F475-V494 HydrophobicContact CG-CG1 3.91Å; F475-V494 HydrophobicContact CG-CG2 4.32Å; F475-V494 HydrophobicContact CZ-CG2 4.19Å; F475-L496 HydrophobicContact CB-CD2 4.33Å; F475-F512 HydrophobicContact CB-CZ 4.04Å; F475-F521 HydrophobicContact CD1-CE1 4.02Å; F475-F521 HydrophobicContact CE1-CE1 4.2Å; F475-A531 WeakPolarHBondContact O-CA 3.49Å; F475-S532 WeakPolarHBondContact CB-O 3.49Å; F475-S532 PolarHBondContact N-O 3.25Å; F475-S532 PolarHBondContact O-N 3.13Å; F475-V558 HydrophobicContact CD2-CG1 4.27Å; F475-V560 HydrophobicContact CE2-CG2 3.89Å; F475-V560 HydrophobicContact CZ-CG2 4.36Å
476	V	97.8	Very high	95.8	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	128.3	-176.8	-174.1	0	0	0	0	109.1	M454 C455 R457 M528 A531	M454-V476 CarbonylContact C-O 3.55Å; M454-V476 VanDerWaalsContact CA-O 3.29Å; M454-V476 WeakPolarHBondContact CA-O 3.33Å; C455-V476 PolarHBondContact N-O 3.46Å; C455-V476 PolarHBondContact O-N 3.28Å; R457-V476 HydrophobicContact CB-CG2 3.86Å; V476-M528 HydrophobicContact CG1-CB 3.89Å; V476-M528 HydrophobicContact CG1-CG 4.37Å; V476-M528 HydrophobicContact CG1-SD 4.19Å; V476-A531 HydrophobicContact CG2-CB 3.71Å
477	I	97.6	Very high	95.8	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134	167.3	-62.9	-171.1	0	0	0	108.5	F475 W488 F490 F521 P524 M528 N529	F475-I477 HydrophobicContact CD1-CG1 4.48Å; F475-I477 HydrophobicContact CE1-CD1 4.19Å; F475-I477 HydrophobicContact CE1-CG1 3.56Å; F475-I477 HydrophobicContact CZ-CG1 3.97Å; I477-W488 HydrophobicContact CD1-CH2 4.46Å; I477-W488 HydrophobicContact CD1-CZ3 3.97Å; I477-W488 HydrophobicContact CG2-CH2 3.65Å; I477-W488 HydrophobicContact CG2-CZ3 4.02Å; I477-F490 HydrophobicContact CD1-CB 3.31Å; I477-F490 HydrophobicContact CD1-CD1 3.77Å; I477-F490 HydrophobicContact CD1-CD2 4.02Å; I477-F490 HydrophobicContact CD1-CG 3.45Å; I477-F490 VanDerWaalsContact CD1-CG 3.45Å; I477-F521 HydrophobicContact CD1-CD1 4Å; I477-P524 HydrophobicContact CG2-CG 3.74Å; I477-M528 WeakPolarHBondContact O-CA 3.41Å; I477-N529 HydrophobicContact CB-CB 4.34Å; I477-N529 PolarHBondContact O-N 2.88Å
478	M	96.9	Very high	95.7	Very high	21 Å²	21	47.3 Å²	47.3	10%	0.103	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	156.1	175.9	-53.4	-175	70.1	0	0	110	P444 K453 C455 G480 E527 M528	P444-M478 HydrophobicContact CB-SD 4.22Å; P444-M478 HydrophobicContact CG-SD 4.04Å; K453-M478 HydrophobicContact CB-CB 4.29Å; K453-M478 HydrophobicContact CD-CB 4.14Å; K453-M478 HydrophobicContact CG-CB 3.96Å; K453-M478 HydrophobicContact CG-SD 4.35Å; K453-M478 PolarHBondContact O-N 3.44Å; K453-M478 VanDerWaalsContact O-O 3.11Å; C455-M478 HydrophobicContact CB-CG 4.47Å; C455-M478 HydrophobicContact CB-SD 3.78Å; M478-G480 PolarHBondContact O-N 3.46Å; M478-E527 CarbonylContact C-O 3.54Å; M478-E527 VanDerWaalsContact CA-O 3.32Å; M478-E527 WeakPolarHBondContact CA-O 3.39Å; M478-M528 HydrophobicContact CE-CE 3.77Å; M478-M528 HydrophobicContact CE-CG 4.08Å; M478-M528 HydrophobicContact CE-SD 4.25Å; M478-M528 HydrophobicContact CG-CG 4.17Å
479	R	97	Very high	95.7	Very high	125 Å²	125	47.4 Å²	47.4	47%	0.472	25%	0.248	S	C	.	.			trans	-64.3	116.2	171	-170.6	169.4	68.5	-165.4	0.7	110.1	K453 D483 P524 G526 E527	K453-R479 WeakPolarHBondContact CD-O 3.45Å; R479-D483 WeakPolarHBondContact CA-OD2 3.45Å; R479-P524 HydrophobicContact CB-CB 3.91Å; R479-P524 HydrophobicContact CG-CB 4.33Å; R479-G526 WeakPolarHBondContact CB-O 3.4Å; R479-E527 PolarHBondContact N-O 3.34Å
480	G	93.6	Very high	95.7	Very high	9 Å²	9	43.8 Å²	43.8	9%	0.093	23%	0.225	C	C	.	.			trans	-97	154.4	176	0	0	0	0	0	112.2	M478 Y482 D483	M478-G480 PolarHBondContact O-N 3.46Å; G480-Y482 PolarHBondContact O-N 3.43Å; G480-D483 WeakPolarHBondContact CA-OD1 3.17Å; G480-D483 PolarHBondContact N-OD1 2.98Å; G480-D483 VanDerWaalsContact N-OD1 3.17Å; G480-D483 PolarHBondContact N-OD2 3.33Å; G480-D483 VanDerWaalsContact O-CG 3.22Å; G480-D483 PolarHBondContact O-N 2.94Å
481	E	93.8	Very high	95.5	Very high	167 Å²	167	47.1 Å²	47.1	78%	0.78	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.6	176.7	-57.9	-57.5	140.3	0	0	112.4
482	Y	93.6	Very high	95.4	Very high	90 Å²	90	47.4 Å²	47.4	35%	0.353	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	12.5	-175	-53.6	-76.4	0	0	0	113.4	F450 G480 A484 L485 L486	F450-Y482 HydrophobicContact CB-CD1 4.4Å; F450-Y482 HydrophobicContact CB-CD2 4.05Å; F450-Y482 HydrophobicContact CB-CE2 4.18Å; F450-Y482 HydrophobicContact CB-CG 4.18Å; F450-Y482 HydrophobicContact CD1-CD2 4.34Å; F450-Y482 AromaticContact CD1-CE1 3.94Å; F450-Y482 HydrophobicContact CD1-CE1 3.94Å; F450-Y482 AromaticContact CD1-CE2 3.61Å; F450-Y482 HydrophobicContact CD1-CE2 3.61Å; F450-Y482 AromaticContact CD1-CZ 3.37Å; F450-Y482 WeakPolarHBondContact CD1-OH 3.34Å; F450-Y482 HydrophobicContact CG-CE2 4.39Å; G480-Y482 PolarHBondContact O-N 3.43Å; Y482-A484 PolarHBondContact O-N 3.15Å; Y482-L485 HydrophobicContact CD1-CD1 4.43Å; Y482-L485 PolarHBondContact O-N 3.24Å; Y482-L486 WeakPolarHBondContact O-CG 3.39Å; Y482-L486 PolarHBondContact O-N 3.15Å
483	D	94.9	Very high	95.3	Very high	8 Å²	8	52.5 Å²	52.5	4%	0.043	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-20.8	-176.2	-73	-6.4	0	0	0	113.7	R479 G480 L485 W488 K523	R479-D483 WeakPolarHBondContact CA-OD2 3.45Å; G480-D483 WeakPolarHBondContact CA-OD1 3.17Å; G480-D483 PolarHBondContact N-OD1 2.98Å; G480-D483 VanDerWaalsContact N-OD1 3.17Å; G480-D483 PolarHBondContact N-OD2 3.33Å; G480-D483 VanDerWaalsContact O-CG 3.22Å; G480-D483 PolarHBondContact O-N 2.94Å; D483-L485 VanDerWaalsContact C-N 3.33Å; D483-W488 HydrophobicContact CB-CZ2 4.26Å; D483-W488 PolarHBondContact O-NE1 3.17Å; D483-K523 VanDerWaalsContact O-CE 3.29Å; D483-K523 WeakPolarHBondContact O-CE 3.38Å
484	A	92.6	Very high	95.3	Very high	90 Å²	90	52.5 Å²	52.5	74%	0.744	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.9	174.7	0	0	0	0	0	113.5	Y482	Y482-A484 PolarHBondContact O-N 3.15Å
485	L	91.7	Very high	95.3	Very high	147 Å²	147	53.4 Å²	53.4	77%	0.77	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-16.2	-178.6	-55.7	180	0	0	0	112.6	Y482 D483	Y482-L485 HydrophobicContact CD1-CD1 4.43Å; Y482-L485 PolarHBondContact O-N 3.24Å; D483-L485 VanDerWaalsContact C-N 3.33Å
486	L	93	Very high	95.3	Very high	31 Å²	31	53.3 Å²	53.3	16%	0.162	27%	0.269	C	S	.	.	S	Bend	trans	-88.7	145.7	-174.4	-64.5	169.8	0	0	0	111.9	Y452 Y482 W488	Y452-L486 HydrophobicContact CD1-CB 4.23Å; Y452-L486 HydrophobicContact CD1-CD1 3.73Å; Y452-L486 HydrophobicContact CD2-CD1 4.46Å; Y452-L486 HydrophobicContact CE1-CB 3.66Å; Y452-L486 HydrophobicContact CE1-CD1 4.05Å; Y452-L486 HydrophobicContact CE1-CG 4.37Å; Y452-L486 HydrophobicContact CE2-CD2 4.44Å; Y452-L486 HydrophobicContact CG-CD1 3.97Å; Y482-L486 WeakPolarHBondContact O-CG 3.39Å; Y482-L486 PolarHBondContact O-N 3.15Å; L486-W488 PolarHBondContact O-NE1 2.9Å
