A0A077Z7U4_TRITR Loading...

Newborn larvae specific serine protease ss2

AlphaFold DB , UniProt , Accession A0A077Z7U4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 318 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.1	Very low	29.4	Very low	243 Å²	243	167.1 Å²	167.1	100%	1.197	87%	0.868	S	S	*	*				0	89.5	0	-69.8	174.6	171.3	0	0	109.1	K3	M1-K3 PolarHBondContact O-N 3.43Å
2	K	32	Very low	29.3	Very low	226 Å²	226	172.9 Å²	172.9	98%	0.983	87%	0.87	S	S	*	*			trans	-89.2	101.6	176.9	-80.8	-179	174.7	178.8	0	108.3
3	K	30.5	Very low	29.2	Very low	213 Å²	213	173.8 Å²	173.8	93%	0.926	87%	0.865	S	S	*	*			trans	-101.8	122.3	164.7	-82.1	-174.7	175.5	-178.8	0	107.7	M1	M1-K3 PolarHBondContact O-N 3.43Å
4	G	29.3	Very low	29.2	Very low	78 Å²	78	174.4 Å²	174.4	80%	0.804	86%	0.861	S	S	*	*			trans	167.6	131.7	173.3	0	0	0	0	0	107.8
5	R	31.4	Very low	29.5	Very low	245 Å²	245	174.9 Å²	174.9	93%	0.925	86%	0.859	S	S	*	*			cis	-163.3	117	4	-153.9	-179.7	-149.6	178.1	4.2	102	S7	R5-S7 PolarHBondContact O-N 3.06Å; R5-S7 VanDerWaalsContact O-N 3.15Å
6	H	29.9	Very low	29.7	Very low	175 Å²	175	167.4 Å²	167.4	81%	0.81	83%	0.83	S	S	*	*			trans	-73.2	108.6	176	-75.1	-80.7	0	0	0	108.1	F8	H6-F8 HydrophobicContact CB-CD2 4.12Å; H6-F8 HydrophobicContact CB-CE2 3.73Å; H6-F8 PolarHBondContact O-N 3.24Å
7	S	26.7	Very low	30.3	Very low	109 Å²	109	166.8 Å²	166.8	76%	0.762	82%	0.824	S	S	*	*			trans	-80.9	108.5	171	-179.4	0	0	0	0	107.9	R5	R5-S7 PolarHBondContact O-N 3.06Å; R5-S7 VanDerWaalsContact O-N 3.15Å
8	F	29.3	Very low	30.5	Very low	176 Å²	176	164.8 Å²	164.8	77%	0.772	81%	0.807	S	S	*	*			trans	-97	110.9	169.2	-78.1	-86.7	0	0	0	108.6	H6 V10	H6-F8 HydrophobicContact CB-CD2 4.12Å; H6-F8 HydrophobicContact CB-CE2 3.73Å; H6-F8 PolarHBondContact O-N 3.24Å; F8-V10 PolarHBondContact O-N 2.67Å
9	T	24.6	Very low	30.9	Very low	134 Å²	134	165.9 Å²	165.9	82%	0.822	81%	0.807	S	S	*	*			trans	-73.5	107.7	173.9	-37.5	0	0	0	0	108.1	S11	T9-S11 PolarHBondContact O-N 2.88Å
10	V	29.4	Very low	31.3	Very low	138 Å²	138	159.6 Å²	159.6	84%	0.836	78%	0.78	S	S	*	*			trans	-77.7	107.6	174.9	179.8	0	0	0	0	107.8	F8	F8-V10 PolarHBondContact O-N 2.67Å
11	S	25.6	Very low	31.6	Very low	101 Å²	101	159.2 Å²	159.2	71%	0.706	78%	0.781	S	S	*	*			trans	-67.1	129.6	172.2	61.2	0	0	0	0	109.9	T9 F13	T9-S11 PolarHBondContact O-N 2.88Å; S11-F13 PolarHBondContact O-N 3.23Å
12	R	28	Very low	31.9	Very low	237 Å²	237	155.6 Å²	155.6	89%	0.894	76%	0.76	S	S	*	*			trans	-36.2	117.6	166.5	-70.9	175.4	173.8	-172.2	-3.9	111.2
13	F	27.6	Very low	32.4	Very low	185 Å²	185	150.4 Å²	150.4	81%	0.811	75%	0.749	S	S	*	*			trans	-174.3	126.1	147.3	-99.8	-69.1	0	0	0	108.7	S11	S11-F13 PolarHBondContact O-N 3.23Å
14	F	28.9	Very low	32.7	Very low	182 Å²	182	143.5 Å²	143.5	80%	0.798	74%	0.738	S	S	*	*			trans	71.5	97.6	173	-61.7	-81.5	0	0	0	118.1	S16	F14-S16 VanDerWaalsContact C-N 3.3Å; F14-S16 PolarHBondContact O-N 3.19Å
15	H	33.6	Very low	33.2	Very low	181 Å²	181	151.2 Å²	151.2	84%	0.838	74%	0.743	S	S	*	*			trans	-69	85.8	158	-79.3	-53.8	0	0	0	109.5
16	S	33.8	Very low	33.7	Very low	56 Å²	56	149.6 Å²	149.6	39%	0.392	74%	0.739	S	S	.	*			trans	-107.6	103.4	147.9	61.1	0	0	0	0	105.9	F14 Y18	F14-S16 VanDerWaalsContact C-N 3.3Å; F14-S16 PolarHBondContact O-N 3.19Å; S16-Y18 WeakPolarHBondContact O-CD2 3.38Å; S16-Y18 WeakPolarHBondContact O-CE2 3.18Å; S16-Y18 PolarHBondContact O-N 2.89Å; S16-Y18 VanDerWaalsContact OG-CE2 3.31Å; S16-Y18 WeakPolarHBondContact OG-CE2 3.39Å
17	E	39.2	Very low	34.1	Very low	156 Å²	156	150.1 Å²	150.1	73%	0.729	75%	0.746	S	S	*	*			trans	-63.2	121.6	175.2	-68.5	-167.1	154.4	0	0	108.9	L35	E17-L35 WeakPolarHBondContact O-CD1 3.43Å
18	Y	34.7	Very low	34.7	Very low	132 Å²	132	152 Å²	152	52%	0.518	75%	0.747	S	S	.	*			trans	-95.7	120.5	175.6	-67.5	-83.8	0	0	0	108.7	S16 C20 C32	S16-Y18 WeakPolarHBondContact O-CD2 3.38Å; S16-Y18 WeakPolarHBondContact O-CE2 3.18Å; S16-Y18 PolarHBondContact O-N 2.89Å; S16-Y18 VanDerWaalsContact OG-CE2 3.31Å; S16-Y18 WeakPolarHBondContact OG-CE2 3.39Å; Y18-C20 PolarHBondContact O-N 3.12Å; Y18-C32 HydrophobicContact CD1-CB 3.7Å; Y18-C32 HydrophobicContact CE1-CB 4.21Å
19	F	38.5	Very low	35.2	Very low	185 Å²	185	148.2 Å²	148.2	81%	0.811	74%	0.742	S	S	*	*			trans	-82.4	101.5	167.1	-124.7	-87.6	0	0	0	109.2
20	C	38.6	Very low	36	Very low	39 Å²	39	147.7 Å²	147.7	26%	0.264	73%	0.733	S	S	.	*			trans	-91.7	113.3	176.7	-64.4	0	0	0	0	109.7	Y18 F22 C32	Y18-C20 PolarHBondContact O-N 3.12Å; C20-F22 HydrophobicContact CB-CD2 4.24Å; C20-F22 HydrophobicContact CB-CE2 3.62Å; C20-F22 HydrophobicContact CB-CZ 3.97Å; C20-F22 VanDerWaalsContact O-CD2 3.29Å; C20-F22 WeakPolarHBondContact O-CD2 3.44Å; C20-F22 PolarHBondContact O-N 3.49Å; C20-C32 PolarHBondContact SG-SG 2.93Å
21	N	37.5	Very low	36.5	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	73%	0.725	S	S	*	*			trans	-77.6	121.6	169.5	-116	-22.6	0	0	0	109	P23	N21-P23 WeakPolarHBondContact O-CD 3.35Å
22	F	41.4	Very low	37.2	Very low	168 Å²	168	144.1 Å²	144.1	74%	0.737	71%	0.709	S	S	*	*			trans	-106.2	79.8	177.8	-68.5	-87.5	0	0	0	110.8	C20 G24	C20-F22 HydrophobicContact CB-CD2 4.24Å; C20-F22 HydrophobicContact CB-CE2 3.62Å; C20-F22 HydrophobicContact CB-CZ 3.97Å; C20-F22 VanDerWaalsContact O-CD2 3.29Å; C20-F22 WeakPolarHBondContact O-CD2 3.44Å; C20-F22 PolarHBondContact O-N 3.49Å; F22-G24 PolarHBondContact O-N 2.96Å
23	P	42.6	Very low	37.6	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	70%	0.703	S	S	*	*			trans	-70.8	130.7	165.8	29.1	-29.5	0	0	0	108.9	N21	N21-P23 WeakPolarHBondContact O-CD 3.35Å
24	G	36	Very low	38.2	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	70%	0.699	S	S	*	*	S	Bend	trans	-57.1	148.5	-162.6	0	0	0	0	0	117.6	F22 Y26	F22-G24 PolarHBondContact O-N 2.96Å; G24-Y26 PolarHBondContact O-N 2.82Å; G24-Y26 VanDerWaalsContact O-N 3.11Å
25	R	40.9	Very low	39	Very low	240 Å²	240	135 Å²	135	91%	0.906	69%	0.685	S	S	*	*	S	Bend	trans	50.4	27.7	147	-74.6	-162.2	-178.8	-155.8	2.3	120.9
26	Y	40.7	Very low	39.7	Very low	211 Å²	211	132.9 Å²	132.9	83%	0.827	68%	0.675	S	S	*	*	S	Bend	trans	-143.9	137.3	153.3	-74.5	-78.1	0	0	0	110.6	G24 I28	G24-Y26 PolarHBondContact O-N 2.82Å; G24-Y26 VanDerWaalsContact O-N 3.11Å; Y26-I28 PolarHBondContact O-N 2.77Å
27	L	38.4	Very low	40.7	Very low	185 Å²	185	131.2 Å²	131.2	97%	0.969	67%	0.666	S	S	*	*			trans	-51.9	95.1	-175.8	-78.5	153.7	0	0	0	112.2
28	I	40	Very low	42.5	Very low	150 Å²	150	126.4 Å²	126.4	77%	0.769	65%	0.645	S	S	*	*			trans	-142.8	129.7	171.6	-54.6	179.8	0	0	0	109.6	Y26	Y26-I28 PolarHBondContact O-N 2.77Å
29	S	39.1	Very low	45.2	Very low	96 Å²	96	121.1 Å²	121.1	67%	0.671	63%	0.627	S	S	*	*			trans	-6.5	117.7	169.3	-175.8	0	0	0	0	117	T31	S29-T31 PolarHBondContact O-N 3.26Å; S29-T31 VanDerWaalsContact O-N 3.13Å
30	I	42.2	Very low	47.9	Very low	123 Å²	123	112.3 Å²	112.3	63%	0.631	59%	0.589	S	S	*	*			trans	-72	100.6	167	-56.6	175.2	0	0	0	107.5	C32	I30-C32 PolarHBondContact O-N 2.88Å
31	T	39.3	Very low	50.5	Low	111 Å²	111	115.9 Å²	115.9	68%	0.681	60%	0.597	S	S	*	*			trans	-84.6	86.2	167.7	48.9	0	0	0	0	109.2	S29 K33	S29-T31 PolarHBondContact O-N 3.26Å; S29-T31 VanDerWaalsContact O-N 3.13Å; T31-K33 PolarHBondContact O-N 2.8Å; T31-K33 VanDerWaalsContact O-N 3.15Å
32	C	39.3	Very low	53.2	Low	53 Å²	53	109.9 Å²	109.9	36%	0.358	57%	0.566	S	S	.	*			trans	-66.6	106.3	161.3	-84.8	0	0	0	0	108	Y18 C20 I30 L34	Y18-C32 HydrophobicContact CD1-CB 3.7Å; Y18-C32 HydrophobicContact CE1-CB 4.21Å; C20-C32 PolarHBondContact SG-SG 2.93Å; I30-C32 PolarHBondContact O-N 2.88Å; C32-L34 PolarHBondContact O-N 2.83Å
33	K	37.3	Very low	55.6	Low	179 Å²	179	106.2 Å²	106.2	78%	0.778	56%	0.557	S	S	*	*			trans	-70.6	126.6	162.1	-74.3	-175.1	177.2	-175.5	0	107	T31 L35	T31-K33 PolarHBondContact O-N 2.8Å; T31-K33 VanDerWaalsContact O-N 3.15Å; K33-L35 PolarHBondContact O-N 3.48Å
34	L	40.3	Very low	58	Low	137 Å²	137	104 Å²	104	72%	0.717	54%	0.536	S	S	*	.			trans	-48.5	134.8	164.5	-108.8	87.3	0	0	0	107.1	C32 Q36	C32-L34 PolarHBondContact O-N 2.83Å; L34-Q36 PolarHBondContact O-N 3.48Å
35	L	45.1	Very low	60.5	Low	97 Å²	97	105.3 Å²	105.3	51%	0.508	53%	0.532	S	S	.	.			trans	-60.3	92.4	159.6	-125	88.9	0	0	0	105.3	E17 K33 G37 I38	E17-L35 WeakPolarHBondContact O-CD1 3.43Å; K33-L35 PolarHBondContact O-N 3.48Å; L35-G37 PolarHBondContact O-N 2.89Å; L35-I38 HydrophobicContact CG-CD1 4.47Å
36	Q	48.8	Very low	62.8	Low	136 Å²	136	94.9 Å²	94.9	64%	0.636	50%	0.495	S	S	*	.			trans	-48.6	126.8	159.6	-69.7	178.2	-27.8	0	0	104.2	L34 I38	L34-Q36 PolarHBondContact O-N 3.48Å; Q36-I38 VanDerWaalsContact C-N 3.32Å; Q36-I38 WeakPolarHBondContact O-CG1 3.24Å; Q36-I38 PolarHBondContact O-N 3Å
37	G	54.3	Low	64.6	Low	20 Å²	20	91.9 Å²	91.9	21%	0.206	48%	0.482	C	S	.	.			trans	-53.5	99.9	-176	0	0	0	0	0	109.1	L35 C39	L35-G37 PolarHBondContact O-N 2.89Å; G37-C39 PolarHBondContact O-N 3.17Å; G37-C39 VanDerWaalsContact O-N 3.14Å
38	I	77	Confident	66.1	Low	56 Å²	56	85.5 Å²	85.5	29%	0.287	45%	0.449	S	S	.	.			trans	-82.9	105.2	-168.2	-47.2	-176.2	0	0	0	104.9	L35 Q36 R41 Q183 T276	L35-I38 HydrophobicContact CG-CD1 4.47Å; Q36-I38 VanDerWaalsContact C-N 3.32Å; Q36-I38 WeakPolarHBondContact O-CG1 3.24Å; Q36-I38 PolarHBondContact O-N 3Å; I38-R41 HydrophobicContact CB-CG 4.4Å; I38-R41 VanDerWaalsContact CD1-NH1 3.35Å; I38-R41 HydrophobicContact CG2-CG 3.88Å; I38-Q183 PolarHBondContact O-NE2 3.35Å; I38-T276 HydrophobicContact CG2-CG2 4.38Å
39	C	92.9	Very high	66.9	Low	20 Å²	20	81 Å²	81	14%	0.135	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	154.4	174.6	59.3	0	0	0	0	111.6	G37 R41 H92 G184 C186	G37-C39 PolarHBondContact O-N 3.17Å; G37-C39 VanDerWaalsContact O-N 3.14Å; C39-R41 PolarHBondContact O-N 3.5Å; C39-R41 VanDerWaalsContact O-N 3.08Å; C39-H92 HydrophobicContact CB-CB 3.37Å; C39-G184 VanDerWaalsContact CA-O 3.29Å; C39-G184 WeakPolarHBondContact CA-O 3.46Å; C39-G184 WeakPolarHBondContact CB-O 3.26Å; C39-C186 HydrophobicContact CB-CB 4Å; C39-C186 WeakPolarHBondContact CB-SG 3.46Å; C39-C186 PolarHBondContact O-SG 3.28Å; C39-C186 WeakPolarHBondContact SG-CA 3.09Å; C39-C186 WeakPolarHBondContact SG-CB 3.44Å; C39-C186 CovalentContact SG-SG 2.04Å; C39-C186 PolarHBondContact SG-SG 3.22Å
40	G	93.5	Very high	67.3	Low	1 Å²	1	85.5 Å²	85.5	1%	0.01	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	63	19.8	170.3	0	0	0	0	0	115.6	G184 F277	G40-G184 PolarHBondContact N-O 3.02Å; G40-F277 WeakPolarHBondContact CA-O 3.36Å; G40-F277 PolarHBondContact O-N 3.15Å
41	R	93.6	Very high	67.5	Low	114 Å²	114	89.5 Å²	89.5	43%	0.43	45%	0.45	S	S	.	.			trans	-120.8	85.6	175.2	-67.2	-163.2	176.8	157.5	4.8	110	I38 C39 Q183 G275 T276	I38-R41 HydrophobicContact CB-CG 4.4Å; I38-R41 VanDerWaalsContact CD1-NH1 3.35Å; I38-R41 HydrophobicContact CG2-CG 3.88Å; C39-R41 PolarHBondContact O-N 3.5Å; C39-R41 VanDerWaalsContact O-N 3.08Å; R41-Q183 VanDerWaalsContact C-OE1 3.3Å; R41-Q183 PolarHBondContact O-NE2 3.44Å; R41-Q183 VanDerWaalsContact O-NE2 3.16Å; R41-Q183 PolarHBondContact O-OE1 3.22Å; R41-G275 PolarHBondContact NE-O 3.24Å; R41-T276 HydrophobicContact CG-CG2 3.81Å; R41-T276 VanDerWaalsContact NE-CG2 3.27Å
42	P	93.5	Very high	67.5	Low	26 Å²	26	91.5 Å²	91.5	17%	0.169	46%	0.457	C	S	.	.			trans	-67.8	144.6	-179.7	31.5	-35.2	0	0	0	110.4	F44 S68 P70 W71	P42-F44 VanDerWaalsContact C-N 3.33Å; P42-F44 WeakPolarHBondContact CB-O 3.44Å; P42-S68 WeakPolarHBondContact CB-O 3.26Å; P42-P70 HydrophobicContact CB-CG 3.88Å; P42-W71 HydrophobicContact CB-CZ3 4.35Å; P42-W71 HydrophobicContact CG-CH2 4.2Å; P42-W71 HydrophobicContact CG-CZ3 4.3Å
43	V	92.8	Very high	67.4	Low	90 Å²	90	97.1 Å²	97.1	55%	0.545	48%	0.478	S	S	.	.	S	Bend	trans	-66.8	-40.5	173.2	175.2	0	0	0	0	110.2	D180	V43-D180 HydrophobicContact CB-CB 4.43Å; V43-D180 HydrophobicContact CG2-CB 4.23Å
44	F	92.7	Very high	67.6	Low	69 Å²	69	91.9 Å²	91.9	30%	0.303	47%	0.468	S	S	.	.	S	Bend	trans	-91.6	118.3	176.3	-54	-80.5	0	0	0	109.5	P42 Y67 S68 D180 Y181	P42-F44 VanDerWaalsContact C-N 3.33Å; P42-F44 WeakPolarHBondContact CB-O 3.44Å; F44-Y67 HydrophobicContact CE2-CD2 4.33Å; F44-S68 VanDerWaalsContact O-CA 3.29Å; F44-S68 WeakPolarHBondContact O-CA 3.37Å; F44-D180 HydrophobicContact CE2-CB 4.02Å; F44-D180 WeakPolarHBondContact CE2-O 3.13Å; F44-Y181 AromaticContact CE2-CD1 3.84Å; F44-Y181 HydrophobicContact CE2-CD1 3.84Å; F44-Y181 AromaticContact CE2-CE1 3.76Å; F44-Y181 HydrophobicContact CE2-CE1 3.76Å; F44-Y181 HydrophobicContact CZ-CD1 4.45Å; F44-Y181 AromaticContact CZ-CE1 3.92Å; F44-Y181 HydrophobicContact CZ-CE1 3.92Å
45	P	88.8	Confident	67.3	Low	97 Å²	97	88.2 Å²	88.2	63%	0.63	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-73.3	143.3	-178.8	28.7	-33.8	0	0	0	111.5