487	P	93.7	Very high	95.3	Very high	59 Å²	59	55 Å²	55	38%	0.383	28%	0.277	S	S	.	.			trans	-60.9	145.4	174.2	-23.5	32.5	0	0	0	113.1	Y452	Y452-P487 WeakPolarHBondContact CE1-O 3.5Å; Y452-P487 WeakPolarHBondContact OH-CD 3.27Å; Y452-P487 PolarHBondContact OH-O 3.02Å
488	W	94.7	Very high	95.3	Very high	60 Å²	60	55 Å²	55	23%	0.227	28%	0.277	C	S	.	.	S	Bend	trans	-139.2	149.7	172.8	-67.9	100	0	0	0	111.2	Y452 I477 D483 L486 F490 K522 K523 P524	Y452-W488 AromaticContact CD1-CH2 3.61Å; Y452-W488 HydrophobicContact CD1-CH2 3.61Å; Y452-W488 AromaticContact CD1-CZ2 3.68Å; Y452-W488 HydrophobicContact CD1-CZ2 3.68Å; Y452-W488 HydrophobicContact CD1-CZ3 4.33Å; Y452-W488 HydrophobicContact CE1-CD2 4.29Å; Y452-W488 AromaticContact CE1-CE2 3.91Å; Y452-W488 HydrophobicContact CE1-CE3 4.4Å; Y452-W488 AromaticContact CE1-CH2 3.76Å; Y452-W488 HydrophobicContact CE1-CH2 3.76Å; Y452-W488 AromaticContact CE1-CZ2 3.64Å; Y452-W488 HydrophobicContact CE1-CZ2 3.64Å; Y452-W488 HydrophobicContact CE1-CZ3 4.16Å; I477-W488 HydrophobicContact CD1-CH2 4.46Å; I477-W488 HydrophobicContact CD1-CZ3 3.97Å; I477-W488 HydrophobicContact CG2-CH2 3.65Å; I477-W488 HydrophobicContact CG2-CZ3 4.02Å; D483-W488 HydrophobicContact CB-CZ2 4.26Å; D483-W488 PolarHBondContact O-NE1 3.17Å; L486-W488 PolarHBondContact O-NE1 2.9Å; W488-F490 HydrophobicContact CE3-CB 4.17Å; W488-F490 HydrophobicContact CZ3-CB 3.82Å; W488-K522 WeakPolarHBondContact CZ3-O 3.46Å; W488-K523 HydrophobicContact CB-CB 4.2Å; W488-K523 VanDerWaalsContact CD2-CA 3.49Å; W488-K523 HydrophobicContact CD2-CB 3.76Å; W488-K523 HydrophobicContact CD2-CG 4.19Å; W488-K523 HydrophobicContact CE3-CB 4.33Å; W488-K523 HydrophobicContact CG-CB 3.65Å; W488-K523 HydrophobicContact CG-CD 4.39Å; W488-K523 HydrophobicContact CG-CG 4.12Å; W488-P524 HydrophobicContact CH2-CG 4.02Å; W488-P524 VanDerWaalsContact CZ2-CD 3.47Å; W488-P524 HydrophobicContact CZ2-CG 4.36Å
489	P	95.8	Very high	95.3	Very high	44 Å²	44	55.5 Å²	55.5	29%	0.286	28%	0.28	S	S	.	.	S	Bend	cis	-69.5	158.6	-3.7	30.3	-35.2	0	0	0	113	K491 P516 F521	P489-K491 PolarHBondContact O-N 2.99Å; P489-P516 HydrophobicContact CG-CB 3.7Å; P489-F521 CarbonylContact C-O 3.55Å; P489-F521 VanDerWaalsContact CA-O 3.31Å; P489-F521 WeakPolarHBondContact CA-O 3.42Å; P489-F521 VanDerWaalsContact CB-O 3.28Å; P489-F521 WeakPolarHBondContact CB-O 3.48Å
490	F	96	Very high	95.3	Very high	1 Å²	1	50 Å²	50	0%	0.004	26%	0.26	C	S	.	.			trans	-62.6	128.8	176.6	175.6	-89.3	0	0	0	110.1	Y452 M454 F475 I477 W488 Q492 V494 P514 F521 V560	Y452-F490 HydrophobicContact CD1-CD2 4.03Å; Y452-F490 HydrophobicContact CD2-CD2 4.01Å; Y452-F490 HydrophobicContact CD2-CE2 4.07Å; Y452-F490 HydrophobicContact CE1-CD2 4.16Å; Y452-F490 HydrophobicContact CE2-CD2 4.15Å; Y452-F490 HydrophobicContact CE2-CE2 4.5Å; Y452-F490 AromaticContact CG-CD2 3.94Å; Y452-F490 HydrophobicContact CG-CD2 3.94Å; Y452-F490 HydrophobicContact CG-CE2 4.17Å; M454-F490 HydrophobicContact SD-CE2 3.9Å; M454-F490 HydrophobicContact SD-CZ 4.02Å; F475-F490 HydrophobicContact CE1-CD1 4.25Å; F475-F490 AromaticContact CE1-CE1 3.73Å; F475-F490 HydrophobicContact CE1-CE1 3.73Å; F475-F490 HydrophobicContact CE1-CZ 4.1Å; F475-F490 AromaticContact CZ-CE1 3.85Å; F475-F490 HydrophobicContact CZ-CE1 3.85Å; F475-F490 HydrophobicContact CZ-CE2 4.45Å; F475-F490 AromaticContact CZ-CZ 3.72Å; F475-F490 HydrophobicContact CZ-CZ 3.72Å; I477-F490 HydrophobicContact CD1-CB 3.31Å; I477-F490 HydrophobicContact CD1-CD1 3.77Å; I477-F490 HydrophobicContact CD1-CD2 4.02Å; I477-F490 HydrophobicContact CD1-CG 3.45Å; I477-F490 VanDerWaalsContact CD1-CG 3.45Å; W488-F490 HydrophobicContact CE3-CB 4.17Å; W488-F490 HydrophobicContact CZ3-CB 3.82Å; F490-Q492 HydrophobicContact CD2-CG 4.45Å; F490-Q492 HydrophobicContact CE1-CB 4.09Å; F490-Q492 WeakPolarHBondContact CE1-O 3.44Å; F490-Q492 HydrophobicContact CE2-CB 3.95Å; F490-Q492 HydrophobicContact CE2-CG 3.94Å; F490-Q492 HydrophobicContact CZ-CB 3.63Å; F490-Q492 HydrophobicContact CZ-CG 4.16Å; F490-V494 HydrophobicContact CE1-CG2 3.79Å; F490-V494 HydrophobicContact CZ-CG2 4.23Å; F490-P514 HydrophobicContact CD1-CB 4.14Å; F490-P514 HydrophobicContact CD1-CG 3.6Å; F490-P514 HydrophobicContact CE1-CG 3.65Å; F490-P514 VanDerWaalsContact O-CB 3.23Å; F490-P514 WeakPolarHBondContact O-CB 3.28Å; F490-F521 HydrophobicContact CB-CB 4.26Å; F490-F521 HydrophobicContact CD1-CD1 4.07Å; F490-F521 PolarHBondContact N-O 3.44Å; F490-V560 HydrophobicContact CE2-CG1 4.13Å; F490-V560 HydrophobicContact CZ-CG1 3.65Å
491	K	94.7	Very high	95.3	Very high	118 Å²	118	52 Å²	52	51%	0.513	27%	0.267	S	S	.	.			trans	-130.6	4.8	-169.8	64.8	-175.8	178.6	178.8	0	114.3	P489	P489-K491 PolarHBondContact O-N 2.99Å
492	Q	95.3	Very high	95.2	Very high	5 Å²	5	44.9 Å²	44.9	2%	0.023	24%	0.238	C	C	.	.			trans	-73.7	136.2	-176.4	-55.6	-44.7	105.1	0	0	110.6	F490 V494 P514 V560 D561 L565	F490-Q492 HydrophobicContact CD2-CG 4.45Å; F490-Q492 HydrophobicContact CE1-CB 4.09Å; F490-Q492 WeakPolarHBondContact CE1-O 3.44Å; F490-Q492 HydrophobicContact CE2-CB 3.95Å; F490-Q492 HydrophobicContact CE2-CG 3.94Å; F490-Q492 HydrophobicContact CZ-CB 3.63Å; F490-Q492 HydrophobicContact CZ-CG 4.16Å; Q492-V494 WeakPolarHBondContact O-CG2 3.23Å; Q492-V494 PolarHBondContact O-N 3.36Å; Q492-P514 WeakPolarHBondContact O-CD 3.46Å; Q492-P514 WeakPolarHBondContact O-CG 3.46Å; Q492-V560 HydrophobicContact CB-CG1 3.66Å; Q492-V560 HydrophobicContact CG-CG1 4.31Å; Q492-D561 WeakPolarHBondContact CB-O 3.38Å; Q492-D561 PolarHBondContact NE2-O 2.91Å; Q492-L565 HydrophobicContact CG-CD1 4.16Å; Q492-L565 HydrophobicContact CG-CD2 4.15Å; Q492-L565 HydrophobicContact CG-CG 4.23Å
493	K	96.4	Very high	94.8	Very high	108 Å²	108	47 Å²	47	47%	0.47	27%	0.266	S	S	.	.			trans	-60.1	129.9	177.2	-178.3	-178.4	175.5	-177.2	0	109.6	D561	K493-D561 HydrophobicContact CB-CB 4.09Å; K493-D561 PolarHBondContact O-N 3.39Å
494	V	97.6	Very high	94.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.1	178.8	-174.1	0	0	0	0	108.9	F475 F490 Q492 L496 A511 F512 P514 V558 I559 V560	F475-V494 HydrophobicContact CB-CG1 4.09Å; F475-V494 HydrophobicContact CD1-CG1 4.5Å; F475-V494 HydrophobicContact CD1-CG2 4.12Å; F475-V494 HydrophobicContact CD2-CG1 3.87Å; F475-V494 HydrophobicContact CD2-CG2 4.48Å; F475-V494 HydrophobicContact CE1-CG2 4.05Å; F475-V494 HydrophobicContact CE2-CG1 4.4Å; F475-V494 HydrophobicContact CE2-CG2 4.41Å; F475-V494 HydrophobicContact CG-CG1 3.91Å; F475-V494 HydrophobicContact CG-CG2 4.32Å; F475-V494 HydrophobicContact CZ-CG2 4.19Å; F490-V494 HydrophobicContact CE1-CG2 3.79Å; F490-V494 HydrophobicContact CZ-CG2 4.23Å; Q492-V494 WeakPolarHBondContact O-CG2 3.23Å; Q492-V494 PolarHBondContact O-N 3.36Å; V494-L496 HydrophobicContact CG1-CD2 4.05Å; V494-L496 HydrophobicContact CG1-CG 4.48Å; V494-A511 CarbonylContact O-C 3.51Å; V494-A511 VanDerWaalsContact O-CA 3.25Å; V494-A511 WeakPolarHBondContact O-CA 3.37Å; V494-F512 HydrophobicContact CB-CE1 4.17Å; V494-F512 HydrophobicContact CB-CE2 3.95Å; V494-F512 HydrophobicContact CB-CZ 3.77Å; V494-F512 HydrophobicContact CG1-CE1 4.26Å; V494-F512 HydrophobicContact CG1-CZ 4.01Å; V494-F512 HydrophobicContact CG2-CE2 4.11Å; V494-F512 HydrophobicContact CG2-CZ 4.24Å; V494-F512 PolarHBondContact N-O 3.38Å; V494-F512 PolarHBondContact O-N 3.38Å; V494-P514 HydrophobicContact CG2-CG 4.3Å; V494-V558 HydrophobicContact CG1-CG1 3.95Å; V494-I559 CarbonylContact C-O 3.59Å; V494-I559 WeakPolarHBondContact CA-O 3.41Å; V494-V560 HydrophobicContact CG1-CG2 4.5Å; V494-V560 HydrophobicContact CG2-CG2 4.35Å