46	P	88.4	Confident	66.7	Low	22 Å²	22	88.8 Å²	88.8	14%	0.143	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-64.7	159.8	172.9	-19.4	30.8	0	0	0	113.5	L48 Y69 F277	P46-L48 HydrophobicContact CB-CD2 4.19Å; P46-L48 HydrophobicContact CB-CG 4.15Å; P46-L48 PolarHBondContact O-N 3.22Å; P46-Y69 HydrophobicContact CB-CE1 4.3Å; P46-Y69 HydrophobicContact CB-CE2 4.23Å; P46-Y69 WeakPolarHBondContact CB-OH 3.47Å; P46-Y69 HydrophobicContact CG-CE1 4.05Å; P46-F277 HydrophobicContact CG-CE2 4.08Å; P46-F277 HydrophobicContact CG-CZ 3.97Å
47	R	80	Confident	65.9	Low	147 Å²	147	88.9 Å²	88.9	56%	0.555	46%	0.461	S	S	*	.			trans	-86.7	54.6	176.4	-65.4	-179.7	177.1	158	-2.6	110.5	P49 E63 A65 E228	R47-P49 VanDerWaalsContact O-CD 3.23Å; R47-P49 WeakPolarHBondContact O-CD 3.3Å; R47-E63 PolarHBondContact NH1-O 3.26Å; R47-E63 VanDerWaalsContact NH1-O 3.14Å; R47-A65 HydrophobicContact CG-CB 3.82Å; R47-E228 PolarHBondContact N-OE1 3.32Å; R47-E228 VanDerWaalsContact O-OE1 3.11Å
48	L	69.2	Low	65.4	Low	51 Å²	51	88.2 Å²	88.2	27%	0.267	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-56	116.3	177.6	-59.3	174.1	0	0	0	108.8	P46 K50 I200 V202	P46-L48 HydrophobicContact CB-CD2 4.19Å; P46-L48 HydrophobicContact CB-CG 4.15Å; P46-L48 PolarHBondContact O-N 3.22Å; L48-K50 PolarHBondContact O-N 3.21Å; L48-K50 VanDerWaalsContact O-N 3.16Å; L48-I200 HydrophobicContact CD1-CD1 3.85Å; L48-I200 HydrophobicContact CD1-CG2 3.94Å; L48-I200 HydrophobicContact CD2-CG2 3.54Å; L48-I200 HydrophobicContact CG-CG2 4.3Å; L48-V202 HydrophobicContact CD2-CG2 3.79Å
49	P	55.7	Low	64	Low	57 Å²	57	86.2 Å²	86.2	37%	0.37	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-60.2	127.4	180	5.6	-6	0	0	0	108.3	R47 K51	R47-P49 VanDerWaalsContact O-CD 3.23Å; R47-P49 WeakPolarHBondContact O-CD 3.3Å; P49-K51 PolarHBondContact O-N 3.44Å
50	K	49.4	Very low	62.1	Low	189 Å²	189	87.8 Å²	87.8	82%	0.822	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-59.3	134.3	150.9	-66.7	179.6	-176.5	174.4	0	104.4	L48 D52 E53	L48-K50 PolarHBondContact O-N 3.21Å; L48-K50 VanDerWaalsContact O-N 3.16Å; K50-D52 PolarHBondContact O-N 3.31Å; K50-E53 PolarHBondContact O-N 3.1Å
51	K	45.7	Very low	60.5	Low	207 Å²	207	88 Å²	88	90%	0.9	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	1.2	-165.1	-148.3	175.5	178.7	179.2	0	118.3	P49	P49-K51 PolarHBondContact O-N 3.44Å
52	D	38.9	Very low	59.9	Low	153 Å²	153	84.2 Å²	84.2	82%	0.818	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	5.5	-172.5	-61.2	-38	0	0	0	115.9	K50	K50-D52 PolarHBondContact O-N 3.31Å
53	E	37.5	Very low	59.5	Low	172 Å²	172	86.3 Å²	86.3	80%	0.804	45%	0.453	S	S	*	.			trans	-132.2	65	-179.8	-66.8	-175.4	-175.9	0	0	113.1	K50	K50-E53 PolarHBondContact O-N 3.1Å
54	A	41.1	Very low	59.4	Low	69 Å²	69	82 Å²	82	57%	0.57	43%	0.427	S	S	*	.			trans	-97.5	109.5	172.2	0	0	0	0	0	110.5
55	G	33.8	Very low	59.3	Low	60 Å²	60	79.3 Å²	79.3	62%	0.619	42%	0.418	S	S	*	.			trans	-135	106.8	175	0	0	0	0	0	111.6
56	N	32.3	Very low	59.4	Low	108 Å²	108	79.3 Å²	79.3	58%	0.578	41%	0.411	S	S	*	.	S	Bend	trans	70	113.1	151.1	-100.2	-28.7	0	0	0	122.7	G61	N56-G61 CarbonylContact C-O 3.4Å; N56-G61 VanDerWaalsContact O-O 3.08Å
57	R	33	Very low	59.6	Low	138 Å²	138	79.7 Å²	79.7	52%	0.521	41%	0.41	S	S	.	.	S	Bend	trans	73.8	122.4	151.4	-53.9	175.6	-168	175.4	2.1	115.9	G61 A62 Q227	R57-G61 VanDerWaalsContact C-C 3.45Å; R57-G61 CarbonylContact C-O 3.47Å; R57-G61 PolarHBondContact N-O 2.83Å; R57-G61 CarbonylContact O-C 3.45Å; R57-A62 PolarHBondContact O-N 2.94Å; R57-Q227 PolarHBondContact O-OE1 2.86Å
58	I	44.4	Very low	60.3	Low	6 Å²	6	72.8 Å²	72.8	3%	0.031	38%	0.383	C	S	.	.	S	Bend	cis	-52.2	105.8	7.6	-55.9	-131.5	0	0	0	115.6	N60 G61 L209 Q227 G259 R261	I58-N60 CarbonylContact O-C 3.57Å; I58-N60 PolarHBondContact O-N 3Å; I58-G61 PolarHBondContact O-N 2.97Å; I58-L209 HydrophobicContact CG1-CD2 4.19Å; I58-Q227 HydrophobicContact CD1-CB 3.69Å; I58-Q227 HydrophobicContact CD1-CG 4.14Å; I58-Q227 HydrophobicContact CG1-CB 3.23Å; I58-Q227 HydrophobicContact CG1-CG 3.69Å; I58-G259 WeakPolarHBondContact CG2-O 3.33Å; I58-R261 HydrophobicContact CG2-CG 4.39Å
59	S	46.3	Very low	61.6	Low	14 Å²	14	70.6 Å²	70.6	10%	0.098	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	21.1	62	-174	75.1	0	0	0	0	113.6	L209 D257 T258 R261	S59-L209 PolarHBondContact N-O 3.33Å; S59-D257 WeakPolarHBondContact CB-O 3.25Å; S59-D257 PolarHBondContact OG-O 2.89Å; S59-T258 VanDerWaalsContact O-CA 3.23Å; S59-T258 WeakPolarHBondContact O-CA 3.28Å; S59-T258 WeakPolarHBondContact O-CB 3.34Å; S59-T258 VanDerWaalsContact O-CG2 3.31Å; S59-T258 WeakPolarHBondContact O-CG2 3.33Å; S59-T258 PolarHBondContact O-OG1 2.8Å; S59-T258 WeakPolarHBondContact OG-CA 3.28Å; S59-R261 PolarHBondContact OG-NH2 3.26Å; S59-R261 VanDerWaalsContact OG-NH2 3.08Å
60	N	53.2	Low	63.6	Low	54 Å²	54	68 Å²	68	29%	0.289	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	7.8	-167.7	-51.9	-31.6	0	0	0	120.8	I58 E255 T258	I58-N60 CarbonylContact O-C 3.57Å; I58-N60 PolarHBondContact O-N 3Å; N60-E255 WeakPolarHBondContact CB-OE2 3.48Å; N60-E255 PolarHBondContact ND2-OE2 2.73Å; N60-T258 HydrophobicContact CB-CG2 3.91Å; N60-T258 PolarHBondContact ND2-OG1 3.42Å
61	G	61.2	Low	65.9	Low	4 Å²	4	59 Å²	59	4%	0.041	32%	0.316	C	S	.	.			trans	-76.7	-171	165.3	0	0	0	0	0	112.2	N56 R57 I58 E228	N56-G61 CarbonylContact C-O 3.4Å; N56-G61 VanDerWaalsContact O-O 3.08Å; R57-G61 VanDerWaalsContact C-C 3.45Å; R57-G61 CarbonylContact C-O 3.47Å; R57-G61 PolarHBondContact N-O 2.83Å; R57-G61 CarbonylContact O-C 3.45Å; I58-G61 PolarHBondContact O-N 2.97Å; G61-E228 CarbonylContact C-O 3.56Å; G61-E228 WeakPolarHBondContact CA-O 3.39Å
62	A	79.5	Confident	68.4	Low	35 Å²	35	49.4 Å²	49.4	29%	0.289	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	157.1	173.1	0	0	0	0	0	111.5	R57 A64 Q227 E228	R57-A62 PolarHBondContact O-N 2.94Å; A62-A64 PolarHBondContact O-N 2.9Å; A62-Q227 WeakPolarHBondContact O-CA 3.42Å; A62-E228 PolarHBondContact N-O 2.8Å; A62-E228 PolarHBondContact O-N 2.88Å
63	E	86	Confident	71.2	Confident	70 Å²	70	42.1 Å²	42.1	33%	0.327	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	122.1	169.5	-174.4	-174.5	143.6	0	0	109	R47 H136 K225	R47-E63 PolarHBondContact NH1-O 3.26Å; R47-E63 VanDerWaalsContact NH1-O 3.14Å; E63-H136 IonicContact OE1-NE2 3.83Å; E63-H136 PolarHBondContact OE1-NE2 2.81Å; E63-K225 HydrophobicContact CG-CB 4.17Å; E63-K225 HydrophobicContact CG-CD 4.15Å; E63-K225 VanDerWaalsContact OE1-CD 3.25Å; E63-K225 WeakPolarHBondContact OE1-CD 3.37Å; E63-K225 IonicContact OE1-NZ 3.31Å; E63-K225 PolarHBondContact OE1-NZ 2.9Å; E63-K225 WeakPolarHBondContact OE2-CD 3.46Å; E63-K225 IonicContact OE2-NZ 3.21Å; E63-K225 PolarHBondContact OE2-NZ 2.93Å
64	A	89.9	Confident	74	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-58.8	150	179.8	0	0	0	0	0	110.7	A62 M66 Y69 H136 L226 E228	A62-A64 PolarHBondContact O-N 2.9Å; A64-M66 PolarHBondContact O-N 3.16Å; A64-Y69 HydrophobicContact CB-CD2 4.04Å; A64-Y69 HydrophobicContact CB-CE2 3.89Å; A64-H136 PolarHBondContact O-CE1 3.22Å; A64-H136 VanDerWaalsContact O-CE1 3.25Å; A64-L226 HydrophobicContact CB-CB 4.31Å; A64-L226 HydrophobicContact CB-CD2 4.2Å; A64-L226 HydrophobicContact CB-CG 4.08Å; A64-L226 WeakPolarHBondContact CB-O 3.33Å; A64-L226 PolarHBondContact N-O 2.8Å; A64-E228 VanDerWaalsContact CA-OE2 3.3Å; A64-E228 WeakPolarHBondContact CA-OE2 3.23Å; A64-E228 HydrophobicContact CB-CB 4.22Å; A64-E228 HydrophobicContact CB-CG 4.2Å
65	A	91.6	Very high	76.7	Confident	13 Å²	13	31.1 Å²	31.1	11%	0.107	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-58.9	135.3	164.3	0	0	0	0	0	108.9	R47 Y67 S68	R47-A65 HydrophobicContact CG-CB 3.82Å; A65-Y67 PolarHBondContact O-N 2.92Å; A65-Y67 VanDerWaalsContact O-N 3.15Å; A65-S68 WeakPolarHBondContact O-CB 3.48Å; A65-S68 PolarHBondContact O-N 2.88Å; A65-S68 PolarHBondContact O-OG 2.84Å
66	M	91.4	Very high	79.6	Confident	96 Å²	96	29.7 Å²	29.7	47%	0.473	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	127.1	179.8	-157.1	-177.5	-171.7	0	0	109.7	A64 S68 H136	A64-M66 PolarHBondContact O-N 3.16Å; M66-S68 PolarHBondContact O-N 3.12Å; M66-H136 HydrophobicContact CE-CB 4.37Å; M66-H136 HydrophobicContact CG-CB 3.98Å
67	Y	92.2	Very high	82.5	Confident	31 Å²	31	24.7 Å²	24.7	12%	0.122	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	16.3	-179.9	-42.8	-65.4	0	0	0	116	F44 A65 Y69 E144 Y181	F44-Y67 HydrophobicContact CE2-CD2 4.33Å; A65-Y67 PolarHBondContact O-N 2.92Å; A65-Y67 VanDerWaalsContact O-N 3.15Å; Y67-Y69 PolarHBondContact O-N 2.84Å; Y67-E144 HydrophobicContact CE1-CB 4.09Å; Y67-E144 HydrophobicContact CE1-CG 4.28Å; Y67-E144 PolarHBondContact OH-OE2 2.94Å; Y67-E144 VanDerWaalsContact OH-OE2 3.06Å; Y67-Y181 AromaticContact CD1-CD1 3.8Å; Y67-Y181 HydrophobicContact CD1-CD1 3.8Å; Y67-Y181 HydrophobicContact CD1-CG 4.32Å; Y67-Y181 AromaticContact CD2-CD1 3.61Å; Y67-Y181 HydrophobicContact CD2-CD1 3.61Å; Y67-Y181 AromaticContact CD2-CE1 3.87Å; Y67-Y181 HydrophobicContact CD2-CE1 3.87Å; Y67-Y181 HydrophobicContact CE1-CD1 4.07Å; Y67-Y181 HydrophobicContact CE1-CG 4.5Å; Y67-Y181 AromaticContact CE2-CD1 3.9Å; Y67-Y181 HydrophobicContact CE2-CD1 3.9Å; Y67-Y181 AromaticContact CE2-CE1 3.93Å; Y67-Y181 HydrophobicContact CE2-CE1 3.93Å; Y67-Y181 AromaticContact CG-CD1 3.54Å; Y67-Y181 HydrophobicContact CG-CD1 3.54Å; Y67-Y181 HydrophobicContact CG-CE1 4.28Å; Y67-Y181 HydrophobicContact CG-CG 4.45Å
68	S	94.6	Very high	85.2	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.007	12%	0.123	C	C	.	.	S	Bend	trans	-73.6	-13.1	179	63.3	0	0	0	0	114.9	P42 F44 A65 M66 P70	P42-S68 WeakPolarHBondContact CB-O 3.26Å; F44-S68 VanDerWaalsContact O-CA 3.29Å; F44-S68 WeakPolarHBondContact O-CA 3.37Å; A65-S68 WeakPolarHBondContact O-CB 3.48Å; A65-S68 PolarHBondContact O-N 2.88Å; A65-S68 PolarHBondContact O-OG 2.84Å; M66-S68 PolarHBondContact O-N 3.12Å; S68-P70 VanDerWaalsContact C-CD 3.46Å; S68-P70 WeakPolarHBondContact O-CD 3.44Å
69	Y	96.4	Very high	86.9	Confident	6 Å²	6	25 Å²	25	2%	0.024	13%	0.128	C	C	.	.			trans	-125.4	68.8	177.4	-57.6	-82.8	0	0	0	110.5	P46 A64 Y67 W71 Q72 V202 T204 L226 E228	P46-Y69 HydrophobicContact CB-CE1 4.3Å; P46-Y69 HydrophobicContact CB-CE2 4.23Å; P46-Y69 WeakPolarHBondContact CB-OH 3.47Å; P46-Y69 HydrophobicContact CG-CE1 4.05Å; A64-Y69 HydrophobicContact CB-CD2 4.04Å; A64-Y69 HydrophobicContact CB-CE2 3.89Å; Y67-Y69 PolarHBondContact O-N 2.84Å; Y69-W71 HydrophobicContact CD1-CH2 4.44Å; Y69-W71 AromaticContact CD1-CZ2 3.6Å; Y69-W71 HydrophobicContact CD1-CZ2 3.6Å; Y69-W71 HydrophobicContact CE1-CZ2 4.38Å; Y69-W71 HydrophobicContact CG-CZ2 4.5Å; Y69-W71 PolarHBondContact O-N 2.78Å; Y69-Q72 VanDerWaalsContact O-CB 3.28Å; Y69-Q72 WeakPolarHBondContact O-CB 3.45Å; Y69-Q72 PolarHBondContact O-N 3.47Å; Y69-V202 HydrophobicContact CE1-CB 4.3Å; Y69-V202 HydrophobicContact CE1-CG1 4.01Å; Y69-V202 WeakPolarHBondContact OH-CG1 3.41Å; Y69-T204 HydrophobicContact CD1-CG2 3.83Å; Y69-T204 HydrophobicContact CD2-CG2 3.66Å; Y69-T204 HydrophobicContact CE1-CG2 3.8Å; Y69-T204 HydrophobicContact CE2-CG2 3.6Å; Y69-T204 HydrophobicContact CG-CG2 3.76Å; Y69-L226 HydrophobicContact CD2-CD2 4.16Å; Y69-E228 HydrophobicContact CE2-CB 3.8Å; Y69-E228 HydrophobicContact CE2-CG 4.43Å; Y69-E228 WeakPolarHBondContact CE2-OE2 3.03Å; Y69-E228 WeakPolarHBondContact OH-CB 3.27Å; Y69-E228 PolarHBondContact OH-OE2 2.92Å
70	P	96.9	Very high	88.4	Confident	3 Å²	3	29.4 Å²	29.4	2%	0.019	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-5.8	-172.5	30.5	-39	0	0	0	114.2	P42 S68 Y181 I182 Q183	P42-P70 HydrophobicContact CB-CG 3.88Å; S68-P70 VanDerWaalsContact C-CD 3.46Å; S68-P70 WeakPolarHBondContact O-CD 3.44Å; P70-Y181 WeakPolarHBondContact CA-O 3.4Å; P70-Y181 VanDerWaalsContact CB-O 3.24Å; P70-Y181 WeakPolarHBondContact CB-O 3.44Å; P70-I182 WeakPolarHBondContact O-CA 3.47Å; P70-Q183 CarbonylContact C-O 3.56Å; P70-Q183 HydrophobicContact CB-CB 3.94Å; P70-Q183 HydrophobicContact CG-CB 3.84Å; P70-Q183 PolarHBondContact O-N 3.1Å
71	W	98	Very high	89.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.2	171.5	50.9	80.5	0	0	0	113.7	P42 Y69 A73 F90 Q183 I185 A270 F277	P42-W71 HydrophobicContact CB-CZ3 4.35Å; P42-W71 HydrophobicContact CG-CH2 4.2Å; P42-W71 HydrophobicContact CG-CZ3 4.3Å; Y69-W71 HydrophobicContact CD1-CH2 4.44Å; Y69-W71 AromaticContact CD1-CZ2 3.6Å; Y69-W71 HydrophobicContact CD1-CZ2 3.6Å; Y69-W71 HydrophobicContact CE1-CZ2 4.38Å; Y69-W71 HydrophobicContact CG-CZ2 4.5Å; Y69-W71 PolarHBondContact O-N 2.78Å; W71-A73 PolarHBondContact O-N 2.86Å; W71-F90 PolarHBondContact O-N 2.95Å; W71-Q183 WeakPolarHBondContact CA-O 3.32Å; W71-Q183 VanDerWaalsContact CB-O 3.29Å; W71-Q183 WeakPolarHBondContact CB-O 3.17Å; W71-Q183 PolarHBondContact N-O 2.95Å; W71-I185 HydrophobicContact CB-CB 3.75Å; W71-I185 HydrophobicContact CB-CG2 4.18Å; W71-I185 HydrophobicContact CD2-CB 3.85Å; W71-I185 HydrophobicContact CD2-CD1 4.13Å; W71-I185 HydrophobicContact CD2-CG1 4.17Å; W71-I185 HydrophobicContact CE3-CB 4.23Å; W71-I185 HydrophobicContact CG-CB 3.64Å; W71-I185 HydrophobicContact CG-CD1 4.23Å; W71-I185 HydrophobicContact CG-CG1 4.33Å; W71-I185 HydrophobicContact CG-CG2 4.33Å; W71-I185 HydrophobicContact CZ2-CD1 4.34Å; W71-A270 HydrophobicContact CZ2-CB 4.2Å; W71-F277 HydrophobicContact CH2-CB 3.46Å; W71-F277 VanDerWaalsContact CH2-CB 3.46Å; W71-F277 HydrophobicContact CH2-CD1 4.37Å; W71-F277 AromaticContact CH2-CD2 3.54Å; W71-F277 HydrophobicContact CH2-CD2 3.54Å; W71-F277 HydrophobicContact CH2-CE2 4.35Å; W71-F277 AromaticContact CH2-CG 3.54Å; W71-F277 HydrophobicContact CH2-CG 3.54Å; W71-F277 HydrophobicContact CZ2-CB 3.72Å; W71-F277 HydrophobicContact CZ2-CD1 4.21Å; W71-F277 HydrophobicContact CZ2-CD2 4.17Å; W71-F277 AromaticContact CZ2-CG 3.78Å; W71-F277 HydrophobicContact CZ2-CG 3.78Å; W71-F277 HydrophobicContact CZ3-CB 4.17Å
72	Q	97.8	Very high	90.4	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.019	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	124.1	179.5	-178.9	67.8	50.8	0	0	109	Y69 G88 T204 W206 L226 P268	Y69-Q72 VanDerWaalsContact O-CB 3.28Å; Y69-Q72 WeakPolarHBondContact O-CB 3.45Å; Y69-Q72 PolarHBondContact O-N 3.47Å; Q72-G88 PolarHBondContact NE2-O 2.9Å; Q72-T204 PolarHBondContact OE1-O 3.2Å; Q72-T204 PolarHBondContact OE1-OG1 3.3Å; Q72-W206 HydrophobicContact CB-CH2 4.43Å; Q72-W206 HydrophobicContact CG-CH2 3.32Å; Q72-W206 HydrophobicContact CG-CZ2 4.15Å; Q72-W206 HydrophobicContact CG-CZ3 3.53Å; Q72-L226 HydrophobicContact CB-CD2 4.29Å; Q72-L226 HydrophobicContact CG-CD1 3.78Å; Q72-L226 HydrophobicContact CG-CD2 4.21Å; Q72-P268 VanDerWaalsContact OE1-CD 3.24Å
73	A	98.2	Very high	90.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	143.6	173.8	0	0	0	0	0	109.8	W71 G87 G88 V102 V131 L133	W71-A73 PolarHBondContact O-N 2.86Å; A73-G87 CarbonylContact O-C 3.19Å; A73-G88 PolarHBondContact N-O 2.78Å; A73-G88 PolarHBondContact O-N 3.25Å; A73-V102 HydrophobicContact CB-CG1 3.94Å; A73-V102 HydrophobicContact CB-CG2 4.43Å; A73-V131 HydrophobicContact CB-CG1 4.13Å; A73-L133 HydrophobicContact CB-CD2 3.61Å
74	L	96.8	Very high	90.8	Very high	10 Å²	10	43 Å²	43	5%	0.052	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.3	163.9	176.7	68	0	0	0	107.9	I76 R85 V131 V132 I138 W206	L74-I76 HydrophobicContact CD2-CD1 3.86Å; L74-I76 HydrophobicContact CD2-CG1 4.02Å; L74-I76 HydrophobicContact CG-CD1 4.25Å; L74-I76 HydrophobicContact CG-CG1 3.88Å; L74-R85 HydrophobicContact CD1-CB 4.15Å; L74-R85 HydrophobicContact CD1-CG 4.46Å; L74-V131 CarbonylContact O-C 3.46Å; L74-V131 WeakPolarHBondContact O-CA 3.35Å; L74-V132 HydrophobicContact CB-CB 4.18Å; L74-V132 HydrophobicContact CD2-CB 4.49Å; L74-V132 HydrophobicContact CD2-CG2 4.39Å; L74-V132 PolarHBondContact N-O 3.14Å; L74-V132 PolarHBondContact O-N 3.39Å; L74-I138 HydrophobicContact CD2-CB 4.44Å; L74-I138 HydrophobicContact CD2-CG2 3.9Å; L74-W206 HydrophobicContact CB-CE3 4.4Å; L74-W206 HydrophobicContact CB-CH2 4.1Å; L74-W206 HydrophobicContact CB-CZ3 3.78Å; L74-W206 HydrophobicContact CD1-CE3 4.02Å; L74-W206 HydrophobicContact CD1-CZ3 4.24Å
75	V	97.2	Very high	90.8	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119	175.5	-177.1	0	0	0	0	108.3	C86 V102 T104 V109 L170	V75-C86 HydrophobicContact CB-CB 4.26Å; V75-C86 PolarHBondContact N-O 3.21Å; V75-C86 PolarHBondContact O-N 3.32Å; V75-V102 HydrophobicContact CG2-CG1 4.39Å; V75-T104 HydrophobicContact CG2-CG2 4.37Å; V75-V109 HydrophobicContact CG1-CG1 4.3Å; V75-L170 HydrophobicContact CG1-CD1 4.07Å; V75-L170 HydrophobicContact CG2-CD1 4.19Å
76	I	95	Very high	90.9	Very high	30 Å²	30	47.8 Å²	47.8	15%	0.154	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	121.7	-178.9	-55.1	173.1	0	0	0	108.3	L74 Y83 R84 L129 R130 V132	L74-I76 HydrophobicContact CD2-CD1 3.86Å; L74-I76 HydrophobicContact CD2-CG1 4.02Å; L74-I76 HydrophobicContact CG-CD1 4.25Å; L74-I76 HydrophobicContact CG-CG1 3.88Å; I76-Y83 HydrophobicContact CG2-CD1 3.75Å; I76-Y83 HydrophobicContact CG2-CG 4.37Å; I76-R84 WeakPolarHBondContact CA-O 3.31Å; I76-L129 WeakPolarHBondContact O-CA 3.43Å; I76-R130 HydrophobicContact CB-CB 4.37Å; I76-R130 PolarHBondContact N-O 3.01Å; I76-R130 PolarHBondContact O-N 3.37Å; I76-V132 HydrophobicContact CD1-CG2 4.06Å
77	T	93.4	Very high	91.1	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.7	172.1	-52.6	0	0	0	0	108.5	G79 R84 C108 A124 L129	T77-G79 PolarHBondContact O-N 2.86Å; T77-R84 PolarHBondContact N-O 2.83Å; T77-R84 PolarHBondContact O-N 3.33Å; T77-C108 PolarHBondContact OG1-O 3.15Å; T77-A124 HydrophobicContact CG2-CB 3.61Å; T77-L129 HydrophobicContact CG2-CD2 4.01Å; T77-L129 WeakPolarHBondContact OG1-CD2 3.22Å
78	R	90.3	Very high	91.4	Very high	138 Å²	138	41.8 Å²	41.8	52%	0.521	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.6	175.5	-176	178.4	-177.6	149.8	2.4	110.1	Y83 D128	R78-Y83 HydrophobicContact CB-CD1 4.08Å; R78-Y83 HydrophobicContact CB-CE1 3.93Å; R78-Y83 HydrophobicContact CG-CD1 4.24Å; R78-Y83 HydrophobicContact CG-CE1 3.76Å; R78-D128 HydrophobicContact CB-CB 3.96Å; R78-D128 PolarHBondContact N-O 3.22Å
79	G	79.7	Confident	91.6	Very high	12 Å²	12	41.7 Å²	41.7	12%	0.124	21%	0.207	C	C	.	.			trans	-106.8	179.3	168.2	0	0	0	0	0	113.1	T77 A82 N112	T77-G79 PolarHBondContact O-N 2.86Å; G79-A82 VanDerWaalsContact CA-O 3.26Å; G79-A82 WeakPolarHBondContact CA-O 3.38Å; G79-A82 PolarHBondContact N-O 3.14Å; G79-N112 VanDerWaalsContact CA-ND2 3.3Å; G79-N112 WeakPolarHBondContact CA-ND2 3.34Å
80	P	76.9	Confident	91.7	Very high	108 Å²	108	41.4 Å²	41.4	70%	0.701	21%	0.206	S	C	*	.	S	Bend	trans	-60.4	-44.5	177.8	-20.7	31.6	0	0	0	112.2
81	D	77.4	Confident	91.8	Very high	162 Å²	162	41.3 Å²	41.3	87%	0.866	21%	0.205	S	C	*	.	S	Bend	trans	-112.7	-24.4	-171.3	-53.4	-52.1	0	0	0	113.4
82	A	79.3	Confident	91.6	Very high	67 Å²	67	42.8 Å²	42.8	55%	0.554	21%	0.212	S	C	*	.			trans	-149.7	158.5	-174.9	0	0	0	0	0	112.3	G79	G79-A82 VanDerWaalsContact CA-O 3.26Å; G79-A82 WeakPolarHBondContact CA-O 3.38Å; G79-A82 PolarHBondContact N-O 3.14Å
83	Y	86	Confident	91.2	Very high	137 Å²	137	45 Å²	45	54%	0.537	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	129.4	169.6	-63.4	-86.7	0	0	0	109.6	I76 R78	I76-Y83 HydrophobicContact CG2-CD1 3.75Å; I76-Y83 HydrophobicContact CG2-CG 4.37Å; R78-Y83 HydrophobicContact CB-CD1 4.08Å; R78-Y83 HydrophobicContact CB-CE1 3.93Å; R78-Y83 HydrophobicContact CG-CD1 4.24Å; R78-Y83 HydrophobicContact CG-CE1 3.76Å
84	R	87.4	Confident	90.3	Very high	82 Å²	82	52.2 Å²	52.2	31%	0.309	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.3	165.3	-172.5	-175	-61	145.3	5.8	108	I76 T77 H107 L110	I76-R84 WeakPolarHBondContact CA-O 3.31Å; T77-R84 PolarHBondContact N-O 2.83Å; T77-R84 PolarHBondContact O-N 3.33Å; R84-H107 PolarHBondContact NH1-O 2.95Å; R84-L110 PolarHBondContact NH1-O 2.87Å
85	R	90.9	Very high	89.2	Confident	108 Å²	108	59.9 Å²	59.9	41%	0.408	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.9	173.9	-64.7	177.9	-175.9	165.6	-3.8	108.8	L74	L74-R85 HydrophobicContact CD1-CB 4.15Å; L74-R85 HydrophobicContact CD1-CG 4.46Å
86	C	94	Very high	88.3	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	160.2	174.9	-84.4	0	0	0	0	110	V75 C108 S265	V75-C86 HydrophobicContact CB-CB 4.26Å; V75-C86 PolarHBondContact N-O 3.21Å; V75-C86 PolarHBondContact O-N 3.32Å; C86-C108 HydrophobicContact CB-CB 3.58Å; C86-C108 WeakPolarHBondContact CB-SG 3.44Å; C86-C108 WeakPolarHBondContact SG-CB 3.23Å; C86-C108 CovalentContact SG-SG 2.03Å; C86-C108 PolarHBondContact SG-SG 2.85Å; C86-S265 CarbonylContact C-O 3.46Å; C86-S265 WeakPolarHBondContact CB-O 3.43Å
87	G	95.6	Very high	88.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	166.5	164.1	0	0	0	0	0	112.4	A73 T104 G263 S265 G266	A73-G87 CarbonylContact O-C 3.19Å; G87-T104 PolarHBondContact O-OG1 2.94Å; G87-G263 PolarHBondContact N-O 2.88Å; G87-S265 PolarHBondContact N-O 3.4Å; G87-G266 VanDerWaalsContact C-C 3.45Å; G87-G266 CarbonylContact C-O 3.6Å; G87-G266 CarbonylContact O-C 3.6Å; G87-G266 VanDerWaalsContact O-C 3.29Å; G87-G266 WeakPolarHBondContact O-CA 3.24Å
88	G	98.2	Very high	88.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	168.7	171.1	0	0	0	0	0	110	Q72 A73 L103 G266	Q72-G88 PolarHBondContact NE2-O 2.9Å; A73-G88 PolarHBondContact N-O 2.78Å; A73-G88 PolarHBondContact O-N 3.25Å; G88-L103 CarbonylContact C-O 3.59Å; G88-L103 WeakPolarHBondContact CA-O 3.33Å; G88-G266 WeakPolarHBondContact CA-O 3.41Å
89	S	98.6	Very high	88.4	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	114.5	178.6	-54.2	0	0	0	0	109.2	I91 V102 L103 P268 L279	S89-I91 WeakPolarHBondContact O-CG2 3.34Å; S89-I91 PolarHBondContact O-N 3.01Å; S89-V102 CarbonylContact O-C 3.58Å; S89-V102 VanDerWaalsContact O-CA 3.28Å; S89-V102 WeakPolarHBondContact O-CA 3.46Å; S89-L103 PolarHBondContact N-O 2.86Å; S89-L103 PolarHBondContact O-N 3.46Å; S89-P268 WeakPolarHBondContact OG-CB 3.43Å; S89-L279 WeakPolarHBondContact OG-CD1 3.2Å
90	F	98.5	Very high	89.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	112.7	168.4	-174.6	-130.2	0	0	0	108.5	W71 S99 F101 V102 L133 L172 V176 Y178 I182 G184 I185	W71-F90 PolarHBondContact O-N 2.95Å; F90-S99 WeakPolarHBondContact CZ-O 3.28Å; F90-F101 VanDerWaalsContact CD2-O 3.27Å; F90-F101 WeakPolarHBondContact CD2-O 3.5Å; F90-V102 HydrophobicContact CB-CG2 4.39Å; F90-V102 HydrophobicContact CD2-CG2 3.96Å; F90-L133 HydrophobicContact CB-CD2 3.91Å; F90-L133 HydrophobicContact CD1-CD1 4.2Å; F90-L133 HydrophobicContact CD2-CD1 3.95Å; F90-L133 HydrophobicContact CE1-CD1 4.33Å; F90-L133 HydrophobicContact CE2-CD1 4.12Å; F90-L133 HydrophobicContact CG-CD1 4.01Å; F90-L133 HydrophobicContact CG-CD2 4.24Å; F90-L133 HydrophobicContact CZ-CD1 4.31Å; F90-L172 HydrophobicContact CD2-CD1 4.22Å; F90-L172 HydrophobicContact CE2-CD1 3.91Å; F90-V176 HydrophobicContact CE1-CB 4.5Å; F90-V176 HydrophobicContact CZ-CB 3.84Å; F90-V176 HydrophobicContact CZ-CG1 4.38Å; F90-Y178 HydrophobicContact CD1-CE1 4.37Å; F90-Y178 AromaticContact CE1-CD1 3.93Å; F90-Y178 HydrophobicContact CE1-CD1 3.93Å; F90-Y178 AromaticContact CE1-CE1 3.48Å; F90-Y178 HydrophobicContact CE1-CE1 3.48Å; F90-Y178 VanDerWaalsContact CE1-CE1 3.48Å; F90-Y178 HydrophobicContact CZ-CE1 4Å; F90-I182 HydrophobicContact CD1-CG2 4.02Å; F90-I182 HydrophobicContact CE1-CG2 3.91Å; F90-G184 CarbonylContact O-C 3.55Å; F90-G184 VanDerWaalsContact O-CA 3.24Å; F90-G184 WeakPolarHBondContact O-CA 3.32Å; F90-I185 PolarHBondContact O-N 3.37Å
91	I	98	Very high	90.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-95.1	140.3	-171.1	61.2	170.3	0	0	0	111	S89 S99 F101 L103 L169 I185 L187 L279 I310 I314	S89-I91 WeakPolarHBondContact O-CG2 3.34Å; S89-I91 PolarHBondContact O-N 3.01Å; I91-S99 WeakPolarHBondContact O-CB 3.27Å; I91-S99 PolarHBondContact O-OG 3.03Å; I91-F101 HydrophobicContact CD1-CB 3.81Å; I91-F101 HydrophobicContact CG1-CB 3.61Å; I91-F101 WeakPolarHBondContact CG1-O 3.11Å; I91-F101 PolarHBondContact N-O 3.1Å; I91-L103 HydrophobicContact CD1-CD1 4.38Å; I91-L103 HydrophobicContact CD1-CG 4.17Å; I91-L103 HydrophobicContact CG2-CB 4.23Å; I91-L103 HydrophobicContact CG2-CD1 3.72Å; I91-L103 HydrophobicContact CG2-CG 3.85Å; I91-L169 HydrophobicContact CD1-CD1 4.03Å; I91-I185 HydrophobicContact CG2-CG2 4.35Å; I91-L187 HydrophobicContact CB-CD2 4.24Å; I91-L187 HydrophobicContact CD1-CD1 4.32Å; I91-L187 HydrophobicContact CG2-CD2 3.96Å; I91-L279 HydrophobicContact CG2-CD2 4.02Å; I91-I310 HydrophobicContact CD1-CG2 4.45Å; I91-I314 HydrophobicContact CD1-CD1 4.3Å
92	H	95.2	Very high	91.2	Very high	31 Å²	31	49 Å²	49	14%	0.144	22%	0.223	C	C	.	.			trans	-73	132.8	167.7	-178.5	70.1	0	0	0	110.7	C39 R94 K96 Y178 I185	C39-H92 HydrophobicContact CB-CB 3.37Å; H92-R94 PolarHBondContact CE1-O 2.79Å; H92-R94 PolarHBondContact NE2-O 3.39Å; H92-R94 VanDerWaalsContact NE2-O 3.08Å; H92-K96 PolarHBondContact CE1-O 3.21Å; H92-Y178 VanDerWaalsContact CA-OH 3.3Å; H92-Y178 WeakPolarHBondContact CA-OH 3.2Å; H92-Y178 AromaticContact ND1-CE2 3.39Å; H92-Y178 WeakPolarHBondContact ND1-CE2 3.14Å; H92-Y178 AromaticContact ND1-CZ 3.54Å; H92-Y178 PolarHBondContact ND1-OH 3.06Å; H92-I185 WeakPolarHBondContact CB-O 3.36Å; H92-I185 PolarHBondContact N-O 2.95Å
93	W	87.8	Confident	92.2	Very high	50 Å²	50	45.9 Å²	45.9	19%	0.189	20%	0.197	C	C	.	.			trans	-143.3	123.3	-178.9	-172.7	-105.7	0	0	0	111.1	F101 L187 M311 I314	W93-F101 HydrophobicContact CB-CD2 3.98Å; W93-F101 HydrophobicContact CB-CE2 4.48Å; W93-F101 AromaticContact CD1-CE2 3.7Å; W93-F101 HydrophobicContact CG-CD2 4.07Å; W93-F101 HydrophobicContact CG-CE2 4.19Å; W93-L187 HydrophobicContact CE3-CD1 4.06Å; W93-L187 HydrophobicContact CZ3-CD1 4.17Å; W93-M311 HydrophobicContact CH2-CB 4.14Å; W93-M311 HydrophobicContact CH2-CG 3.76Å; W93-M311 HydrophobicContact CH2-SD 4.23Å; W93-M311 HydrophobicContact CZ3-CG 4.29Å; W93-I314 HydrophobicContact CD2-CD1 3.48Å; W93-I314 VanDerWaalsContact CD2-CD1 3.48Å; W93-I314 HydrophobicContact CD2-CG2 4.32Å; W93-I314 HydrophobicContact CE3-CD1 3.56Å; W93-I314 HydrophobicContact CG-CD1 4.06Å; W93-I314 HydrophobicContact CG-CG2 4.49Å; W93-I314 HydrophobicContact CH2-CD1 3.97Å; W93-I314 HydrophobicContact CZ2-CB 4.09Å; W93-I314 HydrophobicContact CZ2-CD1 3.87Å; W93-I314 HydrophobicContact CZ2-CG2 3.86Å; W93-I314 HydrophobicContact CZ3-CD1 3.81Å