495	T	97.8	Very high	94	Very high	33 Å²	33	54.5 Å²	54.5	20%	0.202	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.9	174.4	-52.1	0	0	0	0	109	M497 D510 A511 V558 I559	T495-M497 HydrophobicContact CG2-CG 3.91Å; T495-M497 HydrophobicContact CG2-SD 4.23Å; T495-D510 WeakPolarHBondContact CA-O 3.42Å; T495-A511 HydrophobicContact CG2-CB 4.13Å; T495-V558 CarbonylContact O-C 3.58Å; T495-V558 WeakPolarHBondContact O-CA 3.39Å; T495-I559 PolarHBondContact N-O 3.3Å; T495-I559 PolarHBondContact O-N 3.35Å
496	L	97.6	Very high	94.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.2	177.4	-58	-179.9	0	0	0	108.7	L473 F475 V494 G509 D510 F512 F537 V558	L473-L496 HydrophobicContact CD2-CB 3.96Å; L473-L496 HydrophobicContact CG-CD1 4.26Å; F475-L496 HydrophobicContact CB-CD2 4.33Å; V494-L496 HydrophobicContact CG1-CD2 4.05Å; V494-L496 HydrophobicContact CG1-CG 4.48Å; L496-G509 CarbonylContact O-C 3.51Å; L496-G509 WeakPolarHBondContact O-CA 3.5Å; L496-D510 PolarHBondContact N-O 3.39Å; L496-D510 PolarHBondContact O-N 2.98Å; L496-F512 HydrophobicContact CD1-CE1 3.91Å; L496-F512 HydrophobicContact CG-CE1 4.23Å; L496-F537 HydrophobicContact CB-CE2 4.28Å; L496-F537 HydrophobicContact CB-CZ 4.37Å; L496-V558 HydrophobicContact CD2-CB 4.25Å; L496-V558 HydrophobicContact CD2-CG1 3.78Å; L496-V558 HydrophobicContact CD2-CG2 3.61Å
497	M	97.2	Very high	94.1	Very high	39 Å²	39	57.5 Å²	57.5	19%	0.192	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.5	-177.7	-51.9	-176.9	80.6	0	0	112.2	T495 M499 H507 L508 I556 K557 I559	T495-M497 HydrophobicContact CG2-CG 3.91Å; T495-M497 HydrophobicContact CG2-SD 4.23Å; M497-M499 HydrophobicContact CB-SD 4.28Å; M497-H507 HydrophobicContact CE-CB 3.7Å; M497-L508 CarbonylContact C-O 3.5Å; M497-L508 WeakPolarHBondContact CA-O 3.28Å; M497-I556 CarbonylContact O-C 3.49Å; M497-I556 WeakPolarHBondContact O-CA 3.39Å; M497-K557 HydrophobicContact CB-CB 4.28Å; M497-K557 PolarHBondContact N-O 3.1Å; M497-K557 PolarHBondContact O-N 2.86Å; M497-I559 HydrophobicContact SD-CD1 4.45Å
498	L	97.5	Very high	94.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.8	161.3	178.1	71.8	0	0	0	108.8	D500 H507 L508 F537 V538 L543 Y548 I554 I556	L498-D500 PolarHBondContact O-N 3.03Å; L498-H507 WeakPolarHBondContact O-CA 3.45Å; L498-L508 HydrophobicContact CB-CB 4.41Å; L498-L508 HydrophobicContact CD2-CD1 4.4Å; L498-L508 PolarHBondContact N-O 3.16Å; L498-L508 PolarHBondContact O-N 3.31Å; L498-F537 HydrophobicContact CB-CE1 4Å; L498-V538 HydrophobicContact CB-CG2 4.39Å; L498-V538 HydrophobicContact CD2-CB 4.39Å; L498-V538 HydrophobicContact CD2-CG1 4.08Å; L498-V538 HydrophobicContact CD2-CG2 3.97Å; L498-L543 HydrophobicContact CD1-CD1 4.22Å; L498-L543 HydrophobicContact CD2-CD1 3.55Å; L498-L543 HydrophobicContact CG-CD1 4.47Å; L498-Y548 HydrophobicContact CD2-CD1 3.95Å; L498-Y548 HydrophobicContact CD2-CG 3.96Å; L498-Y548 HydrophobicContact CG-CD1 4.13Å; L498-Y548 HydrophobicContact CG-CG 4.49Å; L498-I554 HydrophobicContact CD1-CB 4.38Å; L498-I556 HydrophobicContact CD1-CG1 4.34Å
499	M	97.4	Very high	94.2	Very high	32 Å²	32	56.6 Å²	56.6	16%	0.158	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-84.9	117	-173.2	-53.3	-61.8	-73.7	0	0	111.1	M497 H507 F555 K557	M497-M499 HydrophobicContact CB-SD 4.28Å; M499-H507 WeakPolarHBondContact CA-ND1 3.12Å; M499-H507 VanDerWaalsContact CE-CE1 3.44Å; M499-H507 WeakPolarHBondContact CE-CE1 3.27Å; M499-H507 VanDerWaalsContact CE-NE2 3.33Å; M499-H507 WeakPolarHBondContact CE-NE2 3.42Å; M499-H507 HydrophobicContact SD-CB 4.44Å; M499-F555 HydrophobicContact CB-CB 3.87Å; M499-F555 WeakPolarHBondContact CB-O 3.44Å; M499-F555 HydrophobicContact CG-CB 4.01Å; M499-F555 WeakPolarHBondContact CG-O 3.35Å; M499-F555 PolarHBondContact N-O 3.32Å; M499-K557 HydrophobicContact CE-CD 4.13Å; M499-K557 HydrophobicContact CG-CB 4.05Å; M499-K557 HydrophobicContact SD-CB 3.5Å; M499-K557 WeakPolarHBondContact SD-CB 3.33Å; M499-K557 HydrophobicContact SD-CD 3.98Å; M499-K557 HydrophobicContact SD-CG 4.39Å
500	D	95.8	Very high	94	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.053	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-60	130.3	162.6	-178.1	25.2	0	0	0	112.3	L498 G502 R505 R506 H507 T547 Y548	L498-D500 PolarHBondContact O-N 3.03Å; D500-G502 PolarHBondContact OD1-N 3.43Å; D500-R505 WeakPolarHBondContact OD2-CA 3.45Å; D500-R505 PolarHBondContact OD2-N 3.41Å; D500-R505 VanDerWaalsContact OD2-N 3.16Å; D500-R506 WeakPolarHBondContact CB-O 3.48Å; D500-R506 PolarHBondContact OD2-N 2.97Å; D500-H507 PolarHBondContact N-ND1 3.33Å; D500-T547 VanDerWaalsContact OD1-CB 3.3Å; D500-T547 WeakPolarHBondContact OD1-CB 3.49Å; D500-T547 PolarHBondContact OD1-OG1 3.42Å; D500-Y548 HydrophobicContact CB-CD1 3.96Å; D500-Y548 HydrophobicContact CB-CE1 3.68Å
501	Q	95.1	Very high	93.9	Very high	50 Å²	50	60.1 Å²	60.1	23%	0.234	32%	0.315	C	S	.	.			trans	-102.1	-1.6	179	-57.1	-176.9	67.3	0	0	112.4	T547 Y548 K550 T553 F555	Q501-T547 WeakPolarHBondContact CB-O 3.3Å; Q501-T547 PolarHBondContact N-O 3.46Å; Q501-Y548 PolarHBondContact NE2-O 3.03Å; Q501-K550 HydrophobicContact CB-CB 4.13Å; Q501-T553 PolarHBondContact NE2-O 3.48Å; Q501-F555 HydrophobicContact CG-CD2 4.24Å
502	G	90.6	Very high	93.9	Very high	18 Å²	18	56.4 Å²	56.4	19%	0.186	30%	0.299	C	S	.	.	S	Bend	trans	-73.9	168.1	172.2	0	0	0	0	0	113.2	D500 S504 R505	D500-G502 PolarHBondContact OD1-N 3.43Å; G502-S504 PolarHBondContact O-N 3.11Å; G502-S504 VanDerWaalsContact O-N 3.15Å; G502-R505 PolarHBondContact O-N 3.33Å
503	S	86.4	Confident	93.8	Very high	135 Å²	135	64.2 Å²	64.2	94%	0.944	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.5	-178.4	-46.5	0	0	0	0	113.5
504	S	83.6	Confident	93.7	Very high	62 Å²	62	59.4 Å²	59.4	43%	0.434	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-12.1	-176.9	-168.7	0	0	0	0	114.2	G502 R506	G502-S504 PolarHBondContact O-N 3.11Å; G502-S504 VanDerWaalsContact O-N 3.15Å; S504-R506 VanDerWaalsContact C-N 3.25Å; S504-R506 PolarHBondContact O-N 3.47Å; S504-R506 VanDerWaalsContact O-N 3.15Å; S504-R506 PolarHBondContact OG-NE 3.28Å; S504-R506 PolarHBondContact OG-NH1 3.09Å