94	R	80	Confident	92.8	Very high	152 Å²	152	39.3 Å²	39.3	57%	0.574	17%	0.171	S	C	*	.	S	Bend	trans	63.9	163.2	-170.4	-56.7	171.5	172.1	169	0.1	112.7	H92 K96	H92-R94 PolarHBondContact CE1-O 2.79Å; H92-R94 PolarHBondContact NE2-O 3.39Å; H92-R94 VanDerWaalsContact NE2-O 3.08Å; R94-K96 PolarHBondContact O-N 3Å
95	E	73.4	Confident	93.2	Very high	172 Å²	172	35.4 Å²	35.4	80%	0.804	16%	0.156	S	C	*	.	S	Bend	trans	-74.8	48.8	178.4	-60.4	-173.8	-177.1	0	0	112.9
96	K	79.5	Confident	93.5	Very high	98 Å²	98	30.3 Å²	30.3	43%	0.426	14%	0.137	S	C	.	.	S	Bend	trans	-112.3	147.9	173.2	-68.4	-171.2	177.3	-172.2	0	109.7	H92 R94 A98 E175	H92-K96 PolarHBondContact CE1-O 3.21Å; R94-K96 PolarHBondContact O-N 3Å; K96-A98 PolarHBondContact O-N 3.23Å; K96-E175 IonicContact NZ-OE2 3.4Å
97	N	90.2	Very high	93.4	Very high	96 Å²	96	32.1 Å²	32.1	51%	0.513	15%	0.145	S	C	.	.	S	Bend	trans	-76.6	35.6	171.1	63.9	-28.2	0	0	0	112.4	Y178	N97-Y178 PolarHBondContact O-N 2.88Å
98	A	94.3	Very high	93.3	Very high	2 Å²	2	32.1 Å²	32.1	2%	0.017	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	155.7	-175.8	0	0	0	0	0	110.7	K96 E175 V176	K96-A98 PolarHBondContact O-N 3.23Å; A98-E175 HydrophobicContact CB-CG 3.64Å; A98-V176 WeakPolarHBondContact CA-O 3.45Å; A98-V176 WeakPolarHBondContact CB-O 3.38Å
99	S	95.8	Very high	93.2	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.021	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	165.9	173.5	-178.8	0	0	0	0	110.9	F90 I91 F101 V176	F90-S99 WeakPolarHBondContact CZ-O 3.28Å; I91-S99 WeakPolarHBondContact O-CB 3.27Å; I91-S99 PolarHBondContact O-OG 3.03Å; S99-F101 PolarHBondContact OG-N 2.75Å; S99-V176 PolarHBondContact N-O 2.8Å; S99-V176 VanDerWaalsContact N-O 3.1Å; S99-V176 PolarHBondContact O-N 3.43Å
100	S	96.8	Very high	92.7	Very high	14 Å²	14	32.6 Å²	32.6	10%	0.098	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	15	174.3	52.9	0	0	0	0	112	M171 L172	S100-M171 CarbonylContact O-C 3.58Å; S100-M171 WeakPolarHBondContact O-CA 3.35Å; S100-L172 WeakPolarHBondContact O-CB 3.36Å; S100-L172 WeakPolarHBondContact O-CG 3.19Å; S100-L172 PolarHBondContact O-N 3.14Å
101	F	98.2	Very high	91.8	Very high	12 Å²	12	33.3 Å²	33.3	5%	0.053	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.5	-170.5	-60	-66.3	0	0	0	112.7	F90 I91 W93 S99 L169 L170 M171 I314 F317	F90-F101 VanDerWaalsContact CD2-O 3.27Å; F90-F101 WeakPolarHBondContact CD2-O 3.5Å; I91-F101 HydrophobicContact CD1-CB 3.81Å; I91-F101 HydrophobicContact CG1-CB 3.61Å; I91-F101 WeakPolarHBondContact CG1-O 3.11Å; I91-F101 PolarHBondContact N-O 3.1Å; W93-F101 HydrophobicContact CB-CD2 3.98Å; W93-F101 HydrophobicContact CB-CE2 4.48Å; W93-F101 AromaticContact CD1-CE2 3.7Å; W93-F101 HydrophobicContact CG-CD2 4.07Å; W93-F101 HydrophobicContact CG-CE2 4.19Å; S99-F101 PolarHBondContact OG-N 2.75Å; F101-L169 HydrophobicContact CB-CD1 4.2Å; F101-L169 HydrophobicContact CD1-CD2 4.43Å; F101-L170 WeakPolarHBondContact CA-O 3.41Å; F101-M171 HydrophobicContact CD1-CB 4.32Å; F101-M171 HydrophobicContact CD1-CG 4.35Å; F101-M171 HydrophobicContact CE1-CB 4.13Å; F101-M171 HydrophobicContact CE1-CG 3.84Å; F101-M171 HydrophobicContact CE1-SD 4.36Å; F101-I314 HydrophobicContact CD1-CG1 4.26Å; F101-I314 HydrophobicContact CD2-CD1 4.3Å; F101-I314 HydrophobicContact CD2-CG1 4.46Å; F101-I314 HydrophobicContact CD2-CG2 4.44Å; F101-I314 HydrophobicContact CE1-CG1 4.25Å; F101-I314 HydrophobicContact CE1-CG2 4.22Å; F101-I314 HydrophobicContact CE2-CG1 4.43Å; F101-I314 HydrophobicContact CE2-CG2 3.69Å; F101-I314 HydrophobicContact CG-CD1 4.41Å; F101-I314 HydrophobicContact CG-CG1 4.38Å; F101-I314 HydrophobicContact CZ-CB 4.43Å; F101-I314 HydrophobicContact CZ-CG1 4.34Å; F101-I314 HydrophobicContact CZ-CG2 3.56Å; F101-F317 HydrophobicContact CE1-CB 4.36Å; F101-F317 HydrophobicContact CE1-CD2 4.02Å
102	V	98.8	Very high	90.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	132.4	173.4	174.1	0	0	0	0	109.4	A73 V75 S89 F90 V131 L170 L172	A73-V102 HydrophobicContact CB-CG1 3.94Å; A73-V102 HydrophobicContact CB-CG2 4.43Å; V75-V102 HydrophobicContact CG2-CG1 4.39Å; S89-V102 CarbonylContact O-C 3.58Å; S89-V102 VanDerWaalsContact O-CA 3.28Å; S89-V102 WeakPolarHBondContact O-CA 3.46Å; F90-V102 HydrophobicContact CB-CG2 4.39Å; F90-V102 HydrophobicContact CD2-CG2 3.96Å; V102-V131 HydrophobicContact CG2-CG1 4.08Å; V102-L170 HydrophobicContact CB-CB 4.29Å; V102-L170 HydrophobicContact CG1-CD1 4.42Å; V102-L170 PolarHBondContact N-O 3.24Å; V102-L170 PolarHBondContact O-N 3.25Å; V102-L172 HydrophobicContact CG2-CD1 4.14Å; V102-L172 HydrophobicContact CG2-CD2 4.29Å; V102-L172 HydrophobicContact CG2-CG 4.41Å
103	L	98.7	Very high	89	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	141.9	166.4	-72.7	175	0	0	0	110.2	G88 S89 I91 I167 A168 L169 L187 L279 V282 V303 I310	G88-L103 CarbonylContact C-O 3.59Å; G88-L103 WeakPolarHBondContact CA-O 3.33Å; S89-L103 PolarHBondContact N-O 2.86Å; S89-L103 PolarHBondContact O-N 3.46Å; I91-L103 HydrophobicContact CD1-CD1 4.38Å; I91-L103 HydrophobicContact CD1-CG 4.17Å; I91-L103 HydrophobicContact CG2-CB 4.23Å; I91-L103 HydrophobicContact CG2-CD1 3.72Å; I91-L103 HydrophobicContact CG2-CG 3.85Å; L103-I167 HydrophobicContact CD2-CD1 4.15Å; L103-I167 HydrophobicContact CD2-CG1 4.21Å; L103-A168 WeakPolarHBondContact CA-O 3.2Å; L103-L169 HydrophobicContact CD2-CB 4.28Å; L103-L169 HydrophobicContact CD2-CD1 3.6Å; L103-L169 HydrophobicContact CG-CD1 4.21Å; L103-L187 HydrophobicContact CD1-CD2 4.25Å; L103-L279 HydrophobicContact CD1-CD2 3.81Å; L103-V282 HydrophobicContact CB-CG2 4.21Å; L103-V303 HydrophobicContact CD1-CG1 4.46Å; L103-I310 HydrophobicContact CD1-CD1 3.83Å; L103-I310 HydrophobicContact CD2-CD1 4.21Å; L103-I310 HydrophobicContact CD2-CG1 4.22Å
104	T	98.5	Very high	87.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	179.6	173.1	-172.7	0	0	0	0	108.8	V75 G87 V109 A168 L170 V282	V75-T104 HydrophobicContact CG2-CG2 4.37Å; G87-T104 PolarHBondContact O-OG1 2.94Å; T104-V109 HydrophobicContact CG2-CG1 4.06Å; T104-A168 HydrophobicContact CG2-CB 4.09Å; T104-A168 PolarHBondContact N-O 3.28Å; T104-A168 PolarHBondContact O-N 3.03Å; T104-L170 HydrophobicContact CG2-CD1 4.08Å; T104-L170 HydrophobicContact CG2-CG 4.26Å; T104-V282 VanDerWaalsContact C-CG1 3.42Å
105	A	97.5	Very high	86.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.			trans	-75.6	150.8	176.6	0	0	0	0	0	110.9	C108 V282	A105-C108 HydrophobicContact CB-CB 4.48Å; A105-C108 WeakPolarHBondContact O-CB 2.94Å; A105-C108 PolarHBondContact O-N 3.19Å; A105-V282 HydrophobicContact CB-CG1 4.39Å
106	A	96.2	Very high	86.3	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-45.8	175.7	0	0	0	0	0	111.2	C108 V109 L110 V155 Y158 D166	A106-C108 PolarHBondContact O-N 3.41Å; A106-C108 VanDerWaalsContact O-N 3.15Å; A106-V109 VanDerWaalsContact O-CG2 3.29Å; A106-V109 WeakPolarHBondContact O-CG2 3.22Å; A106-V109 PolarHBondContact O-N 2.78Å; A106-L110 PolarHBondContact O-N 2.86Å; A106-V155 HydrophobicContact CB-CG1 3.32Å; A106-Y158 HydrophobicContact CB-CD1 3.94Å; A106-Y158 HydrophobicContact CB-CD2 3.95Å; A106-Y158 HydrophobicContact CB-CG 3.57Å; A106-D166 WeakPolarHBondContact CA-OD1 3.24Å; A106-D166 VanDerWaalsContact CB-OD1 3.26Å; A106-D166 WeakPolarHBondContact CB-OD1 3.28Å; A106-D166 PolarHBondContact N-OD1 2.95Å
107	H	92.3	Very high	85.4	Confident	45 Å²	45	42.5 Å²	42.5	21%	0.208	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-63.7	-21.6	-177.9	75.4	-96.9	0	0	0	113.5	R84 V109 L110 Y158 D166 S265 S284	R84-H107 PolarHBondContact NH1-O 2.95Å; H107-V109 VanDerWaalsContact C-N 3.25Å; H107-V109 PolarHBondContact O-N 2.75Å; H107-L110 HydrophobicContact CB-CD1 4.42Å; H107-Y158 HydrophobicContact CB-CE1 4.02Å; H107-D166 IonicContact CE1-OD2 3.49Å; H107-D166 PolarHBondContact CE1-OD2 3.02Å; H107-D166 IonicContact CG-OD1 3.45Å; H107-D166 IonicContact CG-OD2 3.88Å; H107-D166 PolarHBondContact N-OD1 3.23Å; H107-D166 IonicContact ND1-OD1 2.63Å; H107-D166 PolarHBondContact ND1-OD1 2.6Å; H107-D166 IonicContact ND1-OD2 2.74Å; H107-D166 PolarHBondContact ND1-OD2 3.2Å; H107-S265 WeakPolarHBondContact NE2-CB 3.35Å; H107-S265 PolarHBondContact NE2-OG 2.6Å; H107-S265 VanDerWaalsContact NE2-OG 3.11Å; H107-S284 PolarHBondContact CE1-O 2.83Å; H107-S284 VanDerWaalsContact CE1-O 3.29Å
108	C	93.8	Very high	84.2	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-68.1	-25	175.9	-74.2	0	0	0	0	113.3	T77 C86 A105 A106 S265	T77-C108 PolarHBondContact OG1-O 3.15Å; C86-C108 HydrophobicContact CB-CB 3.58Å; C86-C108 WeakPolarHBondContact CB-SG 3.44Å; C86-C108 WeakPolarHBondContact SG-CB 3.23Å; C86-C108 CovalentContact SG-SG 2.03Å; C86-C108 PolarHBondContact SG-SG 2.85Å; A105-C108 HydrophobicContact CB-CB 4.48Å; A105-C108 WeakPolarHBondContact O-CB 2.94Å; A105-C108 PolarHBondContact O-N 3.19Å; A106-C108 PolarHBondContact O-N 3.41Å; A106-C108 VanDerWaalsContact O-N 3.15Å; C108-S265 PolarHBondContact SG-O 3.13Å
109	V	94.3	Very high	83.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-119.1	14.8	-174.2	-61.1	0	0	0	0	113.3	V75 T104 A106 H107 A124 L129 L153 V155 A168 L170	V75-V109 HydrophobicContact CG1-CG1 4.3Å; T104-V109 HydrophobicContact CG2-CG1 4.06Å; A106-V109 VanDerWaalsContact O-CG2 3.29Å; A106-V109 WeakPolarHBondContact O-CG2 3.22Å; A106-V109 PolarHBondContact O-N 2.78Å; H107-V109 VanDerWaalsContact C-N 3.25Å; H107-V109 PolarHBondContact O-N 2.75Å; V109-A124 WeakPolarHBondContact O-CB 2.99Å; V109-A124 PolarHBondContact O-N 2.03Å; V109-L129 HydrophobicContact CB-CD2 4.43Å; V109-L129 HydrophobicContact CG1-CD2 3.95Å; V109-L153 HydrophobicContact CB-CD1 4.16Å; V109-L153 HydrophobicContact CB-CD2 4.3Å; V109-L153 HydrophobicContact CG2-CD1 3.73Å; V109-L153 HydrophobicContact CG2-CD2 4.41Å; V109-V155 HydrophobicContact CG2-CG2 3.87Å; V109-A168 HydrophobicContact CG2-CB 3.62Å; V109-L170 HydrophobicContact CG1-CD2 4.16Å
110	L	89	Confident	81.9	Confident	10 Å²	10	57.3 Å²	57.3	5%	0.052	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-72.8	148.7	165.1	-62.4	-178.9	0	0	0	110.6	R84 A106 H107 L121 L123 Y158	R84-L110 PolarHBondContact NH1-O 2.87Å; A106-L110 PolarHBondContact O-N 2.86Å; H107-L110 HydrophobicContact CB-CD1 4.42Å; L110-L121 HydrophobicContact CD1-CD2 4.27Å; L110-L121 HydrophobicContact CD2-CB 4.16Å; L110-L121 HydrophobicContact CD2-CD1 4.39Å; L110-L121 HydrophobicContact CD2-CD2 4.12Å; L110-L121 HydrophobicContact CD2-CG 4.47Å; L110-L123 HydrophobicContact CD2-CD2 3.86Å; L110-Y158 HydrophobicContact CD1-CD1 4.06Å; L110-Y158 HydrophobicContact CD1-CE1 3.9Å
111	G	79.5	Confident	81	Confident	15 Å²	15	59.1 Å²	59.1	16%	0.155	30%	0.301	C	S	.	.			trans	-62.9	176.6	173.2	0	0	0	0	0	112.5	Q122	G111-Q122 PolarHBondContact N-O 3.01Å
112	N	68.3	Low	80.5	Confident	74 Å²	74	62.4 Å²	62.4	40%	0.396	32%	0.317	S	S	.	.	S	Bend	trans	-93.5	-4.6	-172.8	-60.1	-59.1	0	0	0	113.9	G79	G79-N112 VanDerWaalsContact CA-ND2 3.3Å; G79-N112 WeakPolarHBondContact CA-ND2 3.34Å
113	L	65.3	Low	80.1	Confident	106 Å²	106	65.8 Å²	65.8	56%	0.555	34%	0.335	S	S	*	.	S	Bend	trans	-84.7	133	-179.9	-67.1	175.1	0	0	0	109.6	H115	L113-H115 PolarHBondContact O-N 3.39Å
114	P	62	Low	79.8	Confident	111 Å²	111	66.3 Å²	66.3	72%	0.721	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-53.5	125.7	172	-20.7	29.8	0	0	0	109.7	L116	P114-L116 PolarHBondContact O-N 3.11Å
115	H	61.9	Low	79.5	Confident	36 Å²	36	72.4 Å²	72.4	17%	0.167	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-73.2	118.6	175.6	-63.2	-51.6	0	0	0	109.1	L113 Q122 E160	L113-H115 PolarHBondContact O-N 3.39Å; H115-Q122 PolarHBondContact CE1-N 3.2Å; H115-E160 VanDerWaalsContact CB-OE2 3.28Å; H115-E160 WeakPolarHBondContact CB-OE2 3.29Å; H115-E160 IonicContact CD2-OE1 3.19Å; H115-E160 PolarHBondContact CD2-OE1 2.7Å; H115-E160 IonicContact CD2-OE2 3.74Å; H115-E160 PolarHBondContact CD2-OE2 3.46Å; H115-E160 IonicContact CG-OE2 3.39Å
116	L	60.7	Low	79.5	Confident	113 Å²	113	75.7 Å²	75.7	59%	0.592	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-74.2	139.5	170.2	-62.5	177.1	0	0	0	108.8	P114 G118 E119	P114-L116 PolarHBondContact O-N 3.11Å; L116-G118 PolarHBondContact O-N 3.14Å; L116-G118 VanDerWaalsContact O-N 3.09Å; L116-E119 HydrophobicContact CB-CG 4.09Å; L116-E119 WeakPolarHBondContact O-CB 3.44Å; L116-E119 PolarHBondContact O-N 3.04Å
117	R	61.5	Low	79.4	Confident	256 Å²	256	81.8 Å²	81.8	97%	0.966	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	117.3	-176.7	-166.6	177.2	-174.8	152.5	2.6	110.6
118	G	64.8	Low	79.5	Confident	84 Å²	84	81.7 Å²	81.7	87%	0.866	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.1	-7.4	-179.3	0	0	0	0	0	114.9	L116	L116-G118 PolarHBondContact O-N 3.14Å; L116-G118 VanDerWaalsContact O-N 3.09Å
119	E	70.5	Confident	79.7	Confident	101 Å²	101	81.7 Å²	81.7	47%	0.472	41%	0.412	S	S	.	.	S	Bend	trans	-77.6	156.2	170.5	-68.4	-171.8	164.6	0	0	111.8	L116	L116-E119 HydrophobicContact CB-CG 4.09Å; L116-E119 WeakPolarHBondContact O-CB 3.44Å; L116-E119 PolarHBondContact O-N 3.04Å
120	R	71.4	Confident	79.8	Confident	226 Å²	226	85.4 Å²	85.4	85%	0.853	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-67.3	138.1	169.8	-69.4	177.5	69.9	120.4	0.5	108.9	Q122	R120-Q122 PolarHBondContact O-N 2.81Å; R120-Q122 VanDerWaalsContact O-N 3.1Å
121	L	78	Confident	80.3	Confident	52 Å²	52	84.9 Å²	84.9	27%	0.272	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-50.9	119.2	169.8	-70.3	172.6	0	0	0	109.7	L110 Y158 E160	L110-L121 HydrophobicContact CD1-CD2 4.27Å; L110-L121 HydrophobicContact CD2-CB 4.16Å; L110-L121 HydrophobicContact CD2-CD1 4.39Å; L110-L121 HydrophobicContact CD2-CD2 4.12Å; L110-L121 HydrophobicContact CD2-CG 4.47Å; L121-Y158 HydrophobicContact CD1-CD1 4.23Å; L121-Y158 WeakPolarHBondContact CD1-O 3.47Å; L121-E160 HydrophobicContact CD2-CG 4.1Å
122	Q	86.5	Confident	81.1	Confident	81 Å²	81	84.7 Å²	84.7	38%	0.379	42%	0.419	S	S	.	.			trans	-84.7	115.2	173.9	-58.6	-177.8	52.8	0	0	107.9	G111 H115 R120	G111-Q122 PolarHBondContact N-O 3.01Å; H115-Q122 PolarHBondContact CE1-N 3.2Å; R120-Q122 PolarHBondContact O-N 2.81Å; R120-Q122 VanDerWaalsContact O-N 3.1Å
123	L	91.2	Very high	82.6	Confident	72 Å²	72	81.2 Å²	81.2	38%	0.377	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-80.5	154.6	177.7	-57.3	-175.2	0	0	0	110.8	L110 L153 V155	L110-L123 HydrophobicContact CD2-CD2 3.86Å; L123-L153 HydrophobicContact CB-CD2 3.91Å; L123-L153 HydrophobicContact CD1-CD2 3.96Å; L123-L153 HydrophobicContact CD1-CG 4.17Å; L123-L153 HydrophobicContact CG-CD2 4.43Å; L123-V155 HydrophobicContact CD1-CG2 4.02Å; L123-V155 HydrophobicContact CD2-CB 4.2Å; L123-V155 HydrophobicContact CD2-CG2 3.55Å; L123-V155 HydrophobicContact CG-CG2 4.45Å
124	A	91.9	Very high	84.1	Confident	11 Å²	11	76.4 Å²	76.4	9%	0.091	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-58.8	144.7	169.1	0	0	0	0	0	110.4	T77 V109 L129	T77-A124 HydrophobicContact CG2-CB 3.61Å; V109-A124 WeakPolarHBondContact O-CB 2.99Å; V109-A124 PolarHBondContact O-N 2.03Å; A124-L129 HydrophobicContact CB-CD1 4.24Å; A124-L129 HydrophobicContact CB-CD2 4.12Å; A124-L129 HydrophobicContact CB-CG 4.11Å
125	K	93.6	Very high	85.6	Confident	128 Å²	128	71.6 Å²	71.6	56%	0.557	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-69.2	145	173.7	-58.8	-179.8	-179.1	175.3	0	109.2	E127 D128 L129	K125-E127 HydrophobicContact CB-CG 3.9Å; K125-E127 HydrophobicContact CD-CG 4.28Å; K125-E127 WeakPolarHBondContact CD-OE1 3.44Å; K125-E127 IonicContact NZ-OE1 3.43Å; K125-E127 PolarHBondContact NZ-OE1 3.06Å; K125-E127 PolarHBondContact O-N 3.38Å; K125-D128 WeakPolarHBondContact O-CB 3.29Å; K125-D128 PolarHBondContact O-N 3.34Å; K125-L129 PolarHBondContact O-N 3.34Å
126	L	95.7	Very high	87.1	Confident	69 Å²	69	70.4 Å²	70.4	36%	0.361	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-58.9	-34.1	179.2	-64.1	178.1	0	0	0	112.6	D128 L129 V150 V151 L153	L126-D128 PolarHBondContact O-N 3.15Å; L126-L129 HydrophobicContact CD2-CD1 4.46Å; L126-L129 PolarHBondContact O-N 2.96Å; L126-V150 HydrophobicContact CD2-CG1 4.02Å; L126-V151 WeakPolarHBondContact CD1-O 3.44Å; L126-L153 HydrophobicContact CD2-CB 3.76Å
127	E	95.2	Very high	88.5	Confident	127 Å²	127	66.2 Å²	66.2	59%	0.593	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-63	-26.5	176.8	65	-172.1	172.9	0	0	113.4	K125 R130	K125-E127 HydrophobicContact CB-CG 3.9Å; K125-E127 HydrophobicContact CD-CG 4.28Å; K125-E127 WeakPolarHBondContact CD-OE1 3.44Å; K125-E127 IonicContact NZ-OE1 3.43Å; K125-E127 PolarHBondContact NZ-OE1 3.06Å; K125-E127 PolarHBondContact O-N 3.38Å; E127-R130 PolarHBondContact O-NH1 3.19Å
128	D	94.8	Very high	89.8	Confident	43 Å²	43	55.4 Å²	55.4	23%	0.23	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-88.2	-11	179.9	-66.5	-39.3	0	0	0	112.8	R78 K125 L126	R78-D128 HydrophobicContact CB-CB 3.96Å; R78-D128 PolarHBondContact N-O 3.22Å; K125-D128 WeakPolarHBondContact O-CB 3.29Å; K125-D128 PolarHBondContact O-N 3.34Å; L126-D128 PolarHBondContact O-N 3.15Å
129	L	97.1	Very high	90.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.7	-177.8	-70.8	169.5	0	0	0	111.6	I76 T77 V109 A124 K125 L126 V150 L153	I76-L129 WeakPolarHBondContact O-CA 3.43Å; T77-L129 HydrophobicContact CG2-CD2 4.01Å; T77-L129 WeakPolarHBondContact OG1-CD2 3.22Å; V109-L129 HydrophobicContact CB-CD2 4.43Å; V109-L129 HydrophobicContact CG1-CD2 3.95Å; A124-L129 HydrophobicContact CB-CD1 4.24Å; A124-L129 HydrophobicContact CB-CD2 4.12Å; A124-L129 HydrophobicContact CB-CG 4.11Å; K125-L129 PolarHBondContact O-N 3.34Å; L126-L129 HydrophobicContact CD2-CD1 4.46Å; L126-L129 PolarHBondContact O-N 2.96Å; L129-V150 HydrophobicContact CB-CB 4.01Å; L129-V150 HydrophobicContact CB-CG2 3.88Å; L129-L153 HydrophobicContact CD1-CD2 3.93Å
130	R	97.3	Very high	91.6	Very high	78 Å²	78	56.4 Å²	56.4	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.7	169.7	-66.8	-64.2	-179.4	-73.9	-4.5	110.1	I76 E127	I76-R130 HydrophobicContact CB-CB 4.37Å; I76-R130 PolarHBondContact N-O 3.01Å; I76-R130 PolarHBondContact O-N 3.37Å; E127-R130 PolarHBondContact O-NH1 3.19Å
131	V	98.3	Very high	92.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.2	170.8	173	0	0	0	0	108.2	A73 L74 V102 L133 Q147 L148 V150 L170 L172	A73-V131 HydrophobicContact CB-CG1 4.13Å; L74-V131 CarbonylContact O-C 3.46Å; L74-V131 WeakPolarHBondContact O-CA 3.35Å; V102-V131 HydrophobicContact CG2-CG1 4.08Å; V131-L133 HydrophobicContact CG1-CD2 3.9Å; V131-L133 HydrophobicContact CG1-CG 4.14Å; V131-Q147 WeakPolarHBondContact O-CA 3.3Å; V131-L148 PolarHBondContact N-O 2.86Å; V131-L148 PolarHBondContact O-N 3.17Å; V131-V150 HydrophobicContact CG2-CG2 3.94Å; V131-L170 HydrophobicContact CG2-CD1 3.89Å; V131-L172 HydrophobicContact CB-CD2 3.67Å; V131-L172 HydrophobicContact CG1-CD2 3.97Å; V131-L172 HydrophobicContact CG2-CD2 3.77Å
132	V	97.8	Very high	93.1	Very high	11 Å²	11	50.2 Å²	50.2	7%	0.067	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.3	168.8	-170.3	0	0	0	0	108.6	L74 I76 A135 E145 Q146 Q147	L74-V132 HydrophobicContact CB-CB 4.18Å; L74-V132 HydrophobicContact CD2-CB 4.49Å; L74-V132 HydrophobicContact CD2-CG2 4.39Å; L74-V132 PolarHBondContact N-O 3.14Å; L74-V132 PolarHBondContact O-N 3.39Å; I76-V132 HydrophobicContact CD1-CG2 4.06Å; V132-A135 HydrophobicContact CG1-CB 4.06Å; V132-E145 HydrophobicContact CG1-CB 4.25Å; V132-E145 HydrophobicContact CG1-CG 4Å; V132-Q146 WeakPolarHBondContact CA-O 3.2Å; V132-Q147 HydrophobicContact CG2-CB 4.44Å; V132-Q147 HydrophobicContact CG2-CG 4.22Å
133	L	98.2	Very high	93.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	151.3	173.2	-58.8	-179.2	0	0	0	109.4	A73 F90 V131 A135 E145 Q146 L148 L172 V176 I182	A73-L133 HydrophobicContact CB-CD2 3.61Å; F90-L133 HydrophobicContact CB-CD2 3.91Å; F90-L133 HydrophobicContact CD1-CD1 4.2Å; F90-L133 HydrophobicContact CD2-CD1 3.95Å; F90-L133 HydrophobicContact CE1-CD1 4.33Å; F90-L133 HydrophobicContact CE2-CD1 4.12Å; F90-L133 HydrophobicContact CG-CD1 4.01Å; F90-L133 HydrophobicContact CG-CD2 4.24Å; F90-L133 HydrophobicContact CZ-CD1 4.31Å; V131-L133 HydrophobicContact CG1-CD2 3.9Å; V131-L133 HydrophobicContact CG1-CG 4.14Å; L133-A135 VanDerWaalsContact C-N 3.26Å; L133-A135 PolarHBondContact O-N 3.09Å; L133-E145 CarbonylContact O-C 3.34Å; L133-E145 VanDerWaalsContact O-CA 3.24Å; L133-E145 WeakPolarHBondContact O-CA 3.29Å; L133-Q146 PolarHBondContact N-O 3.1Å; L133-Q146 PolarHBondContact O-N 2.94Å; L133-L148 HydrophobicContact CD1-CD1 3.79Å; L133-L148 HydrophobicContact CG-CD1 4.08Å; L133-L172 HydrophobicContact CD1-CD1 4.24Å; L133-V176 HydrophobicContact CD1-CG1 4.29Å; L133-V176 HydrophobicContact CD1-CG2 4.25Å; L133-I182 HydrophobicContact CB-CD1 3.85Å; L133-I182 HydrophobicContact CB-CG1 4.08Å; L133-I182 HydrophobicContact CB-CG2 4Å; L133-I182 HydrophobicContact CD1-CG2 3.88Å
134	G	96.7	Very high	93.6	Very high	5 Å²	5	51.4 Å²	51.4	5%	0.052	27%	0.273	C	S	.	.	S	Bend	trans	79.9	1.8	177.2	0	0	0	0	0	114.9
135	A	95.1	Very high	93.8	Very high	11 Å²	11	52.7 Å²	52.7	9%	0.091	28%	0.277	C	S	.	.			trans	-72	139	176.2	0	0	0	0	0	111.1	V132 L133 E145 W206	V132-A135 HydrophobicContact CG1-CB 4.06Å; L133-A135 VanDerWaalsContact C-N 3.26Å; L133-A135 PolarHBondContact O-N 3.09Å; A135-E145 HydrophobicContact CB-CG 3.88Å; A135-W206 HydrophobicContact CB-CZ2 4.17Å
136	H	92.2	Very high	93.9	Very high	10 Å²	10	49 Å²	49	5%	0.046	26%	0.262	C	S	.	.	S	Bend	trans	-114.1	-51.2	164.8	-177.7	70.6	0	0	0	110.1	E63 A64 M66 W206 K225 L226	E63-H136 IonicContact OE1-NE2 3.83Å; E63-H136 PolarHBondContact OE1-NE2 2.81Å; A64-H136 PolarHBondContact O-CE1 3.22Å; A64-H136 VanDerWaalsContact O-CE1 3.25Å; M66-H136 HydrophobicContact CE-CB 4.37Å; M66-H136 HydrophobicContact CG-CB 3.98Å; H136-W206 PolarHBondContact O-NE1 2.98Å; H136-K225 CarbonylContact O-C 3.52Å; H136-K225 WeakPolarHBondContact O-CA 3.32Å; H136-L226 PolarHBondContact O-N 3.48Å
137	D	91.2	Very high	94	Very high	25 Å²	25	51.9 Å²	51.9	13%	0.134	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-106	116.8	176.7	-166.9	-36.5	0	0	0	109.1	D139 I140 E224 K225	D137-D139 VanDerWaalsContact C-N 3.3Å; D137-D139 PolarHBondContact O-N 3.21Å; D137-D139 PolarHBondContact OD1-N 3.14Å; D137-D139 VanDerWaalsContact OD1-N 3.12Å; D137-I140 HydrophobicContact CB-CD1 4.21Å; D137-I140 HydrophobicContact CB-CG1 4.25Å; D137-I140 WeakPolarHBondContact OD2-CD1 3.33Å; D137-E224 CarbonylContact C-O 3.56Å; D137-E224 WeakPolarHBondContact CA-O 3.08Å; D137-K225 HydrophobicContact CB-CG 4.16Å
138	I	88.5	Confident	94.2	Very high	30 Å²	30	45.8 Å²	45.8	15%	0.154	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.7	-173.2	62.3	169.5	0	0	0	113.7	L74 W206 E224	L74-I138 HydrophobicContact CD2-CB 4.44Å; L74-I138 HydrophobicContact CD2-CG2 3.9Å; I138-W206 HydrophobicContact CD1-CB 3.94Å; I138-W206 HydrophobicContact CD1-CG 4.13Å; I138-W206 HydrophobicContact CG1-CG 4.49Å; I138-W206 HydrophobicContact CG2-CD2 3.87Å; I138-W206 HydrophobicContact CG2-CG 3.89Å; I138-W206 HydrophobicContact CG2-CZ2 4.09Å; I138-E224 WeakPolarHBondContact CG1-O 3.42Å; I138-E224 PolarHBondContact N-O 2.64Å
139	D	86.9	Confident	94.3	Very high	99 Å²	99	45.3 Å²	45.3	53%	0.529	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-9.3	174.4	-78.1	-11.4	0	0	0	112.5	D137 E224	D137-D139 VanDerWaalsContact C-N 3.3Å; D137-D139 PolarHBondContact O-N 3.21Å; D137-D139 PolarHBondContact OD1-N 3.14Å; D137-D139 VanDerWaalsContact OD1-N 3.12Å; D139-E224 VanDerWaalsContact OD2-CG 3.28Å; D139-E224 WeakPolarHBondContact OD2-CG 3.07Å
140	I	86.8	Confident	94.4	Very high	107 Å²	107	45.5 Å²	45.5	55%	0.549	25%	0.246	S	C	.	.	S	Bend	trans	-129.5	119.8	-178	-26.3	171.8	0	0	0	109.4	D137 S142	D137-I140 HydrophobicContact CB-CD1 4.21Å; D137-I140 HydrophobicContact CB-CG1 4.25Å; D137-I140 WeakPolarHBondContact OD2-CD1 3.33Å; I140-S142 PolarHBondContact O-N 3Å
141	T	89.6	Confident	94.4	Very high	124 Å²	124	45 Å²	45	76%	0.761	25%	0.251	S	S	*	.			trans	-73.4	113.7	172.3	-54.3	0	0	0	0	110.2
142	S	90.4	Very high	94.4	Very high	24 Å²	24	48.9 Å²	48.9	17%	0.168	27%	0.268	C	S	.	.			trans	-90.7	153.5	176.3	67.3	0	0	0	0	112.8	I140 E144 E145	I140-S142 PolarHBondContact O-N 3Å; S142-E144 WeakPolarHBondContact CB-OE2 3.37Å; S142-E144 PolarHBondContact O-N 3.33Å; S142-E145 WeakPolarHBondContact CB-OE1 3.41Å; S142-E145 PolarHBondContact N-OE1 2.71Å; S142-E145 WeakPolarHBondContact O-CB 3.42Å; S142-E145 PolarHBondContact O-N 3.16Å; S142-E145 WeakPolarHBondContact OG-CG 3.47Å; S142-E145 PolarHBondContact OG-OE1 3.2Å
143	P	93.4	Very high	94.4	Very high	124 Å²	124	49.8 Å²	49.8	81%	0.805	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.9	174.9	-23.3	34	0	0	0	114.6	E145	P143-E145 VanDerWaalsContact C-N 3.28Å
144	E	94.1	Very high	94.3	Very high	53 Å²	53	50.7 Å²	50.7	25%	0.248	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-16.3	179.7	-62.7	70.6	-146.9	0	0	112.3	Y67 S142 Y181	Y67-E144 HydrophobicContact CE1-CB 4.09Å; Y67-E144 HydrophobicContact CE1-CG 4.28Å; Y67-E144 PolarHBondContact OH-OE2 2.94Å; Y67-E144 VanDerWaalsContact OH-OE2 3.06Å; S142-E144 WeakPolarHBondContact CB-OE2 3.37Å; S142-E144 PolarHBondContact O-N 3.33Å; E144-Y181 HydrophobicContact CB-CD2 3.87Å; E144-Y181 HydrophobicContact CB-CE2 4.4Å; E144-Y181 HydrophobicContact CB-CG 3.95Å; E144-Y181 HydrophobicContact CG-CD1 4.08Å; E144-Y181 HydrophobicContact CG-CD2 3.52Å; E144-Y181 HydrophobicContact CG-CE1 4.12Å; E144-Y181 HydrophobicContact CG-CE2 3.55Å; E144-Y181 HydrophobicContact CG-CG 3.78Å