505	R	87.1	Confident	93.3	Very high	192 Å²	192	63.3 Å²	63.3	73%	0.725	33%	0.333	S	S	*	.			trans	45.1	42.8	179.8	-61.8	-172.6	-179.3	-179.4	1.2	114.5	D500 G502 H507	D500-R505 WeakPolarHBondContact OD2-CA 3.45Å; D500-R505 PolarHBondContact OD2-N 3.41Å; D500-R505 VanDerWaalsContact OD2-N 3.16Å; G502-R505 PolarHBondContact O-N 3.33Å; R505-H507 VanDerWaalsContact C-N 3.31Å; R505-H507 PolarHBondContact O-N 3.33Å
506	R	91.9	Very high	92.9	Very high	177 Å²	177	65 Å²	65	67%	0.668	35%	0.345	S	S	*	.			trans	-81.8	74.8	177.3	-76	-171.4	-83.9	-112.8	2.1	110.8	D500 S504 Y548	D500-R506 WeakPolarHBondContact CB-O 3.48Å; D500-R506 PolarHBondContact OD2-N 2.97Å; S504-R506 VanDerWaalsContact C-N 3.25Å; S504-R506 PolarHBondContact O-N 3.47Å; S504-R506 VanDerWaalsContact O-N 3.15Å; S504-R506 PolarHBondContact OG-NE 3.28Å; S504-R506 PolarHBondContact OG-NH1 3.09Å; R506-Y548 WeakPolarHBondContact O-CE1 3.09Å; R506-Y548 PolarHBondContact O-OH 2.85Å
507	H	95	Very high	92.6	Very high	65 Å²	65	71.3 Å²	71.3	30%	0.301	38%	0.379	S	S	.	.			trans	-62.8	137.8	178.9	-50.5	-42.5	0	0	0	111.3	M497 L498 M499 D500 R505	M497-H507 HydrophobicContact CE-CB 3.7Å; L498-H507 WeakPolarHBondContact O-CA 3.45Å; M499-H507 WeakPolarHBondContact CA-ND1 3.12Å; M499-H507 VanDerWaalsContact CE-CE1 3.44Å; M499-H507 WeakPolarHBondContact CE-CE1 3.27Å; M499-H507 VanDerWaalsContact CE-NE2 3.33Å; M499-H507 WeakPolarHBondContact CE-NE2 3.42Å; M499-H507 HydrophobicContact SD-CB 4.44Å; D500-H507 PolarHBondContact N-ND1 3.33Å; R505-H507 VanDerWaalsContact C-N 3.31Å; R505-H507 PolarHBondContact O-N 3.33Å
508	L	94.4	Very high	92.4	Very high	52 Å²	52	70.9 Å²	70.9	27%	0.272	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	131.6	172.6	-60.6	177.7	0	0	0	107.9	M497 L498 V538 V542 Y548	M497-L508 CarbonylContact C-O 3.5Å; M497-L508 WeakPolarHBondContact CA-O 3.28Å; L498-L508 HydrophobicContact CB-CB 4.41Å; L498-L508 HydrophobicContact CD2-CD1 4.4Å; L498-L508 PolarHBondContact N-O 3.16Å; L498-L508 PolarHBondContact O-N 3.31Å; L508-V538 HydrophobicContact CB-CG2 4.22Å; L508-V538 HydrophobicContact CD1-CG1 3.81Å; L508-V538 HydrophobicContact CD1-CG2 3.87Å; L508-V542 HydrophobicContact CD1-CG1 4.09Å; L508-Y548 HydrophobicContact CD1-CE1 3.94Å; L508-Y548 HydrophobicContact CD1-CE2 3.92Å; L508-Y548 WeakPolarHBondContact CD2-OH 3.37Å; L508-Y548 HydrophobicContact CG-CE1 3.7Å; L508-Y548 HydrophobicContact CG-CE2 4.42Å; L508-Y548 WeakPolarHBondContact CG-OH 3.48Å
509	G	94.3	Very high	92.2	Very high	47 Å²	47	74.5 Å²	74.5	49%	0.485	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	158.2	-179.1	0	0	0	0	0	113.3	L496	L496-G509 CarbonylContact O-C 3.51Å; L496-G509 WeakPolarHBondContact O-CA 3.5Å
510	D	92.7	Very high	92.1	Very high	79 Å²	79	73.3 Å²	73.3	42%	0.422	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	151.4	175.4	-167.1	10.7	0	0	0	108.5	T495 L496 C534 F537	T495-D510 WeakPolarHBondContact CA-O 3.42Å; L496-D510 PolarHBondContact N-O 3.39Å; L496-D510 PolarHBondContact O-N 2.98Å; D510-C534 PolarHBondContact OD2-SG 2.9Å; D510-F537 HydrophobicContact CB-CD2 4.34Å; D510-F537 HydrophobicContact CB-CE2 4.02Å
511	A	94.6	Very high	92.2	Very high	41 Å²	41	73.1 Å²	73.1	34%	0.339	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	135.7	-179.5	0	0	0	0	0	110.6	V494 T495	V494-A511 CarbonylContact O-C 3.51Å; V494-A511 VanDerWaalsContact O-CA 3.25Å; V494-A511 WeakPolarHBondContact O-CA 3.37Å; T495-A511 HydrophobicContact CG2-CB 4.13Å
512	F	93.9	Very high	92.2	Very high	40 Å²	40	76 Å²	76	18%	0.175	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.1	176.6	62.9	-93.7	0	0	0	110.7	F475 V494 L496 F521	F475-F512 HydrophobicContact CB-CZ 4.04Å; V494-F512 HydrophobicContact CB-CE1 4.17Å; V494-F512 HydrophobicContact CB-CE2 3.95Å; V494-F512 HydrophobicContact CB-CZ 3.77Å; V494-F512 HydrophobicContact CG1-CE1 4.26Å; V494-F512 HydrophobicContact CG1-CZ 4.01Å; V494-F512 HydrophobicContact CG2-CE2 4.11Å; V494-F512 HydrophobicContact CG2-CZ 4.24Å; V494-F512 PolarHBondContact N-O 3.38Å; V494-F512 PolarHBondContact O-N 3.38Å; L496-F512 HydrophobicContact CD1-CE1 3.91Å; L496-F512 HydrophobicContact CG-CE1 4.23Å; F512-F521 HydrophobicContact CD2-CZ 4.44Å; F512-F521 HydrophobicContact CE2-CE1 4.15Å; F512-F521 AromaticContact CE2-CZ 3.7Å; F512-F521 HydrophobicContact CE2-CZ 3.7Å
513	K	92.4	Very high	92.5	Very high	169 Å²	169	80.1 Å²	80.1	74%	0.735	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-97.4	124.3	168.1	-165.7	169.4	-175.9	171.9	0	107.7	D515	K513-D515 PolarHBondContact O-N 2.91Å
514	P	93.7	Very high	92.9	Very high	6 Å²	6	74.1 Å²	74.1	4%	0.039	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-52.6	132.6	178.5	-29.8	36	0	0	0	112.5	F490 Q492 V494 P516 F521	F490-P514 HydrophobicContact CD1-CB 4.14Å; F490-P514 HydrophobicContact CD1-CG 3.6Å; F490-P514 HydrophobicContact CE1-CG 3.65Å; F490-P514 VanDerWaalsContact O-CB 3.23Å; F490-P514 WeakPolarHBondContact O-CB 3.28Å; Q492-P514 WeakPolarHBondContact O-CD 3.46Å; Q492-P514 WeakPolarHBondContact O-CG 3.46Å; V494-P514 HydrophobicContact CG2-CG 4.3Å; P514-P516 WeakPolarHBondContact O-CD 3.42Å; P514-F521 HydrophobicContact CB-CB 4.32Å; P514-F521 HydrophobicContact CB-CD1 3.84Å; P514-F521 HydrophobicContact CB-CD2 3.62Å; P514-F521 HydrophobicContact CB-CE1 3.97Å; P514-F521 HydrophobicContact CB-CE2 3.78Å; P514-F521 HydrophobicContact CB-CG 3.66Å; P514-F521 HydrophobicContact CB-CZ 3.94Å; P514-F521 HydrophobicContact CG-CD1 4.29Å; P514-F521 HydrophobicContact CG-CE1 4.18Å; P514-F521 HydrophobicContact CG-CZ 4.38Å
515	D	89.9	Confident	93.3	Very high	82 Å²	82	77.6 Å²	77.6	44%	0.439	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-77.8	117.2	172.3	176.9	2.2	0	0	0	109.7	K513 N517 S518 F521	K513-D515 PolarHBondContact O-N 2.91Å; D515-N517 PolarHBondContact O-N 3.25Å; D515-N517 WeakPolarHBondContact OD1-CB 3.29Å; D515-N517 PolarHBondContact OD1-N 3.47Å; D515-S518 WeakPolarHBondContact O-CB 3.25Å; D515-S518 PolarHBondContact O-N 3.16Å; D515-F521 WeakPolarHBondContact O-CD2 3.44Å
516	P	88.6	Confident	93.6	Very high	70 Å²	70	69.9 Å²	69.9	46%	0.455	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-25.8	179.1	-26.2	36.1	0	0	0	114.6	P489 P514	P489-P516 HydrophobicContact CG-CB 3.7Å; P514-P516 WeakPolarHBondContact O-CD 3.42Å
517	N	91.4	Very high	93.6	Very high	131 Å²	131	68.1 Å²	68.1	70%	0.701	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-20.4	-178.6	-61.7	-46.8	0	0	0	112.9	D515	D515-N517 PolarHBondContact O-N 3.25Å; D515-N517 WeakPolarHBondContact OD1-CB 3.29Å; D515-N517 PolarHBondContact OD1-N 3.47Å
518	S	94.1	Very high	93.6	Very high	31 Å²	31	68.4 Å²	68.4	22%	0.217	38%	0.382	C	S	.	.	S	Bend	trans	-68.1	132.7	-178.9	174	0	0	0	0	111.3	D515 S520 F521	D515-S518 WeakPolarHBondContact O-CB 3.25Å; D515-S518 PolarHBondContact O-N 3.16Å; S518-S520 PolarHBondContact O-N 3.05Å; S518-S520 VanDerWaalsContact O-N 3.15Å; S518-S520 WeakPolarHBondContact OG-CB 3.27Å; S518-S520 PolarHBondContact OG-N 3.05Å; S518-S520 PolarHBondContact OG-OG 3.18Å; S518-F521 PolarHBondContact O-N 3.13Å
519	S	93.3	Very high	93.7	Very high	75 Å²	75	67 Å²	67	52%	0.524	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-60.5	-22.1	174.5	56.1	0	0	0	0	113	F521	S519-F521 PolarHBondContact O-N 3.35Å
520	S	95.2	Very high	93.7	Very high	8 Å²	8	70.3 Å²	70.3	6%	0.056	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-63.5	-27.2	178.5	-56.6	0	0	0	0	112.6	S518 N529 I530	S518-S520 PolarHBondContact O-N 3.05Å; S518-S520 VanDerWaalsContact O-N 3.15Å; S518-S520 WeakPolarHBondContact OG-CB 3.27Å; S518-S520 PolarHBondContact OG-N 3.05Å; S518-S520 PolarHBondContact OG-OG 3.18Å; S520-N529 WeakPolarHBondContact O-CB 3.36Å; S520-N529 PolarHBondContact O-ND2 3.36Å; S520-I530 WeakPolarHBondContact CB-O 3.46Å; S520-I530 PolarHBondContact OG-O 3.26Å
521	F	97.3	Very high	93.8	Very high	5 Å²	5	67.8 Å²	67.8	2%	0.022	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-112.1	3.1	-173.2	-51.8	-60.6	0	0	0	114	F475 I477 P489 F490 F512 P514 D515 S518 S519 S532	F475-F521 HydrophobicContact CD1-CE1 4.02Å; F475-F521 HydrophobicContact CE1-CE1 4.2Å; I477-F521 HydrophobicContact CD1-CD1 4Å; P489-F521 CarbonylContact C-O 3.55Å; P489-F521 VanDerWaalsContact CA-O 3.31Å; P489-F521 WeakPolarHBondContact CA-O 3.42Å; P489-F521 VanDerWaalsContact CB-O 3.28Å; P489-F521 WeakPolarHBondContact CB-O 3.48Å; F490-F521 HydrophobicContact CB-CB 4.26Å; F490-F521 HydrophobicContact CD1-CD1 4.07Å; F490-F521 PolarHBondContact N-O 3.44Å; F512-F521 HydrophobicContact CD2-CZ 4.44Å; F512-F521 HydrophobicContact CE2-CE1 4.15Å; F512-F521 AromaticContact CE2-CZ 3.7Å; F512-F521 HydrophobicContact CE2-CZ 3.7Å; P514-F521 HydrophobicContact CB-CB 4.32Å; P514-F521 HydrophobicContact CB-CD1 3.84Å; P514-F521 HydrophobicContact CB-CD2 3.62Å; P514-F521 HydrophobicContact CB-CE1 3.97Å; P514-F521 HydrophobicContact CB-CE2 3.78Å; P514-F521 HydrophobicContact CB-CG 3.66Å; P514-F521 HydrophobicContact CB-CZ 3.94Å; P514-F521 HydrophobicContact CG-CD1 4.29Å; P514-F521 HydrophobicContact CG-CE1 4.18Å; P514-F521 HydrophobicContact CG-CZ 4.38Å; D515-F521 WeakPolarHBondContact O-CD2 3.44Å; S518-F521 PolarHBondContact O-N 3.13Å; S519-F521 PolarHBondContact O-N 3.35Å; F521-S532 VanDerWaalsContact CZ-CB 3.47Å; F521-S532 WeakPolarHBondContact CZ-OG 3.49Å
522	K	95.8	Very high	93.8	Very high	111 Å²	111	67.3 Å²	67.3	48%	0.483	36%	0.364	S	S	.	.	S	Bend	trans	-73	165.1	173.2	-66.7	-174.5	-178.3	-177.5	0	110.9	W488 N529	W488-K522 WeakPolarHBondContact CZ3-O 3.46Å; K522-N529 PolarHBondContact O-ND2 3.31Å
523	K	96.8	Very high	93.8	Very high	105 Å²	105	66.5 Å²	66.5	46%	0.457	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-54.3	127.9	175.5	-173.9	169.3	-176.4	-74.2	0	110.4	D483 W488 T525	D483-K523 VanDerWaalsContact O-CE 3.29Å; D483-K523 WeakPolarHBondContact O-CE 3.38Å; W488-K523 HydrophobicContact CB-CB 4.2Å; W488-K523 VanDerWaalsContact CD2-CA 3.49Å; W488-K523 HydrophobicContact CD2-CB 3.76Å; W488-K523 HydrophobicContact CD2-CG 4.19Å; W488-K523 HydrophobicContact CE3-CB 4.33Å; W488-K523 HydrophobicContact CG-CB 3.65Å; W488-K523 HydrophobicContact CG-CD 4.39Å; W488-K523 HydrophobicContact CG-CG 4.12Å; K523-T525 PolarHBondContact O-N 3.45Å
524	P	95.9	Very high	93.8	Very high	8 Å²	8	59.3 Å²	59.3	5%	0.052	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-58.7	135	-177.9	-28.5	36	0	0	0	113.4	I477 R479 W488 N529	I477-P524 HydrophobicContact CG2-CG 3.74Å; R479-P524 HydrophobicContact CB-CB 3.91Å; R479-P524 HydrophobicContact CG-CB 4.33Å; W488-P524 HydrophobicContact CH2-CG 4.02Å; W488-P524 VanDerWaalsContact CZ2-CD 3.47Å; W488-P524 HydrophobicContact CZ2-CG 4.36Å; P524-N529 WeakPolarHBondContact CA-OD1 3.46Å
525	T	91	Very high	93.9	Very high	135 Å²	135	61.3 Å²	61.3	83%	0.828	35%	0.351	S	S	*	.	S	Bend	trans	-105.4	-37.5	171.4	54.4	0	0	0	0	111.5	K523	K523-T525 PolarHBondContact O-N 3.45Å
526	G	92.3	Very high	94.1	Very high	31 Å²	31	61.2 Å²	61.2	32%	0.32	35%	0.353	S	S	.	.	S	Bend	trans	-98.8	-169.1	170.4	0	0	0	0	0	112.9	R479 M528	R479-G526 WeakPolarHBondContact CB-O 3.4Å; G526-M528 VanDerWaalsContact C-N 3.33Å
527	E	93.2	Very high	94.5	Very high	139 Å²	139	59.2 Å²	59.2	65%	0.65	34%	0.337	S	S	*	.	S	Bend	trans	-67	-33.5	177	-67.2	-166.7	150.1	0	0	113.3	M478 R479	M478-E527 CarbonylContact C-O 3.54Å; M478-E527 VanDerWaalsContact CA-O 3.32Å; M478-E527 WeakPolarHBondContact CA-O 3.39Å; R479-E527 PolarHBondContact N-O 3.34Å
528	M	95.2	Very high	94.8	Very high	72 Å²	72	53.3 Å²	53.3	36%	0.355	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-139.4	144.6	178.6	-54.8	-169.4	-154.4	0	0	110.1	Y441 V476 I477 M478 G526	Y441-M528 HydrophobicContact CD1-SD 4.15Å; Y441-M528 HydrophobicContact CE1-SD 3.84Å; V476-M528 HydrophobicContact CG1-CB 3.89Å; V476-M528 HydrophobicContact CG1-CG 4.37Å; V476-M528 HydrophobicContact CG1-SD 4.19Å; I477-M528 WeakPolarHBondContact O-CA 3.41Å; M478-M528 HydrophobicContact CE-CE 3.77Å; M478-M528 HydrophobicContact CE-CG 4.08Å; M478-M528 HydrophobicContact CE-SD 4.25Å; M478-M528 HydrophobicContact CG-CG 4.17Å; G526-M528 VanDerWaalsContact C-N 3.33Å
529	N	95.6	Very high	94.9	Very high	21 Å²	21	53 Å²	53	11%	0.112	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-78.5	172.4	169.6	-75.2	3.3	0	0	0	111.3	I477 S520 K522 P524 A531	I477-N529 HydrophobicContact CB-CB 4.34Å; I477-N529 PolarHBondContact O-N 2.88Å; S520-N529 WeakPolarHBondContact O-CB 3.36Å; S520-N529 PolarHBondContact O-ND2 3.36Å; K522-N529 PolarHBondContact O-ND2 3.31Å; P524-N529 WeakPolarHBondContact CA-OD1 3.46Å; N529-A531 PolarHBondContact O-N 3.12Å
530	I	94.2	Very high	95	Very high	118 Å²	118	50.4 Å²	50.4	61%	0.605	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-59	134.2	167.8	-58.7	-58	0	0	0	109.3	S520	S520-I530 WeakPolarHBondContact CB-O 3.46Å; S520-I530 PolarHBondContact OG-O 3.26Å
531	A	94.9	Very high	95	Very high	26 Å²	26	54.3 Å²	54.3	22%	0.215	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-70.8	141.3	-179.7	0	0	0	0	0	110.7	F474 F475 V476 N529	F474-A531 HydrophobicContact CB-CB 3.75Å; F474-A531 HydrophobicContact CG-CB 4.26Å; F475-A531 WeakPolarHBondContact O-CA 3.49Å; V476-A531 HydrophobicContact CG2-CB 3.71Å; N529-A531 PolarHBondContact O-N 3.12Å
532	S	95.6	Very high	94.9	Very high	30 Å²	30	57.4 Å²	57.4	21%	0.21	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	132.6	179.7	-171.7	0	0	0	0	110.9	F475 F521	F475-S532 WeakPolarHBondContact CB-O 3.49Å; F475-S532 PolarHBondContact N-O 3.25Å; F475-S532 PolarHBondContact O-N 3.13Å; F521-S532 VanDerWaalsContact CZ-CB 3.47Å; F521-S532 WeakPolarHBondContact CZ-OG 3.49Å
533	G	93.1	Very high	94.8	Very high	23 Å²	23	52.1 Å²	52.1	24%	0.237	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.3	-149.8	-173.6	0	0	0	0	0	111.5	P535	G533-P535 WeakPolarHBondContact O-CD 3.47Å