145	E	96	Very high	94.3	Very high	39 Å²	39	51.8 Å²	51.8	18%	0.182	29%	0.286	C	S	.	.			trans	-73	144.5	-179.5	-80.9	159.3	-128.4	0	0	113.5	V132 L133 A135 S142 P143	V132-E145 HydrophobicContact CG1-CB 4.25Å; V132-E145 HydrophobicContact CG1-CG 4Å; L133-E145 CarbonylContact O-C 3.34Å; L133-E145 VanDerWaalsContact O-CA 3.24Å; L133-E145 WeakPolarHBondContact O-CA 3.29Å; A135-E145 HydrophobicContact CB-CG 3.88Å; S142-E145 WeakPolarHBondContact CB-OE1 3.41Å; S142-E145 PolarHBondContact N-OE1 2.71Å; S142-E145 WeakPolarHBondContact O-CB 3.42Å; S142-E145 PolarHBondContact O-N 3.16Å; S142-E145 WeakPolarHBondContact OG-CG 3.47Å; S142-E145 PolarHBondContact OG-OE1 3.2Å; P143-E145 VanDerWaalsContact C-N 3.28Å
146	Q	97.5	Very high	94.3	Very high	49 Å²	49	51.6 Å²	51.6	23%	0.229	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	112.9	165.6	-65.6	-169.8	42.5	0	0	109.9	V132 L133 L148 I182	V132-Q146 WeakPolarHBondContact CA-O 3.2Å; L133-Q146 PolarHBondContact N-O 3.1Å; L133-Q146 PolarHBondContact O-N 2.94Å; Q146-L148 HydrophobicContact CB-CD1 4.02Å; Q146-L148 HydrophobicContact CB-CG 4.36Å; Q146-I182 HydrophobicContact CB-CD1 4.12Å; Q146-I182 HydrophobicContact CG-CD1 3.81Å
147	Q	97.2	Very high	94.2	Very high	130 Å²	130	58.7 Å²	58.7	61%	0.607	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.4	168.9	-173.2	174.1	-0.1	0	0	109.9	V131 V132	V131-Q147 WeakPolarHBondContact O-CA 3.3Å; V132-Q147 HydrophobicContact CG2-CB 4.44Å; V132-Q147 HydrophobicContact CG2-CG 4.22Å
148	L	98.4	Very high	94.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.9	-167.8	-66.2	144	0	0	0	110.5	V131 L133 Q146 L172 E173 K174 V176	V131-L148 PolarHBondContact N-O 2.86Å; V131-L148 PolarHBondContact O-N 3.17Å; L133-L148 HydrophobicContact CD1-CD1 3.79Å; L133-L148 HydrophobicContact CG-CD1 4.08Å; Q146-L148 HydrophobicContact CB-CD1 4.02Å; Q146-L148 HydrophobicContact CB-CG 4.36Å; L148-L172 HydrophobicContact CB-CD2 4.1Å; L148-L172 HydrophobicContact CD1-CD1 4.11Å; L148-E173 HydrophobicContact CD2-CG 4.38Å; L148-K174 HydrophobicContact CD2-CD 4.08Å; L148-K174 HydrophobicContact CD2-CG 3.61Å; L148-V176 HydrophobicContact CD1-CG2 3.69Å; L148-V176 HydrophobicContact CD2-CG2 3.97Å
149	S	98.3	Very high	94.1	Very high	32 Å²	32	60.5 Å²	60.5	22%	0.224	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	153.3	169.5	-41.8	0	0	0	0	111.3	E173	S149-E173 WeakPolarHBondContact CB-OE2 3.48Å; S149-E173 PolarHBondContact N-OE1 3.46Å; S149-E173 PolarHBondContact O-N 2.78Å; S149-E173 PolarHBondContact OG-OE2 3.38Å
150	V	98.5	Very high	93.9	Very high	5 Å²	5	60.1 Å²	60.1	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	126.8	171.6	-178.5	0	0	0	0	109.2	L126 L129 V131 K152 L170 M171	L126-V150 HydrophobicContact CD2-CG1 4.02Å; L129-V150 HydrophobicContact CB-CB 4.01Å; L129-V150 HydrophobicContact CB-CG2 3.88Å; V131-V150 HydrophobicContact CG2-CG2 3.94Å; V150-K152 VanDerWaalsContact CG1-O 3.27Å; V150-K152 WeakPolarHBondContact CG1-O 3.17Å; V150-L170 HydrophobicContact CG1-CB 4.07Å; V150-L170 HydrophobicContact CG1-CD2 4.31Å; V150-L170 HydrophobicContact CG2-CB 4.38Å; V150-L170 HydrophobicContact CG2-CD1 4.3Å; V150-M171 CarbonylContact C-O 3.57Å; V150-M171 WeakPolarHBondContact CA-O 3.32Å
151	V	98	Very high	93.8	Very high	67 Å²	67	60.3 Å²	60.3	41%	0.406	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	-21.9	-178.4	-67.3	0	0	0	0	113.8	L126 M171 L172 E173	L126-V151 WeakPolarHBondContact CD1-O 3.44Å; V151-M171 HydrophobicContact CG2-CB 4.26Å; V151-M171 HydrophobicContact CG2-CG 4.04Å; V151-M171 WeakPolarHBondContact CG2-O 3.36Å; V151-M171 HydrophobicContact CG2-SD 4.29Å; V151-M171 PolarHBondContact N-O 2.79Å; V151-L172 WeakPolarHBondContact CG2-O 3.34Å; V151-E173 HydrophobicContact CG1-CB 3.71Å
152	K	98	Very high	93.7	Very high	81 Å²	81	55.7 Å²	55.7	35%	0.352	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	142.3	170.4	-56.2	-176	-179.9	177.9	0	109.8	V150 M171 F317	V150-K152 VanDerWaalsContact CG1-O 3.27Å; V150-K152 WeakPolarHBondContact CG1-O 3.17Å; K152-M171 HydrophobicContact CB-CB 3.86Å; K152-M171 HydrophobicContact CB-SD 4.47Å; K152-M171 HydrophobicContact CD-SD 3.82Å; K152-M171 HydrophobicContact CG-CB 4.47Å; K152-M171 HydrophobicContact CG-SD 4.16Å; K152-M171 PolarHBondContact N-O 2.88Å; K152-M171 PolarHBondContact O-N 3.04Å; K152-F317 HydrophobicContact CB-CD1 3.92Å; K152-F317 HydrophobicContact CB-CD2 4.14Å; K152-F317 HydrophobicContact CB-CE1 3.7Å; K152-F317 HydrophobicContact CB-CE2 3.93Å; K152-F317 HydrophobicContact CB-CG 4.12Å; K152-F317 HydrophobicContact CB-CZ 3.7Å; K152-F317 HydrophobicContact CD-CB 3.94Å; K152-F317 HydrophobicContact CD-CD1 3.6Å; K152-F317 HydrophobicContact CD-CE1 4.2Å; K152-F317 HydrophobicContact CD-CG 3.79Å; K152-F317 HydrophobicContact CG-CD1 4.37Å; K152-F317 PolarHBondContact NZ-O 3.46Å
153	L	97.3	Very high	93.6	Very high	30 Å²	30	57.8 Å²	57.8	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135	177.5	164.3	63.2	0	0	0	108.5	V109 L123 L126 L129 V155 A168 L170	V109-L153 HydrophobicContact CB-CD1 4.16Å; V109-L153 HydrophobicContact CB-CD2 4.3Å; V109-L153 HydrophobicContact CG2-CD1 3.73Å; V109-L153 HydrophobicContact CG2-CD2 4.41Å; L123-L153 HydrophobicContact CB-CD2 3.91Å; L123-L153 HydrophobicContact CD1-CD2 3.96Å; L123-L153 HydrophobicContact CD1-CG 4.17Å; L123-L153 HydrophobicContact CG-CD2 4.43Å; L126-L153 HydrophobicContact CD2-CB 3.76Å; L129-L153 HydrophobicContact CD1-CD2 3.93Å; L153-V155 HydrophobicContact CD1-CG2 4Å; L153-V155 HydrophobicContact CG-CG2 4.45Å; L153-A168 HydrophobicContact CD1-CB 4.36Å; L153-L170 HydrophobicContact CD1-CD2 3.37Å; L153-L170 HydrophobicContact CG-CD2 4.48Å
154	A	97	Very high	93.5	Very high	19 Å²	19	53.1 Å²	53.1	16%	0.157	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	141.2	169.2	0	0	0	0	0	109.5	A168 L169 W309 T313 F317	A154-A168 CarbonylContact O-C 3.53Å; A154-A168 VanDerWaalsContact O-CA 3.28Å; A154-A168 WeakPolarHBondContact O-CA 3.29Å; A154-L169 PolarHBondContact N-O 3.01Å; A154-L169 PolarHBondContact O-N 2.93Å; A154-W309 HydrophobicContact CB-CZ2 4.31Å; A154-T313 HydrophobicContact CB-CG2 3.34Å; A154-F317 HydrophobicContact CB-CE1 4.09Å; A154-F317 HydrophobicContact CB-CE2 4.47Å; A154-F317 HydrophobicContact CB-CZ 3.56Å
155	V	96.3	Very high	93.6	Very high	28 Å²	28	53 Å²	53	17%	0.17	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.6	177.2	-175.6	0	0	0	0	107.6	A106 V109 L123 L153 A168	A106-V155 HydrophobicContact CB-CG1 3.32Å; V109-V155 HydrophobicContact CG2-CG2 3.87Å; L123-V155 HydrophobicContact CD1-CG2 4.02Å; L123-V155 HydrophobicContact CD2-CB 4.2Å; L123-V155 HydrophobicContact CD2-CG2 3.55Å; L123-V155 HydrophobicContact CG-CG2 4.45Å; L153-V155 HydrophobicContact CD1-CG2 4Å; L153-V155 HydrophobicContact CG-CG2 4.45Å; V155-A168 HydrophobicContact CG2-CB 4Å
156	A	94.9	Very high	93.6	Very high	8 Å²	8	51.1 Å²	51.1	7%	0.066	27%	0.266	C	S	.	.			trans	-67.1	-176.9	170.5	0	0	0	0	0	110.8	Y158 Q165 I167 W309	A156-Y158 PolarHBondContact O-N 2.98Å; A156-Q165 HydrophobicContact CB-CB 3.87Å; A156-I167 HydrophobicContact CB-CG2 3.6Å; A156-I167 PolarHBondContact N-O 2.66Å; A156-W309 HydrophobicContact CB-CD2 4.35Å; A156-W309 HydrophobicContact CB-CZ2 4.16Å
157	E	91	Very high	93.6	Very high	158 Å²	158	48.8 Å²	48.8	74%	0.738	26%	0.255	S	S	*	.			trans	-78.6	63.1	179.3	-61.9	-178.8	175.1	0	0	110.4	N159 Q165	E157-N159 PolarHBondContact O-N 3.21Å; E157-Q165 VanDerWaalsContact N-OE1 3.16Å
158	Y	90	Very high	93.7	Very high	19 Å²	19	42.6 Å²	42.6	8%	0.075	23%	0.226	C	C	.	.			trans	-59.2	133.9	-175	179.1	-123.7	0	0	0	111.5	A106 H107 L110 L121 A156 E160 F163 D164 D166	A106-Y158 HydrophobicContact CB-CD1 3.94Å; A106-Y158 HydrophobicContact CB-CD2 3.95Å; A106-Y158 HydrophobicContact CB-CG 3.57Å; H107-Y158 HydrophobicContact CB-CE1 4.02Å; L110-Y158 HydrophobicContact CD1-CD1 4.06Å; L110-Y158 HydrophobicContact CD1-CE1 3.9Å; L121-Y158 HydrophobicContact CD1-CD1 4.23Å; L121-Y158 WeakPolarHBondContact CD1-O 3.47Å; A156-Y158 PolarHBondContact O-N 2.98Å; Y158-E160 HydrophobicContact CD1-CG 4.12Å; Y158-E160 HydrophobicContact CE1-CG 3.68Å; Y158-F163 WeakPolarHBondContact OH-CD1 3.42Å; Y158-D164 WeakPolarHBondContact CA-O 3.49Å; Y158-D164 VanDerWaalsContact CD2-O 3.28Å; Y158-D164 WeakPolarHBondContact CD2-O 3.28Å; Y158-D166 VanDerWaalsContact CD2-CA 3.49Å; Y158-D166 HydrophobicContact CD2-CB 3.73Å; Y158-D166 HydrophobicContact CE2-CB 3.48Å; Y158-D166 VanDerWaalsContact CE2-CB 3.48Å; Y158-D166 VanDerWaalsContact CE2-CG 3.5Å
159	N	86.3	Confident	93.7	Very high	74 Å²	74	42.6 Å²	42.6	40%	0.396	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-115.9	107.8	177.3	-175.9	-32.8	0	0	0	110.1	E157 T161 S162 F163 D164	E157-N159 PolarHBondContact O-N 3.21Å; N159-T161 PolarHBondContact O-N 2.9Å; N159-T161 VanDerWaalsContact O-N 3.09Å; N159-T161 WeakPolarHBondContact OD1-CA 3.13Å; N159-T161 VanDerWaalsContact OD1-CB 3.31Å; N159-T161 WeakPolarHBondContact OD1-CB 3.24Å; N159-T161 PolarHBondContact OD1-N 3.02Å; N159-S162 WeakPolarHBondContact CB-OG 3.29Å; N159-S162 VanDerWaalsContact CG-OG 3.3Å; N159-S162 PolarHBondContact O-N 2.85Å; N159-S162 PolarHBondContact OD1-N 3.2Å; N159-F163 VanDerWaalsContact O-CA 3.27Å; N159-F163 WeakPolarHBondContact O-CA 3.3Å; N159-F163 PolarHBondContact O-N 2.79Å; N159-D164 PolarHBondContact N-O 2.86Å
160	E	83.2	Confident	93.7	Very high	92 Å²	92	41.1 Å²	41.1	43%	0.43	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.1	-179.3	-66.6	-176.5	92.3	0	0	114.3	H115 L121 Y158	H115-E160 VanDerWaalsContact CB-OE2 3.28Å; H115-E160 WeakPolarHBondContact CB-OE2 3.29Å; H115-E160 IonicContact CD2-OE1 3.19Å; H115-E160 PolarHBondContact CD2-OE1 2.7Å; H115-E160 IonicContact CD2-OE2 3.74Å; H115-E160 PolarHBondContact CD2-OE2 3.46Å; H115-E160 IonicContact CG-OE2 3.39Å; L121-E160 HydrophobicContact CD2-CG 4.1Å; Y158-E160 HydrophobicContact CD1-CG 4.12Å; Y158-E160 HydrophobicContact CE1-CG 3.68Å
161	T	84.8	Confident	93.7	Very high	110 Å²	110	42.7 Å²	42.7	68%	0.675	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-40.4	177.9	-53.9	0	0	0	0	112	N159	N159-T161 PolarHBondContact O-N 2.9Å; N159-T161 VanDerWaalsContact O-N 3.09Å; N159-T161 WeakPolarHBondContact OD1-CA 3.13Å; N159-T161 VanDerWaalsContact OD1-CB 3.31Å; N159-T161 WeakPolarHBondContact OD1-CB 3.24Å; N159-T161 PolarHBondContact OD1-N 3.02Å
162	S	86.9	Confident	93.7	Very high	28 Å²	28	39.6 Å²	39.6	20%	0.196	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-7.8	-178	61.8	0	0	0	0	114	N159 D164	N159-S162 WeakPolarHBondContact CB-OG 3.29Å; N159-S162 VanDerWaalsContact CG-OG 3.3Å; N159-S162 PolarHBondContact O-N 2.85Å; N159-S162 PolarHBondContact OD1-N 3.2Å; S162-D164 PolarHBondContact O-N 2.94Å; S162-D164 VanDerWaalsContact O-N 3.12Å; S162-D164 WeakPolarHBondContact OG-CB 3.46Å; S162-D164 PolarHBondContact OG-N 2.82Å
163	F	88.7	Confident	93.7	Very high	67 Å²	67	40.1 Å²	40.1	29%	0.294	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	16.4	-170.3	-55.2	-86.7	0	0	0	114	Y158 N159 L242 M248 F285	Y158-F163 WeakPolarHBondContact OH-CD1 3.42Å; N159-F163 VanDerWaalsContact O-CA 3.27Å; N159-F163 WeakPolarHBondContact O-CA 3.3Å; N159-F163 PolarHBondContact O-N 2.79Å; F163-L242 HydrophobicContact CD2-CD1 4.11Å; F163-L242 HydrophobicContact CD2-CD2 4.28Å; F163-L242 HydrophobicContact CE2-CD1 4.03Å; F163-L242 HydrophobicContact CE2-CD2 4.49Å; F163-M248 WeakPolarHBondContact O-CE 3.39Å; F163-F285 HydrophobicContact CB-CD1 3.61Å; F163-F285 HydrophobicContact CB-CE1 3.58Å; F163-F285 HydrophobicContact CD1-CD1 4.44Å; F163-F285 AromaticContact CG-CD1 3.96Å; F163-F285 HydrophobicContact CG-CD1 3.96Å; F163-F285 HydrophobicContact CG-CE1 4.21Å
164	D	92	Very high	93.7	Very high	26 Å²	26	43.9 Å²	43.9	14%	0.139	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-75.8	149.7	-180	-162.9	19.3	0	0	0	111.2	Y158 N159 S162 D166 Q244 S247 M248 Y306	Y158-D164 WeakPolarHBondContact CA-O 3.49Å; Y158-D164 VanDerWaalsContact CD2-O 3.28Å; Y158-D164 WeakPolarHBondContact CD2-O 3.28Å; N159-D164 PolarHBondContact N-O 2.86Å; S162-D164 PolarHBondContact O-N 2.94Å; S162-D164 VanDerWaalsContact O-N 3.12Å; S162-D164 WeakPolarHBondContact OG-CB 3.46Å; S162-D164 PolarHBondContact OG-N 2.82Å; D164-D166 PolarHBondContact O-N 3.42Å; D164-Q244 PolarHBondContact OD2-NE2 3.43Å; D164-S247 WeakPolarHBondContact OD1-CB 3.17Å; D164-S247 PolarHBondContact OD1-OG 3.46Å; D164-M248 HydrophobicContact CB-CE 4.48Å; D164-Y306 PolarHBondContact OD1-OH 3.45Å
165	Q	94.7	Very high	93.6	Very high	51 Å²	51	47.9 Å²	47.9	24%	0.238	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	37	-178.2	-45.8	-170.7	47.1	0	0	113.4	A156 E157 I167 Y306	A156-Q165 HydrophobicContact CB-CB 3.87Å; E157-Q165 VanDerWaalsContact N-OE1 3.16Å; Q165-I167 PolarHBondContact O-N 2.96Å; Q165-Y306 WeakPolarHBondContact CA-OH 3.45Å; Q165-Y306 HydrophobicContact CB-CE1 4.07Å; Q165-Y306 HydrophobicContact CG-CE1 3.95Å; Q165-Y306 WeakPolarHBondContact CG-OH 3.42Å; Q165-Y306 PolarHBondContact N-OH 3.26Å; Q165-Y306 VanDerWaalsContact N-OH 3.13Å