534	C	93.6	Very high	94.6	Very high	19 Å²	19	51.3 Å²	51.3	13%	0.128	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	105.8	-163.8	-55.5	0	0	0	0	110.9	L473 D510 V536 F537	L473-C534 PolarHBondContact N-O 3.4Å; L473-C534 PolarHBondContact O-N 3.15Å; D510-C534 PolarHBondContact OD2-SG 2.9Å; C534-V536 PolarHBondContact O-N 3.45Å; C534-F537 HydrophobicContact CB-CB 3.96Å; C534-F537 HydrophobicContact CB-CD2 4.15Å; C534-F537 HydrophobicContact CB-CG 4.5Å; C534-F537 PolarHBondContact O-N 3.09Å
535	P	94.3	Very high	94.3	Very high	47 Å²	47	57.7 Å²	57.7	31%	0.305	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	-32.4	174.6	-26	35.2	0	0	0	113.3	S472 F474 G533	S472-P535 WeakPolarHBondContact CB-O 3.47Å; S472-P535 PolarHBondContact OG-O 2.79Å; F474-P535 HydrophobicContact CE1-CG 4.09Å; F474-P535 HydrophobicContact CZ-CB 4.45Å; F474-P535 HydrophobicContact CZ-CG 4.14Å; G533-P535 WeakPolarHBondContact O-CD 3.47Å
536	V	95.9	Very high	94.2	Very high	81 Å²	81	52.8 Å²	52.8	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	51.4	179.6	-69.9	0	0	0	0	111.2	C534	C534-V536 PolarHBondContact O-N 3.45Å
537	F	97	Very high	94.3	Very high	27 Å²	27	55 Å²	55	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	-56.1	-172.4	-177.8	-121.1	0	0	0	113.2	L471 L473 L496 L498 D510 C534	L471-F537 HydrophobicContact CD2-CD1 4.02Å; L471-F537 WeakPolarHBondContact O-CB 3.37Å; L471-F537 PolarHBondContact O-N 3.27Å; L473-F537 HydrophobicContact CB-CB 4.24Å; L473-F537 HydrophobicContact CB-CD1 3.71Å; L473-F537 HydrophobicContact CB-CE1 4.27Å; L473-F537 HydrophobicContact CB-CG 4.01Å; L473-F537 HydrophobicContact CD2-CD1 3.92Å; L473-F537 HydrophobicContact CD2-CE1 3.59Å; L473-F537 HydrophobicContact CD2-CZ 4.09Å; L473-F537 HydrophobicContact CG-CD1 4.49Å; L496-F537 HydrophobicContact CB-CE2 4.28Å; L496-F537 HydrophobicContact CB-CZ 4.37Å; L498-F537 HydrophobicContact CB-CE1 4Å; D510-F537 HydrophobicContact CB-CD2 4.34Å; D510-F537 HydrophobicContact CB-CE2 4.02Å; C534-F537 HydrophobicContact CB-CB 3.96Å; C534-F537 HydrophobicContact CB-CD2 4.15Å; C534-F537 HydrophobicContact CB-CG 4.5Å; C534-F537 PolarHBondContact O-N 3.09Å
538	V	96.9	Very high	94.4	Very high	7 Å²	7	49.6 Å²	49.6	4%	0.042	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128.1	177.7	178.3	0	0	0	0	109.8	H470 L471 L498 L508 Q540 V542 L543	H470-V538 CarbonylContact C-O 3.55Å; H470-V538 VanDerWaalsContact CA-O 3.26Å; H470-V538 WeakPolarHBondContact CA-O 3.38Å; H470-V538 WeakPolarHBondContact CB-O 3.48Å; L471-V538 PolarHBondContact N-O 3.37Å; L471-V538 PolarHBondContact O-N 3.49Å; L498-V538 HydrophobicContact CB-CG2 4.39Å; L498-V538 HydrophobicContact CD2-CB 4.39Å; L498-V538 HydrophobicContact CD2-CG1 4.08Å; L498-V538 HydrophobicContact CD2-CG2 3.97Å; L508-V538 HydrophobicContact CB-CG2 4.22Å; L508-V538 HydrophobicContact CD1-CG1 3.81Å; L508-V538 HydrophobicContact CD1-CG2 3.87Å; V538-Q540 PolarHBondContact O-N 3.26Å; V538-V542 HydrophobicContact CG1-CB 4.44Å; V538-L543 HydrophobicContact CG1-CB 3.96Å
539	A	97.1	Very high	94.4	Very high	26 Å²	26	48.3 Å²	48.3	22%	0.215	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	134.8	174	0	0	0	0	0	110.4	H470 T541 V542 L543	H470-A539 VanDerWaalsContact CD2-CA 3.5Å; H470-A539 WeakPolarHBondContact CD2-CA 3.4Å; H470-A539 PolarHBondContact CD2-N 3.01Å; A539-T541 PolarHBondContact O-N 3.04Å; A539-V542 HydrophobicContact CB-CB 4.39Å; A539-V542 HydrophobicContact CB-CG2 4.05Å; A539-V542 PolarHBondContact O-N 3.48Å; A539-L543 PolarHBondContact O-N 3Å; A539-L543 VanDerWaalsContact O-N 3.07Å
540	Q	95.4	Very high	94.4	Very high	19 Å²	19	52.9 Å²	52.9	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-59.2	-36.1	-177.4	-70.9	-179.4	24	0	0	111.7	N461 T469 H470 V538 V542 L543 E544	N461-Q540 PolarHBondContact OD1-NE2 3.28Å; T469-Q540 WeakPolarHBondContact O-CB 3.48Å; T469-Q540 WeakPolarHBondContact O-CG 3.39Å; T469-Q540 PolarHBondContact O-N 3.35Å; H470-Q540 PolarHBondContact O-NE2 3.12Å; H470-Q540 VanDerWaalsContact O-NE2 3.15Å; V538-Q540 PolarHBondContact O-N 3.26Å; Q540-V542 VanDerWaalsContact C-N 3.34Å; Q540-V542 PolarHBondContact O-N 3.04Å; Q540-L543 PolarHBondContact O-N 3.18Å; Q540-E544 WeakPolarHBondContact O-CB 3.46Å; Q540-E544 WeakPolarHBondContact O-CG 3.31Å; Q540-E544 PolarHBondContact O-N 3.3Å
541	T	94.4	Very high	94.4	Very high	90 Å²	90	53.8 Å²	53.8	55%	0.552	31%	0.313	S	S	*	.	H	α-helix	trans	-60.5	-40.1	175.2	52.6	0	0	0	0	112.8	A539 N545	A539-T541 PolarHBondContact O-N 3.04Å; T541-N545 WeakPolarHBondContact O-CB 3.49Å; T541-N545 PolarHBondContact O-N 3Å; T541-N545 PolarHBondContact O-ND2 3.49Å
542	V	94.9	Very high	94.4	Very high	71 Å²	71	54.9 Å²	54.9	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-71	-40.4	178.3	175.4	0	0	0	0	111	L508 V538 A539 Q540 G546 Y548	L508-V542 HydrophobicContact CD1-CG1 4.09Å; V538-V542 HydrophobicContact CG1-CB 4.44Å; A539-V542 HydrophobicContact CB-CB 4.39Å; A539-V542 HydrophobicContact CB-CG2 4.05Å; A539-V542 PolarHBondContact O-N 3.48Å; Q540-V542 VanDerWaalsContact C-N 3.34Å; Q540-V542 PolarHBondContact O-N 3.04Å; V542-G546 WeakPolarHBondContact O-CA 3.36Å; V542-G546 PolarHBondContact O-N 3.04Å; V542-G546 VanDerWaalsContact O-N 3.16Å; V542-Y548 HydrophobicContact CG1-CE2 4.16Å
543	L	93.6	Very high	94.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.6	-48	178.1	171	63.5	0	0	0	111.7	Y425 L471 L498 V538 A539 Q540 I549 I554	Y425-L543 HydrophobicContact CE2-CD2 3.87Å; Y425-L543 WeakPolarHBondContact OH-CD2 3.5Å; L471-L543 HydrophobicContact CB-CD2 4.2Å; L471-L543 HydrophobicContact CD1-CD2 3.67Å; L498-L543 HydrophobicContact CD1-CD1 4.22Å; L498-L543 HydrophobicContact CD2-CD1 3.55Å; L498-L543 HydrophobicContact CG-CD1 4.47Å; V538-L543 HydrophobicContact CG1-CB 3.96Å; A539-L543 PolarHBondContact O-N 3Å; A539-L543 VanDerWaalsContact O-N 3.07Å; Q540-L543 PolarHBondContact O-N 3.18Å; L543-I549 HydrophobicContact CD1-CD1 4.4Å; L543-I549 HydrophobicContact CD1-CG1 3.99Å; L543-I549 HydrophobicContact CG-CD1 4.19Å; L543-I549 HydrophobicContact CG-CG1 4.32Å; L543-I554 HydrophobicContact CD1-CG2 4.21Å
544	E	92.6	Very high	94.7	Very high	87 Å²	87	53 Å²	53	41%	0.407	30%	0.298	S	S	.	.	H	α-helix	trans	-82.6	-28.8	-172.1	-66.7	-179.5	135.6	0	0	113.7	Y425 K429 Q540 I549	Y425-E544 HydrophobicContact CE1-CG 4.29Å; K429-E544 VanDerWaalsContact CD-OE1 3.31Å; K429-E544 WeakPolarHBondContact CD-OE1 3.37Å; K429-E544 WeakPolarHBondContact CE-OE1 3.49Å; K429-E544 IonicContact NZ-OE1 3.09Å; K429-E544 PolarHBondContact NZ-OE1 3.44Å; K429-E544 IonicContact NZ-OE2 3.11Å; K429-E544 PolarHBondContact NZ-OE2 3.28Å; Q540-E544 WeakPolarHBondContact O-CB 3.46Å; Q540-E544 WeakPolarHBondContact O-CG 3.31Å; Q540-E544 PolarHBondContact O-N 3.3Å; E544-I549 HydrophobicContact CG-CD1 4.1Å
545	N	90.4	Very high	94.9	Very high	142 Å²	142	54.8 Å²	54.8	76%	0.759	30%	0.304	S	S	*	.	H	α-helix	trans	-92.2	-8.3	176.8	-58.4	-21.1	0	0	0	112.8	T541	T541-N545 WeakPolarHBondContact O-CB 3.49Å; T541-N545 PolarHBondContact O-N 3Å; T541-N545 PolarHBondContact O-ND2 3.49Å