166	D	96.6	Very high	93.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.			trans	-77.9	66.9	176.2	-163.7	11.3	0	0	0	111.4	A106 H107 Y158 D164 S284 S301	A106-D166 WeakPolarHBondContact CA-OD1 3.24Å; A106-D166 VanDerWaalsContact CB-OD1 3.26Å; A106-D166 WeakPolarHBondContact CB-OD1 3.28Å; A106-D166 PolarHBondContact N-OD1 2.95Å; H107-D166 IonicContact CE1-OD2 3.49Å; H107-D166 PolarHBondContact CE1-OD2 3.02Å; H107-D166 IonicContact CG-OD1 3.45Å; H107-D166 IonicContact CG-OD2 3.88Å; H107-D166 PolarHBondContact N-OD1 3.23Å; H107-D166 IonicContact ND1-OD1 2.63Å; H107-D166 PolarHBondContact ND1-OD1 2.6Å; H107-D166 IonicContact ND1-OD2 2.74Å; H107-D166 PolarHBondContact ND1-OD2 3.2Å; Y158-D166 VanDerWaalsContact CD2-CA 3.49Å; Y158-D166 HydrophobicContact CD2-CB 3.73Å; Y158-D166 HydrophobicContact CE2-CB 3.48Å; Y158-D166 VanDerWaalsContact CE2-CB 3.48Å; Y158-D166 VanDerWaalsContact CE2-CG 3.5Å; D164-D166 PolarHBondContact O-N 3.42Å; D166-S284 VanDerWaalsContact CB-OG 3.27Å; D166-S284 WeakPolarHBondContact CB-OG 3.44Å; D166-S284 WeakPolarHBondContact OD2-CA 3.18Å; D166-S284 VanDerWaalsContact OD2-CB 3.32Å; D166-S284 WeakPolarHBondContact OD2-CB 3.06Å; D166-S284 PolarHBondContact OD2-OG 2.8Å; D166-S301 VanDerWaalsContact C-OG 3.24Å; D166-S301 PolarHBondContact O-OG 3.38Å
167	I	98.2	Very high	93.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.251	C	S	.	.			trans	-143.4	138.5	179.9	-166.8	170.5	0	0	0	111	L103 A156 Q165 V282 Y306 W309 I310	L103-I167 HydrophobicContact CD2-CD1 4.15Å; L103-I167 HydrophobicContact CD2-CG1 4.21Å; A156-I167 HydrophobicContact CB-CG2 3.6Å; A156-I167 PolarHBondContact N-O 2.66Å; Q165-I167 PolarHBondContact O-N 2.96Å; I167-V282 HydrophobicContact CD1-CG2 4.33Å; I167-V282 HydrophobicContact CG1-CG2 4.48Å; I167-Y306 HydrophobicContact CD1-CD2 4.28Å; I167-Y306 HydrophobicContact CD1-CG 4.23Å; I167-Y306 HydrophobicContact CG2-CD1 3.88Å; I167-Y306 HydrophobicContact CG2-CD2 4.21Å; I167-Y306 HydrophobicContact CG2-CE1 4.2Å; I167-Y306 HydrophobicContact CG2-CG 3.91Å; I167-W309 HydrophobicContact CD1-CZ3 4.4Å; I167-W309 HydrophobicContact CG1-CZ3 4.17Å; I167-W309 HydrophobicContact CG2-CE3 4.21Å; I167-W309 HydrophobicContact CG2-CH2 4.44Å; I167-W309 HydrophobicContact CG2-CZ3 3.99Å; I167-I310 HydrophobicContact CD1-CD1 4.26Å
168	A	98.4	Very high	93.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.7	176.8	0	0	0	0	0	111	L103 T104 V109 L153 A154 V155	L103-A168 WeakPolarHBondContact CA-O 3.2Å; T104-A168 HydrophobicContact CG2-CB 4.09Å; T104-A168 PolarHBondContact N-O 3.28Å; T104-A168 PolarHBondContact O-N 3.03Å; V109-A168 HydrophobicContact CG2-CB 3.62Å; L153-A168 HydrophobicContact CD1-CB 4.36Å; A154-A168 CarbonylContact O-C 3.53Å; A154-A168 VanDerWaalsContact O-CA 3.28Å; A154-A168 WeakPolarHBondContact O-CA 3.29Å; V155-A168 HydrophobicContact CG2-CB 4Å
169	L	98.6	Very high	94	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	126.2	175.7	-175.1	75.9	0	0	0	109.4	I91 F101 L103 A154 W309 T313 I314 F317	I91-L169 HydrophobicContact CD1-CD1 4.03Å; F101-L169 HydrophobicContact CB-CD1 4.2Å; F101-L169 HydrophobicContact CD1-CD2 4.43Å; L103-L169 HydrophobicContact CD2-CB 4.28Å; L103-L169 HydrophobicContact CD2-CD1 3.6Å; L103-L169 HydrophobicContact CG-CD1 4.21Å; A154-L169 PolarHBondContact N-O 3.01Å; A154-L169 PolarHBondContact O-N 2.93Å; L169-W309 HydrophobicContact CB-CH2 3.9Å; L169-W309 HydrophobicContact CB-CZ3 4.25Å; L169-T313 HydrophobicContact CB-CG2 4.42Å; L169-T313 HydrophobicContact CD2-CG2 3.68Å; L169-I314 HydrophobicContact CD2-CD1 4.42Å; L169-I314 HydrophobicContact CD2-CG1 3.53Å; L169-F317 HydrophobicContact CD2-CD2 4.07Å; L169-F317 HydrophobicContact CD2-CE2 3.87Å; L169-F317 HydrophobicContact CG-CE2 4.2Å
170	L	98.6	Very high	94.4	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134	176.6	-46.6	-178.6	0	0	0	109.3	V75 F101 V102 T104 V109 V131 V150 L153	V75-L170 HydrophobicContact CG1-CD1 4.07Å; V75-L170 HydrophobicContact CG2-CD1 4.19Å; F101-L170 WeakPolarHBondContact CA-O 3.41Å; V102-L170 HydrophobicContact CB-CB 4.29Å; V102-L170 HydrophobicContact CG1-CD1 4.42Å; V102-L170 PolarHBondContact N-O 3.24Å; V102-L170 PolarHBondContact O-N 3.25Å; T104-L170 HydrophobicContact CG2-CD1 4.08Å; T104-L170 HydrophobicContact CG2-CG 4.26Å; V109-L170 HydrophobicContact CG1-CD2 4.16Å; V131-L170 HydrophobicContact CG2-CD1 3.89Å; V150-L170 HydrophobicContact CG1-CB 4.07Å; V150-L170 HydrophobicContact CG1-CD2 4.31Å; V150-L170 HydrophobicContact CG2-CB 4.38Å; V150-L170 HydrophobicContact CG2-CD1 4.3Å; L153-L170 HydrophobicContact CD1-CD2 3.37Å; L153-L170 HydrophobicContact CG-CD2 4.48Å
171	M	98.4	Very high	95	Very high	39 Å²	39	44.9 Å²	44.9	19%	0.192	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.8	165.3	-170.8	-179	-178.5	0	0	109.2	S100 F101 V150 V151 K152 F317	S100-M171 CarbonylContact O-C 3.58Å; S100-M171 WeakPolarHBondContact O-CA 3.35Å; F101-M171 HydrophobicContact CD1-CB 4.32Å; F101-M171 HydrophobicContact CD1-CG 4.35Å; F101-M171 HydrophobicContact CE1-CB 4.13Å; F101-M171 HydrophobicContact CE1-CG 3.84Å; F101-M171 HydrophobicContact CE1-SD 4.36Å; V150-M171 CarbonylContact C-O 3.57Å; V150-M171 WeakPolarHBondContact CA-O 3.32Å; V151-M171 HydrophobicContact CG2-CB 4.26Å; V151-M171 HydrophobicContact CG2-CG 4.04Å; V151-M171 WeakPolarHBondContact CG2-O 3.36Å; V151-M171 HydrophobicContact CG2-SD 4.29Å; V151-M171 PolarHBondContact N-O 2.79Å; K152-M171 HydrophobicContact CB-CB 3.86Å; K152-M171 HydrophobicContact CB-SD 4.47Å; K152-M171 HydrophobicContact CD-SD 3.82Å; K152-M171 HydrophobicContact CG-CB 4.47Å; K152-M171 HydrophobicContact CG-SD 4.16Å; K152-M171 PolarHBondContact N-O 2.88Å; K152-M171 PolarHBondContact O-N 3.04Å; M171-F317 HydrophobicContact CB-CD2 3.81Å; M171-F317 HydrophobicContact CB-CE2 4.1Å; M171-F317 HydrophobicContact SD-CB 3.91Å; M171-F317 HydrophobicContact SD-CD2 4.44Å; M171-F317 HydrophobicContact SD-CG 4.41Å
172	L	98.4	Very high	95.5	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	153.3	178.3	-56.8	171.2	0	0	0	110.7	F90 S100 V102 V131 L133 L148 V151 K174 V176	F90-L172 HydrophobicContact CD2-CD1 4.22Å; F90-L172 HydrophobicContact CE2-CD1 3.91Å; S100-L172 WeakPolarHBondContact O-CB 3.36Å; S100-L172 WeakPolarHBondContact O-CG 3.19Å; S100-L172 PolarHBondContact O-N 3.14Å; V102-L172 HydrophobicContact CG2-CD1 4.14Å; V102-L172 HydrophobicContact CG2-CD2 4.29Å; V102-L172 HydrophobicContact CG2-CG 4.41Å; V131-L172 HydrophobicContact CB-CD2 3.67Å; V131-L172 HydrophobicContact CG1-CD2 3.97Å; V131-L172 HydrophobicContact CG2-CD2 3.77Å; L133-L172 HydrophobicContact CD1-CD1 4.24Å; L148-L172 HydrophobicContact CB-CD2 4.1Å; L148-L172 HydrophobicContact CD1-CD1 4.11Å; V151-L172 WeakPolarHBondContact CG2-O 3.34Å; L172-K174 PolarHBondContact O-N 2.82Å; L172-K174 VanDerWaalsContact O-N 3.16Å; L172-V176 HydrophobicContact CD1-CG2 4.3Å
173	E	97.8	Very high	96	Very high	93 Å²	93	39.4 Å²	39.4	44%	0.435	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	-23	-178.4	71.5	-169.6	162.5	0	0	114.7	L148 S149 V151	L148-E173 HydrophobicContact CD2-CG 4.38Å; S149-E173 WeakPolarHBondContact CB-OE2 3.48Å; S149-E173 PolarHBondContact N-OE1 3.46Å; S149-E173 PolarHBondContact O-N 2.78Å; S149-E173 PolarHBondContact OG-OE2 3.38Å; V151-E173 HydrophobicContact CG1-CB 3.71Å
174	K	96.2	Very high	96.4	Very high	109 Å²	109	36.2 Å²	36.2	47%	0.474	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.8	177.3	64.5	180	-179	179.8	0	110.9	L148 L172	L148-K174 HydrophobicContact CD2-CD 4.08Å; L148-K174 HydrophobicContact CD2-CG 3.61Å; L172-K174 PolarHBondContact O-N 2.82Å; L172-K174 VanDerWaalsContact O-N 3.16Å
175	E	95.4	Very high	96.6	Very high	102 Å²	102	35 Å²	35	48%	0.477	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	130.3	167.9	-160.5	-179.5	71.8	0	0	109	K96 A98	K96-E175 IonicContact NZ-OE2 3.4Å; A98-E175 HydrophobicContact CB-CG 3.64Å
176	V	96	Very high	96.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	114.3	179.7	-179.6	0	0	0	0	108.2	F90 A98 S99 L133 L148 L172 I182	F90-V176 HydrophobicContact CE1-CB 4.5Å; F90-V176 HydrophobicContact CZ-CB 3.84Å; F90-V176 HydrophobicContact CZ-CG1 4.38Å; A98-V176 WeakPolarHBondContact CA-O 3.45Å; A98-V176 WeakPolarHBondContact CB-O 3.38Å; S99-V176 PolarHBondContact N-O 2.8Å; S99-V176 VanDerWaalsContact N-O 3.1Å; S99-V176 PolarHBondContact O-N 3.43Å; L133-V176 HydrophobicContact CD1-CG1 4.29Å; L133-V176 HydrophobicContact CD1-CG2 4.25Å; L148-V176 HydrophobicContact CD1-CG2 3.69Å; L148-V176 HydrophobicContact CD2-CG2 3.97Å; L172-V176 HydrophobicContact CD1-CG2 4.3Å; V176-I182 HydrophobicContact CG1-CG2 3.88Å
177	T	95	Very high	96.8	Very high	82 Å²	82	34.9 Å²	34.9	50%	0.503	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	138.1	174.7	-50.8	0	0	0	0	110.3
178	Y	95.1	Very high	96.7	Very high	31 Å²	31	35.1 Å²	35.1	12%	0.122	17%	0.172	C	C	.	.			trans	-68.8	144.9	179.2	-58.6	-16.9	0	0	0	111.9	F90 H92 N97 I182 Q183	F90-Y178 HydrophobicContact CD1-CE1 4.37Å; F90-Y178 AromaticContact CE1-CD1 3.93Å; F90-Y178 HydrophobicContact CE1-CD1 3.93Å; F90-Y178 AromaticContact CE1-CE1 3.48Å; F90-Y178 HydrophobicContact CE1-CE1 3.48Å; F90-Y178 VanDerWaalsContact CE1-CE1 3.48Å; F90-Y178 HydrophobicContact CZ-CE1 4Å; H92-Y178 VanDerWaalsContact CA-OH 3.3Å; H92-Y178 WeakPolarHBondContact CA-OH 3.2Å; H92-Y178 AromaticContact ND1-CE2 3.39Å; H92-Y178 WeakPolarHBondContact ND1-CE2 3.14Å; H92-Y178 AromaticContact ND1-CZ 3.54Å; H92-Y178 PolarHBondContact ND1-OH 3.06Å; N97-Y178 PolarHBondContact O-N 2.88Å; Y178-I182 CarbonylContact C-O 3.36Å; Y178-I182 VanDerWaalsContact CA-O 3.23Å; Y178-I182 WeakPolarHBondContact CA-O 3.17Å; Y178-Q183 HydrophobicContact CD2-CG 4.1Å; Y178-Q183 HydrophobicContact CG-CG 4.26Å
179	N	94.2	Very high	96.5	Very high	64 Å²	64	41.8 Å²	41.8	34%	0.342	20%	0.203	S	C	.	.			trans	-146.1	-171.9	173.4	64.1	40.8	0	0	0	109	Y181 I182	N179-Y181 PolarHBondContact O-N 2.91Å; N179-Y181 VanDerWaalsContact O-N 3.14Å; N179-Y181 WeakPolarHBondContact OD1-CA 3.49Å; N179-Y181 PolarHBondContact OD1-N 3.42Å; N179-I182 PolarHBondContact N-O 2.8Å; N179-I182 PolarHBondContact OD1-N 2.84Å
180	D	94.7	Very high	96.4	Very high	68 Å²	68	47 Å²	47	36%	0.364	23%	0.227	S	C	.	.	S	Bend	trans	-64.7	-18.3	-175.4	-56.1	-18.9	0	0	0	113.6	V43 F44	V43-D180 HydrophobicContact CB-CB 4.43Å; V43-D180 HydrophobicContact CG2-CB 4.23Å; F44-D180 HydrophobicContact CE2-CB 4.02Å; F44-D180 WeakPolarHBondContact CE2-O 3.13Å
181	Y	95.7	Very high	96.2	Very high	69 Å²	69	51.7 Å²	51.7	27%	0.271	25%	0.252	S	S	.	.	S	Bend	trans	-113.5	-21.6	-173.3	-41.9	-66.7	0	0	0	113.6	F44 Y67 P70 E144 N179	F44-Y181 AromaticContact CE2-CD1 3.84Å; F44-Y181 HydrophobicContact CE2-CD1 3.84Å; F44-Y181 AromaticContact CE2-CE1 3.76Å; F44-Y181 HydrophobicContact CE2-CE1 3.76Å; F44-Y181 HydrophobicContact CZ-CD1 4.45Å; F44-Y181 AromaticContact CZ-CE1 3.92Å; F44-Y181 HydrophobicContact CZ-CE1 3.92Å; Y67-Y181 AromaticContact CD1-CD1 3.8Å; Y67-Y181 HydrophobicContact CD1-CD1 3.8Å; Y67-Y181 HydrophobicContact CD1-CG 4.32Å; Y67-Y181 AromaticContact CD2-CD1 3.61Å; Y67-Y181 HydrophobicContact CD2-CD1 3.61Å; Y67-Y181 AromaticContact CD2-CE1 3.87Å; Y67-Y181 HydrophobicContact CD2-CE1 3.87Å; Y67-Y181 HydrophobicContact CE1-CD1 4.07Å; Y67-Y181 HydrophobicContact CE1-CG 4.5Å; Y67-Y181 AromaticContact CE2-CD1 3.9Å; Y67-Y181 HydrophobicContact CE2-CD1 3.9Å; Y67-Y181 AromaticContact CE2-CE1 3.93Å; Y67-Y181 HydrophobicContact CE2-CE1 3.93Å; Y67-Y181 AromaticContact CG-CD1 3.54Å; Y67-Y181 HydrophobicContact CG-CD1 3.54Å; Y67-Y181 HydrophobicContact CG-CE1 4.28Å; Y67-Y181 HydrophobicContact CG-CG 4.45Å; P70-Y181 WeakPolarHBondContact CA-O 3.4Å; P70-Y181 VanDerWaalsContact CB-O 3.24Å; P70-Y181 WeakPolarHBondContact CB-O 3.44Å; E144-Y181 HydrophobicContact CB-CD2 3.87Å; E144-Y181 HydrophobicContact CB-CE2 4.4Å; E144-Y181 HydrophobicContact CB-CG 3.95Å; E144-Y181 HydrophobicContact CG-CD1 4.08Å; E144-Y181 HydrophobicContact CG-CD2 3.52Å; E144-Y181 HydrophobicContact CG-CE1 4.12Å; E144-Y181 HydrophobicContact CG-CE2 3.55Å; E144-Y181 HydrophobicContact CG-CG 3.78Å; N179-Y181 PolarHBondContact O-N 2.91Å; N179-Y181 VanDerWaalsContact O-N 3.14Å; N179-Y181 WeakPolarHBondContact OD1-CA 3.49Å; N179-Y181 PolarHBondContact OD1-N 3.42Å