546	G	88.7	Confident	95.1	Very high	32 Å²	32	52.6 Å²	52.6	33%	0.33	29%	0.29	S	S	.	.	S	Bend	trans	-93.2	-171.9	-179.1	0	0	0	0	0	114	V542 Y548	V542-G546 WeakPolarHBondContact O-CA 3.36Å; V542-G546 PolarHBondContact O-N 3.04Å; V542-G546 VanDerWaalsContact O-N 3.16Å; G546-Y548 VanDerWaalsContact C-N 3.27Å; G546-Y548 PolarHBondContact O-N 3.29Å
547	T	94	Very high	95.1	Very high	79 Å²	79	51.3 Å²	51.3	49%	0.485	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	20.4	176.7	47.8	0	0	0	0	113.4	D500 Q501	D500-T547 VanDerWaalsContact OD1-CB 3.3Å; D500-T547 WeakPolarHBondContact OD1-CB 3.49Å; D500-T547 PolarHBondContact OD1-OG1 3.42Å; Q501-T547 WeakPolarHBondContact CB-O 3.3Å; Q501-T547 PolarHBondContact N-O 3.46Å
548	Y	95	Very high	95.2	Very high	25 Å²	25	50 Å²	50	10%	0.098	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-21.7	-176.8	-58.9	-74.8	0	0	0	113.3	L498 D500 Q501 R506 L508 V542 G546	L498-Y548 HydrophobicContact CD2-CD1 3.95Å; L498-Y548 HydrophobicContact CD2-CG 3.96Å; L498-Y548 HydrophobicContact CG-CD1 4.13Å; L498-Y548 HydrophobicContact CG-CG 4.49Å; D500-Y548 HydrophobicContact CB-CD1 3.96Å; D500-Y548 HydrophobicContact CB-CE1 3.68Å; Q501-Y548 PolarHBondContact NE2-O 3.03Å; R506-Y548 WeakPolarHBondContact O-CE1 3.09Å; R506-Y548 PolarHBondContact O-OH 2.85Å; L508-Y548 HydrophobicContact CD1-CE1 3.94Å; L508-Y548 HydrophobicContact CD1-CE2 3.92Å; L508-Y548 WeakPolarHBondContact CD2-OH 3.37Å; L508-Y548 HydrophobicContact CG-CE1 3.7Å; L508-Y548 HydrophobicContact CG-CE2 4.42Å; L508-Y548 WeakPolarHBondContact CG-OH 3.48Å; V542-Y548 HydrophobicContact CG1-CE2 4.16Å; G546-Y548 VanDerWaalsContact C-N 3.27Å; G546-Y548 PolarHBondContact O-N 3.29Å
549	I	95.9	Very high	95.2	Very high	45 Å²	45	52.1 Å²	52.1	23%	0.231	28%	0.282	C	S	.	.			trans	-107.4	123.7	172.1	-51.4	179.1	0	0	0	108.1	Y425 L543 E544 I554	Y425-I549 HydrophobicContact CD1-CD1 3.62Å; Y425-I549 HydrophobicContact CE1-CD1 3.57Å; Y425-I549 HydrophobicContact CE2-CD1 4.48Å; Y425-I549 HydrophobicContact CG-CD1 4.13Å; L543-I549 HydrophobicContact CD1-CD1 4.4Å; L543-I549 HydrophobicContact CD1-CG1 3.99Å; L543-I549 HydrophobicContact CG-CD1 4.19Å; L543-I549 HydrophobicContact CG-CG1 4.32Å; E544-I549 HydrophobicContact CG-CD1 4.1Å; I549-I554 HydrophobicContact CB-CG2 4.31Å; I549-I554 HydrophobicContact CD1-CG2 4.48Å; I549-I554 HydrophobicContact CG1-CG2 3.62Å
550	K	94.6	Very high	95.2	Very high	116 Å²	116	51 Å²	51	50%	0.504	27%	0.273	S	S	.	.	B	Isolated β-bridge	trans	-139.5	139.3	171.3	-168.1	-179.1	175.9	-179.6	0	108.3	Q501 D552 T553	Q501-K550 HydrophobicContact CB-CB 4.13Å; K550-D552 PolarHBondContact O-N 2.88Å; K550-T553 PolarHBondContact N-O 3.34Å; K550-T553 WeakPolarHBondContact O-CB 3.46Å; K550-T553 PolarHBondContact O-N 3.17Å
551	D	94.3	Very high	95.2	Very high	137 Å²	137	52.9 Å²	52.9	73%	0.733	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	45.1	-178.2	-50.7	-38.5	0	0	0	112.3	T553	D551-T553 PolarHBondContact O-N 3.49Å; D551-T553 PolarHBondContact O-OG1 3.03Å
552	D	96	Very high	95.1	Very high	49 Å²	49	50.9 Å²	50.9	26%	0.262	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	32.4	-175.9	-159.8	29	0	0	0	114.2	D424 Y425 K426 K550	D424-D552 WeakPolarHBondContact CA-OD2 3.4Å; D424-D552 PolarHBondContact N-O 3.41Å; Y425-D552 PolarHBondContact N-O 3.5Å; Y425-D552 PolarHBondContact N-OD1 2.92Å; K426-D552 WeakPolarHBondContact CG-OD1 3.49Å; K426-D552 PolarHBondContact N-OD1 3.11Å; K550-D552 PolarHBondContact O-N 2.88Å
553	T	96.5	Very high	94.8	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.086	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	142	-173.4	-59.6	0	0	0	0	110.7	K421 I422 R423 Q501 K550 D551 F555	K421-T553 HydrophobicContact CD-CG2 4.3Å; K421-T553 HydrophobicContact CG-CG2 3.61Å; I422-T553 VanDerWaalsContact O-CA 3.28Å; I422-T553 WeakPolarHBondContact O-CA 3.47Å; I422-T553 WeakPolarHBondContact O-CG2 3.49Å; R423-T553 HydrophobicContact CG-CG2 4.41Å; Q501-T553 PolarHBondContact NE2-O 3.48Å; K550-T553 PolarHBondContact N-O 3.34Å; K550-T553 WeakPolarHBondContact O-CB 3.46Å; K550-T553 PolarHBondContact O-N 3.17Å; D551-T553 PolarHBondContact O-N 3.49Å; D551-T553 PolarHBondContact O-OG1 3.03Å; T553-F555 HydrophobicContact CG2-CD2 4.43Å; T553-F555 HydrophobicContact CG2-CE2 3.95Å; T553-F555 HydrophobicContact CG2-CZ 4.25Å
554	I	97.5	Very high	94.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.5	168.5	63.2	172.2	0	0	0	111.1	I422 Y425 L460 L471 L498 L543 I549 I556	I422-I554 HydrophobicContact CB-CD1 4.4Å; I422-I554 HydrophobicContact CB-CG1 3.76Å; I422-I554 HydrophobicContact CD1-CD1 4.08Å; I422-I554 HydrophobicContact CD1-CG1 4.23Å; I422-I554 HydrophobicContact CG1-CG1 4.41Å; I422-I554 HydrophobicContact CG2-CG1 4.43Å; I422-I554 PolarHBondContact N-O 2.98Å; I422-I554 PolarHBondContact O-N 3.39Å; Y425-I554 HydrophobicContact CD2-CD1 3.84Å; Y425-I554 HydrophobicContact CD2-CG1 4.17Å; Y425-I554 HydrophobicContact CD2-CG2 3.91Å; Y425-I554 HydrophobicContact CE2-CD1 3.98Å; Y425-I554 HydrophobicContact CE2-CG2 4.38Å; Y425-I554 HydrophobicContact CG-CG2 4.46Å; L460-I554 HydrophobicContact CD2-CD1 4.09Å; L471-I554 HydrophobicContact CD1-CD1 4.1Å; L498-I554 HydrophobicContact CD1-CB 4.38Å; L543-I554 HydrophobicContact CD1-CG2 4.21Å; I549-I554 HydrophobicContact CB-CG2 4.31Å; I549-I554 HydrophobicContact CD1-CG2 4.48Å; I549-I554 HydrophobicContact CG1-CG2 3.62Å; I554-I556 HydrophobicContact CD1-CD1 4.5Å
555	F	97.7	Very high	93.5	Very high	57 Å²	57	56 Å²	56	25%	0.25	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	126	175.1	-70.1	-90.1	0	0	0	110.4	I419 W420 K421 M499 Q501 T553	I419-F555 HydrophobicContact CG2-CD1 4.25Å; W420-F555 WeakPolarHBondContact O-CA 2.99Å; K421-F555 HydrophobicContact CB-CD1 3.91Å; K421-F555 HydrophobicContact CB-CE1 3.6Å; K421-F555 HydrophobicContact CB-CZ 4.38Å; K421-F555 HydrophobicContact CD-CE1 3.73Å; K421-F555 HydrophobicContact CD-CZ 3.79Å; K421-F555 HydrophobicContact CG-CD1 4.15Å; K421-F555 HydrophobicContact CG-CE1 3.52Å; K421-F555 HydrophobicContact CG-CZ 3.78Å; M499-F555 HydrophobicContact CB-CB 3.87Å; M499-F555 WeakPolarHBondContact CB-O 3.44Å; M499-F555 HydrophobicContact CG-CB 4.01Å; M499-F555 WeakPolarHBondContact CG-O 3.35Å; M499-F555 PolarHBondContact N-O 3.32Å; Q501-F555 HydrophobicContact CG-CD2 4.24Å; T553-F555 HydrophobicContact CG2-CD2 4.43Å; T553-F555 HydrophobicContact CG2-CE2 3.95Å; T553-F555 HydrophobicContact CG2-CZ 4.25Å
556	I	97.9	Very high	92.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.9	173.2	-69.5	166.5	0	0	0	108.1	W420 I422 V458 L473 M497 L498 I554 V558	W420-I556 HydrophobicContact CB-CB 4.34Å; W420-I556 HydrophobicContact CE3-CB 4.31Å; W420-I556 HydrophobicContact CE3-CD1 3.94Å; W420-I556 HydrophobicContact CE3-CG2 4.45Å; W420-I556 HydrophobicContact CZ3-CD1 4.21Å; W420-I556 PolarHBondContact N-O 3.38Å; W420-I556 PolarHBondContact O-N 3.01Å; I422-I556 HydrophobicContact CD1-CD1 3.79Å; V458-I556 HydrophobicContact CB-CD1 4.31Å; V458-I556 HydrophobicContact CG2-CD1 3.99Å; L473-I556 HydrophobicContact CD1-CD1 3.96Å; L473-I556 HydrophobicContact CD1-CG2 4.11Å; L473-I556 HydrophobicContact CD2-CG2 3.68Å; M497-I556 CarbonylContact O-C 3.49Å; M497-I556 WeakPolarHBondContact O-CA 3.39Å; L498-I556 HydrophobicContact CD1-CG1 4.34Å; I554-I556 HydrophobicContact CD1-CD1 4.5Å; I556-V558 HydrophobicContact CG2-CG2 4.33Å
557	K	97.8	Very high	91	Very high	55 Å²	55	60.5 Å²	60.5	24%	0.239	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.3	173.5	-179.6	176	-169.2	-171.1	0	109.5	V417 L418 I419 M497 M499 I559	V417-K557 HydrophobicContact CG1-CG 4.47Å; L418-K557 VanDerWaalsContact O-CA 3.27Å; L418-K557 WeakPolarHBondContact O-CA 3.37Å; I419-K557 HydrophobicContact CD1-CB 3.81Å; I419-K557 HydrophobicContact CD1-CD 3.67Å; I419-K557 HydrophobicContact CD1-CG 3.55Å; M497-K557 HydrophobicContact CB-CB 4.28Å; M497-K557 PolarHBondContact N-O 3.1Å; M497-K557 PolarHBondContact O-N 2.86Å; M499-K557 HydrophobicContact CE-CD 4.13Å; M499-K557 HydrophobicContact CG-CB 4.05Å; M499-K557 HydrophobicContact SD-CB 3.5Å; M499-K557 WeakPolarHBondContact SD-CB 3.33Å; M499-K557 HydrophobicContact SD-CD 3.98Å; M499-K557 HydrophobicContact SD-CG 4.39Å; K557-I559 HydrophobicContact CD-CD1 4.12Å; K557-I559 HydrophobicContact CD-CG1 4.21Å; K557-I559 HydrophobicContact CG-CD1 4.45Å; K557-I559 HydrophobicContact CG-CG1 4.02Å
558	V	98	Very high	89.1	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.5	169.7	-177.6	0	0	0	0	108.2	V417 L418 F445 A456 F475 V494 T495 L496 I556	V417-V558 WeakPolarHBondContact CA-O 3.44Å; L418-V558 HydrophobicContact CB-CB 4.06Å; L418-V558 HydrophobicContact CD2-CB 4.3Å; L418-V558 HydrophobicContact CD2-CG2 4.08Å; L418-V558 PolarHBondContact N-O 3.03Å; L418-V558 PolarHBondContact O-N 3.48Å; F445-V558 HydrophobicContact CE1-CG1 4.44Å; F445-V558 HydrophobicContact CE2-CG1 4.39Å; F445-V558 HydrophobicContact CZ-CB 4.1Å; F445-V558 HydrophobicContact CZ-CG1 3.69Å; A456-V558 HydrophobicContact CB-CG2 4.03Å; F475-V558 HydrophobicContact CD2-CG1 4.27Å; V494-V558 HydrophobicContact CG1-CG1 3.95Å; T495-V558 CarbonylContact O-C 3.58Å; T495-V558 WeakPolarHBondContact O-CA 3.39Å; L496-V558 HydrophobicContact CD2-CB 4.25Å; L496-V558 HydrophobicContact CD2-CG1 3.78Å; L496-V558 HydrophobicContact CD2-CG2 3.61Å; I556-V558 HydrophobicContact CG2-CG2 4.33Å
559	I	97.8	Very high	88.8	Confident	51 Å²	51	67.2 Å²	67.2	26%	0.262	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.7	177.3	-53.1	175.1	0	0	0	107.7	G416 V417 V494 T495 M497 K557	G416-I559 CarbonylContact O-C 3.57Å; G416-I559 WeakPolarHBondContact O-CA 3.38Å; V417-I559 HydrophobicContact CG1-CG1 4.49Å; V417-I559 HydrophobicContact CG2-CG2 4.4Å; V494-I559 CarbonylContact C-O 3.59Å; V494-I559 WeakPolarHBondContact CA-O 3.41Å; T495-I559 PolarHBondContact N-O 3.3Å; T495-I559 PolarHBondContact O-N 3.35Å; M497-I559 HydrophobicContact SD-CD1 4.45Å; K557-I559 HydrophobicContact CD-CD1 4.12Å; K557-I559 HydrophobicContact CD-CG1 4.21Å; K557-I559 HydrophobicContact CG-CD1 4.45Å; K557-I559 HydrophobicContact CG-CG1 4.02Å
560	V	97.3	Very high	88.4	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.018	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.3	171.7	176.1	0	0	0	0	107.4	G416 F445 T447 M454 F475 F490 Q492 V494 T562	G416-V560 PolarHBondContact O-N 3.44Å; F445-V560 HydrophobicContact CE2-CG2 3.81Å; F445-V560 HydrophobicContact CZ-CG2 3.94Å; T447-V560 HydrophobicContact CG2-CB 4.41Å; T447-V560 HydrophobicContact CG2-CG1 3.72Å; M454-V560 HydrophobicContact CE-CB 4.3Å; M454-V560 HydrophobicContact CE-CG1 4.48Å; M454-V560 HydrophobicContact CE-CG2 3.98Å; M454-V560 HydrophobicContact SD-CB 4.39Å; M454-V560 HydrophobicContact SD-CG1 4.21Å; M454-V560 HydrophobicContact SD-CG2 3.77Å; F475-V560 HydrophobicContact CE2-CG2 3.89Å; F475-V560 HydrophobicContact CZ-CG2 4.36Å; F490-V560 HydrophobicContact CE2-CG1 4.13Å; F490-V560 HydrophobicContact CZ-CG1 3.65Å; Q492-V560 HydrophobicContact CB-CG1 3.66Å; Q492-V560 HydrophobicContact CG-CG1 4.31Å; V494-V560 HydrophobicContact CG1-CG2 4.5Å; V494-V560 HydrophobicContact CG2-CG2 4.35Å; V560-T562 PolarHBondContact O-N 3.42Å
561	D	95.3	Very high	88.1	Confident	58 Å²	58	65.7 Å²	65.7	31%	0.31	37%	0.374	S	S	.	.			trans	-70.4	113.7	179.2	-171.2	-4.4	0	0	0	110.8	Q492 K493 S563	Q492-D561 WeakPolarHBondContact CB-O 3.38Å; Q492-D561 PolarHBondContact NE2-O 2.91Å; K493-D561 HydrophobicContact CB-CB 4.09Å; K493-D561 PolarHBondContact O-N 3.39Å; D561-S563 VanDerWaalsContact OD1-CB 3.26Å; D561-S563 WeakPolarHBondContact OD1-CB 3.43Å; D561-S563 PolarHBondContact OD1-N 3.09Å; D561-S563 PolarHBondContact OD1-OG 3.15Å
562	T	92.5	Very high	87.7	Confident	48 Å²	48	61.5 Å²	61.5	29%	0.294	35%	0.353	S	S	.	.			trans	-99.6	-0.3	-179.1	57.8	0	0	0	0	113.2	T447 V560 D564 L565	T447-T562 HydrophobicContact CG2-CG2 3.92Å; T447-T562 WeakPolarHBondContact O-CG2 3.39Å; V560-T562 PolarHBondContact O-N 3.42Å; T562-D564 PolarHBondContact O-N 3.43Å; T562-L565 HydrophobicContact CG2-CD1 4.37Å; T562-L565 PolarHBondContact O-N 3.07Å
563	S	87.1	Confident	87.2	Confident	99 Å²	99	62.3 Å²	62.3	69%	0.692	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-31.4	-172.1	-46.1	0	0	0	0	113.4	D561	D561-S563 VanDerWaalsContact OD1-CB 3.26Å; D561-S563 WeakPolarHBondContact OD1-CB 3.43Å; D561-S563 PolarHBondContact OD1-N 3.09Å; D561-S563 PolarHBondContact OD1-OG 3.15Å
564	D	79.8	Confident	86.5	Confident	133 Å²	133	65.5 Å²	65.5	71%	0.711	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	5.1	-179	-64.1	-24.6	0	0	0	113.4	T562	T562-D564 PolarHBondContact O-N 3.43Å
565	L	79.8	Confident	85.8	Confident	33 Å²	33	70.1 Å²	70.1	17%	0.173	40%	0.404	C	S	.	.	S	Bend	trans	-89.6	141.1	176	-66.2	177.8	0	0	0	110.2	T447 Y452 Q492 T562 D567	T447-L565 HydrophobicContact CG2-CD1 3.89Å; Y452-L565 HydrophobicContact CD2-CD1 4.18Å; Y452-L565 HydrophobicContact CE2-CD1 4.1Å; Y452-L565 HydrophobicContact CE2-CD2 3.85Å; Q492-L565 HydrophobicContact CG-CD1 4.16Å; Q492-L565 HydrophobicContact CG-CD2 4.15Å; Q492-L565 HydrophobicContact CG-CG 4.23Å; T562-L565 HydrophobicContact CG2-CD1 4.37Å; T562-L565 PolarHBondContact O-N 3.07Å; L565-D567 PolarHBondContact O-N 3.5Å
566	P	63.1	Low	84.8	Confident	111 Å²	111	71.2 Å²	71.2	72%	0.721	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-59.9	120.9	174.5	-17.2	29	0	0	0	110.2
567	D	62.3	Low	83.8	Confident	157 Å²	157	77.1 Å²	77.1	84%	0.84	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-87	117.2	164.6	-159.5	9.1	0	0	0	106.8	L565	L565-D567 PolarHBondContact O-N 3.5Å
568	P	54.4	Low	82.5	Confident	177 Å²	177	79.1 Å²	79.1	100%	1.149	47%	0.47	S	S	*	.			trans	-62.9	0	-173	22.7	-33.7	0	0	0	115.4

Retrieved 568 of 568 residues in 1201.1 ms (Link to these results)

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