182	I	96.8	Very high	96	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.25	C	S	.	.			trans	-131.9	116.5	-177.5	-57.6	172	0	0	0	109.2	P70 F90 L133 Q146 V176 Y178 N179	P70-I182 WeakPolarHBondContact O-CA 3.47Å; F90-I182 HydrophobicContact CD1-CG2 4.02Å; F90-I182 HydrophobicContact CE1-CG2 3.91Å; L133-I182 HydrophobicContact CB-CD1 3.85Å; L133-I182 HydrophobicContact CB-CG1 4.08Å; L133-I182 HydrophobicContact CB-CG2 4Å; L133-I182 HydrophobicContact CD1-CG2 3.88Å; Q146-I182 HydrophobicContact CB-CD1 4.12Å; Q146-I182 HydrophobicContact CG-CD1 3.81Å; V176-I182 HydrophobicContact CG1-CG2 3.88Å; Y178-I182 CarbonylContact C-O 3.36Å; Y178-I182 VanDerWaalsContact CA-O 3.23Å; Y178-I182 WeakPolarHBondContact CA-O 3.17Å; N179-I182 PolarHBondContact N-O 2.8Å; N179-I182 PolarHBondContact OD1-N 2.84Å
183	Q	96	Very high	95.8	Very high	24 Å²	24	57.1 Å²	57.1	11%	0.112	28%	0.277	C	S	.	.			trans	-154.7	144.2	-177.1	-174.7	-173.5	30.2	0	0	110.1	I38 R41 P70 W71 Y178	I38-Q183 PolarHBondContact O-NE2 3.35Å; R41-Q183 VanDerWaalsContact C-OE1 3.3Å; R41-Q183 PolarHBondContact O-NE2 3.44Å; R41-Q183 VanDerWaalsContact O-NE2 3.16Å; R41-Q183 PolarHBondContact O-OE1 3.22Å; P70-Q183 CarbonylContact C-O 3.56Å; P70-Q183 HydrophobicContact CB-CB 3.94Å; P70-Q183 HydrophobicContact CG-CB 3.84Å; P70-Q183 PolarHBondContact O-N 3.1Å; W71-Q183 WeakPolarHBondContact CA-O 3.32Å; W71-Q183 VanDerWaalsContact CB-O 3.29Å; W71-Q183 WeakPolarHBondContact CB-O 3.17Å; W71-Q183 PolarHBondContact N-O 2.95Å; Y178-Q183 HydrophobicContact CD2-CG 4.1Å; Y178-Q183 HydrophobicContact CG-CG 4.26Å
184	G	97.1	Very high	95.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-72.5	141.1	177.5	0	0	0	0	0	113.5	C39 G40 F90	C39-G184 VanDerWaalsContact CA-O 3.29Å; C39-G184 WeakPolarHBondContact CA-O 3.46Å; C39-G184 WeakPolarHBondContact CB-O 3.26Å; G40-G184 PolarHBondContact N-O 3.02Å; F90-G184 CarbonylContact O-C 3.55Å; F90-G184 VanDerWaalsContact O-CA 3.24Å; F90-G184 WeakPolarHBondContact O-CA 3.32Å
185	I	97.7	Very high	95.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-75.8	149.6	166.6	-167.6	164.8	0	0	0	110.7	W71 F90 I91 H92 A270 F277 L279	W71-I185 HydrophobicContact CB-CB 3.75Å; W71-I185 HydrophobicContact CB-CG2 4.18Å; W71-I185 HydrophobicContact CD2-CB 3.85Å; W71-I185 HydrophobicContact CD2-CD1 4.13Å; W71-I185 HydrophobicContact CD2-CG1 4.17Å; W71-I185 HydrophobicContact CE3-CB 4.23Å; W71-I185 HydrophobicContact CG-CB 3.64Å; W71-I185 HydrophobicContact CG-CD1 4.23Å; W71-I185 HydrophobicContact CG-CG1 4.33Å; W71-I185 HydrophobicContact CG-CG2 4.33Å; W71-I185 HydrophobicContact CZ2-CD1 4.34Å; F90-I185 PolarHBondContact O-N 3.37Å; I91-I185 HydrophobicContact CG2-CG2 4.35Å; H92-I185 WeakPolarHBondContact CB-O 3.36Å; H92-I185 PolarHBondContact N-O 2.95Å; I185-A270 HydrophobicContact CD1-CB 3.58Å; I185-F277 HydrophobicContact CD1-CB 4.4Å; I185-F277 HydrophobicContact CG1-CB 4.45Å; I185-F277 WeakPolarHBondContact CG1-O 3.32Å; I185-L279 HydrophobicContact CD1-CB 3.86Å; I185-L279 HydrophobicContact CD1-CD1 4.27Å; I185-L279 HydrophobicContact CG1-CB 4.11Å; I185-L279 HydrophobicContact CG2-CB 3.78Å; I185-L279 HydrophobicContact CG2-CD2 4.18Å; I185-L279 HydrophobicContact CG2-CG 4.39Å
186	C	96.7	Very high	94.9	Very high	12 Å²	12	45.9 Å²	45.9	8%	0.081	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-69.3	149.1	174.6	-59.5	0	0	0	0	111.4	C39 F277 T278 L279	C39-C186 HydrophobicContact CB-CB 4Å; C39-C186 WeakPolarHBondContact CB-SG 3.46Å; C39-C186 PolarHBondContact O-SG 3.28Å; C39-C186 WeakPolarHBondContact SG-CA 3.09Å; C39-C186 WeakPolarHBondContact SG-CB 3.44Å; C39-C186 CovalentContact SG-SG 2.04Å; C39-C186 PolarHBondContact SG-SG 3.22Å; C186-F277 WeakPolarHBondContact CB-O 3.13Å; C186-F277 PolarHBondContact N-O 3.35Å; C186-T278 WeakPolarHBondContact O-CA 3.28Å; C186-L279 PolarHBondContact O-N 3.06Å
187	L	96.8	Very high	94.2	Very high	37 Å²	37	50.1 Å²	50.1	19%	0.194	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-95	144.6	168.5	-66	176.5	0	0	0	110	I91 W93 L103 L279 V303 L307	I91-L187 HydrophobicContact CB-CD2 4.24Å; I91-L187 HydrophobicContact CD1-CD1 4.32Å; I91-L187 HydrophobicContact CG2-CD2 3.96Å; W93-L187 HydrophobicContact CE3-CD1 4.06Å; W93-L187 HydrophobicContact CZ3-CD1 4.17Å; L103-L187 HydrophobicContact CD1-CD2 4.25Å; L187-L279 HydrophobicContact CD2-CD2 4.41Å; L187-V303 HydrophobicContact CD2-CG1 3.98Å; L187-L307 HydrophobicContact CB-CD1 4.29Å; L187-L307 HydrophobicContact CD1-CD1 4.04Å
188	P	96.4	Very high	93.6	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.032	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-70.4	167.2	173.4	31.2	-35.7	0	0	0	110.7	E192 T278 L279 Y280 V303 L307	P188-E192 HydrophobicContact CB-CB 4.31Å; P188-T278 HydrophobicContact CB-CG2 3.84Å; P188-T278 HydrophobicContact CG-CG2 4.39Å; P188-L279 WeakPolarHBondContact CD-O 3.33Å; P188-Y280 HydrophobicContact CB-CD1 4.2Å; P188-Y280 HydrophobicContact CB-CE1 3.89Å; P188-V303 HydrophobicContact CG-CB 4.24Å; P188-V303 HydrophobicContact CG-CG1 4.01Å; P188-L307 WeakPolarHBondContact O-CD2 3.34Å
189	H	95.6	Very high	93.2	Very high	140 Å²	140	53.2 Å²	53.2	65%	0.648	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-70.8	159.6	168.3	-62.8	-68.2	0	0	0	111.5	N191 E192 S304	H189-N191 PolarHBondContact O-N 3.29Å; H189-E192 HydrophobicContact CB-CB 4.14Å; H189-E192 IonicContact CD2-OE2 2.91Å; H189-E192 PolarHBondContact CD2-OE2 3.2Å; H189-E192 VanDerWaalsContact CD2-OE2 3.26Å; H189-E192 IonicContact CG-OE2 3.01Å; H189-E192 PolarHBondContact N-OE2 2.56Å; H189-E192 WeakPolarHBondContact O-CB 3.28Å; H189-E192 PolarHBondContact O-N 3.11Å; H189-E192 VanDerWaalsContact O-N 3.13Å; H189-S304 VanDerWaalsContact O-CB 3.24Å; H189-S304 WeakPolarHBondContact O-CB 3.13Å
190	E	96.1	Very high	93	Very high	108 Å²	108	52.6 Å²	52.6	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	131.2	177.2	-168.4	-176.3	152.1	0	0	110.4	E192 L307 P308	E190-E192 PolarHBondContact O-N 3.38Å; E190-E192 VanDerWaalsContact O-N 3.07Å; E190-L307 HydrophobicContact CB-CD2 4.02Å; E190-P308 VanDerWaalsContact CD-CG 3.48Å; E190-P308 HydrophobicContact CG-CG 3.85Å; E190-P308 WeakPolarHBondContact OE1-CG 3.14Å
191	N	93.7	Very high	93	Very high	99 Å²	99	49.3 Å²	49.3	53%	0.529	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	17.9	-177.1	-53.4	-53	0	0	0	114.9	H189 E193 S304	H189-N191 PolarHBondContact O-N 3.29Å; N191-E193 PolarHBondContact O-N 3Å; N191-S304 PolarHBondContact N-O 2.96Å
192	E	95.2	Very high	92.8	Very high	32 Å²	32	46.1 Å²	46.1	15%	0.15	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.6	127.9	170.2	-170.6	-175.7	144.9	0	0	110.1	P188 H189 E190 K273 Y280 S304	P188-E192 HydrophobicContact CB-CB 4.31Å; H189-E192 HydrophobicContact CB-CB 4.14Å; H189-E192 IonicContact CD2-OE2 2.91Å; H189-E192 PolarHBondContact CD2-OE2 3.2Å; H189-E192 VanDerWaalsContact CD2-OE2 3.26Å; H189-E192 IonicContact CG-OE2 3.01Å; H189-E192 PolarHBondContact N-OE2 2.56Å; H189-E192 WeakPolarHBondContact O-CB 3.28Å; H189-E192 PolarHBondContact O-N 3.11Å; H189-E192 VanDerWaalsContact O-N 3.13Å; E190-E192 PolarHBondContact O-N 3.38Å; E190-E192 VanDerWaalsContact O-N 3.07Å; E192-K273 IonicContact OE1-NZ 3.2Å; E192-K273 PolarHBondContact OE1-NZ 2.89Å; E192-K273 IonicContact OE2-NZ 3.9Å; E192-K273 PolarHBondContact OE2-NZ 2.7Å; E192-Y280 HydrophobicContact CG-CE1 4.36Å; E192-Y280 PolarHBondContact OE1-OH 3.02Å; E192-S304 WeakPolarHBondContact O-CB 3.28Å; E192-S304 PolarHBondContact O-OG 2.73Å
193	E	94.3	Very high	92.6	Very high	123 Å²	123	46.4 Å²	46.4	58%	0.575	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-73.6	143.8	175	-73.3	-57.8	136.6	0	0	111.2	N191 K302	N191-E193 PolarHBondContact O-N 3Å; E193-K302 VanDerWaalsContact CD-NZ 3.28Å; E193-K302 IonicContact OE1-NZ 2.86Å; E193-K302 PolarHBondContact OE1-NZ 3.46Å; E193-K302 IonicContact OE2-NZ 3.58Å; E193-K302 PolarHBondContact OE2-NZ 3.41Å
194	P	93.1	Very high	92.4	Very high	20 Å²	20	45.3 Å²	45.3	13%	0.13	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-57.3	151.7	172.7	-19.7	31.3	0	0	0	111.4	V233 V249 Y280	P194-V233 HydrophobicContact CB-CG1 4.12Å; P194-V233 HydrophobicContact CB-CG2 4.3Å; P194-V249 HydrophobicContact CB-CG1 4.25Å; P194-V249 HydrophobicContact CG-CB 4.34Å; P194-V249 HydrophobicContact CG-CG1 3.86Å; P194-V249 HydrophobicContact CG-CG2 3.5Å; P194-Y280 HydrophobicContact CB-CD1 4.03Å; P194-Y280 HydrophobicContact CB-CG 4.32Å; P194-Y280 HydrophobicContact CG-CD1 4.3Å
195	P	91.6	Very high	92.2	Very high	21 Å²	21	45.3 Å²	45.3	14%	0.136	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-67	159.7	179.4	31.7	-36.4	0	0	0	111.1	S199 V233 C271 Y280	P195-S199 WeakPolarHBondContact CB-OG 3.44Å; P195-V233 WeakPolarHBondContact O-CB 3.02Å; P195-C271 HydrophobicContact CG-CB 3.58Å; P195-Y280 HydrophobicContact CG-CE2 4.21Å
196	G	85.3	Confident	91.8	Very high	26 Å²	26	45.8 Å²	45.8	27%	0.268	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-66	170.7	-176.4	0	0	0	0	0	113.9	E198 S199	G196-E198 VanDerWaalsContact C-OE2 3.28Å; G196-E198 WeakPolarHBondContact CA-OE2 3.28Å; G196-E198 PolarHBondContact O-N 2.76Å; G196-E198 VanDerWaalsContact O-N 3.1Å; G196-S199 WeakPolarHBondContact O-CB 3.43Å; G196-S199 PolarHBondContact O-N 3.05Å
197	P	81.2	Confident	90.8	Very high	92 Å²	92	45.2 Å²	45.2	60%	0.597	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.8	-177.1	26.3	-35.7	0	0	0	114.3	S199	P197-S199 VanDerWaalsContact C-N 3.31Å
198	E	81.5	Confident	89	Confident	148 Å²	148	43.9 Å²	43.9	69%	0.692	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-17.3	174.7	73.6	-65.5	155.6	0	0	113.9	G196	G196-E198 VanDerWaalsContact C-OE2 3.28Å; G196-E198 WeakPolarHBondContact CA-OE2 3.28Å; G196-E198 PolarHBondContact O-N 2.76Å; G196-E198 VanDerWaalsContact O-N 3.1Å
199	S	87.3	Confident	86.9	Confident	29 Å²	29	45 Å²	45	20%	0.203	24%	0.237	C	C	.	.	S	Bend	trans	-80.2	149	-179.2	-65.9	0	0	0	0	111.4	P195 G196 P197 C201	P195-S199 WeakPolarHBondContact CB-OG 3.44Å; G196-S199 WeakPolarHBondContact O-CB 3.43Å; G196-S199 PolarHBondContact O-N 3.05Å; P197-S199 VanDerWaalsContact C-N 3.31Å; S199-C201 PolarHBondContact O-N 2.73Å; S199-C201 VanDerWaalsContact O-N 3.16Å
200	I	91.1	Very high	84.5	Confident	51 Å²	51	40.8 Å²	40.8	26%	0.262	23%	0.227	S	C	.	.			trans	-78.8	105.9	-179.1	-56.9	-179.2	0	0	0	108.3	L48 V202 C271 L272	L48-I200 HydrophobicContact CD1-CD1 3.85Å; L48-I200 HydrophobicContact CD1-CG2 3.94Å; L48-I200 HydrophobicContact CD2-CG2 3.54Å; L48-I200 HydrophobicContact CG-CG2 4.3Å; I200-V202 HydrophobicContact CG2-CG2 4.09Å; I200-C271 CarbonylContact O-C 3.51Å; I200-C271 VanDerWaalsContact O-CA 3.28Å; I200-C271 WeakPolarHBondContact O-CA 2.94Å; I200-L272 HydrophobicContact CB-CB 4.22Å; I200-L272 HydrophobicContact CD1-CD2 4.41Å; I200-L272 PolarHBondContact O-N 2.84Å
201	C	93.2	Very high	82.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135.3	170.4	-66.7	0	0	0	0	109.8	S199 Q230 V231 L269 A270 C271	S199-C201 PolarHBondContact O-N 2.73Å; S199-C201 VanDerWaalsContact O-N 3.16Å; C201-Q230 CarbonylContact O-C 3.46Å; C201-Q230 WeakPolarHBondContact O-CA 3.5Å; C201-V231 HydrophobicContact CB-CG2 4.3Å; C201-V231 PolarHBondContact O-N 2.7Å; C201-L269 HydrophobicContact CB-CD1 3.92Å; C201-A270 CarbonylContact C-O 3.47Å; C201-A270 WeakPolarHBondContact CA-O 3.28Å; C201-C271 HydrophobicContact CB-CB 4.1Å; C201-C271 WeakPolarHBondContact CB-SG 3.23Å; C201-C271 WeakPolarHBondContact SG-CB 3.42Å; C201-C271 CovalentContact SG-SG 2.04Å; C201-C271 PolarHBondContact SG-SG 3.24Å
202	V	92.4	Very high	79.6	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137	-175.5	-171.5	0	0	0	0	109.5	L48 Y69 I200 T204 E228 L229 A270	L48-V202 HydrophobicContact CD2-CG2 3.79Å; Y69-V202 HydrophobicContact CE1-CB 4.3Å; Y69-V202 HydrophobicContact CE1-CG1 4.01Å; Y69-V202 WeakPolarHBondContact OH-CG1 3.41Å; I200-V202 HydrophobicContact CG2-CG2 4.09Å; V202-T204 HydrophobicContact CG1-CG2 3.99Å; V202-E228 HydrophobicContact CG1-CB 3.9Å; V202-L229 WeakPolarHBondContact CA-O 3.38Å; V202-A270 PolarHBondContact N-O 3.16Å; V202-A270 PolarHBondContact O-N 2.8Å
203	V	91.8	Very high	76.9	Confident	5 Å²	5	44 Å²	44	3%	0.03	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.9	168.7	-174.5	0	0	0	0	108	L229 V231 A260 P268 L269 F300	V203-L229 PolarHBondContact N-O 2.8Å; V203-L229 PolarHBondContact O-N 3.5Å; V203-V231 HydrophobicContact CG2-CG1 4.17Å; V203-V231 HydrophobicContact CG2-CG2 3.77Å; V203-A260 HydrophobicContact CG1-CB 4.04Å; V203-P268 WeakPolarHBondContact CA-O 3.08Å; V203-L269 HydrophobicContact CG2-CD1 3.95Å; V203-F300 HydrophobicContact CG1-CE1 4.4Å; V203-F300 HydrophobicContact CG1-CZ 4.5Å; V203-F300 HydrophobicContact CG2-CE1 3.97Å; V203-F300 HydrophobicContact CG2-CZ 3.6Å
204	T	92.3	Very high	74.1	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	146.6	-179.1	50.8	0	0	0	0	111.6	Y69 Q72 V202 Q227 E228 P268	Y69-T204 HydrophobicContact CD1-CG2 3.83Å; Y69-T204 HydrophobicContact CD2-CG2 3.66Å; Y69-T204 HydrophobicContact CE1-CG2 3.8Å; Y69-T204 HydrophobicContact CE2-CG2 3.6Å; Y69-T204 HydrophobicContact CG-CG2 3.76Å; Q72-T204 PolarHBondContact OE1-O 3.2Å; Q72-T204 PolarHBondContact OE1-OG1 3.3Å; V202-T204 HydrophobicContact CG1-CG2 3.99Å; T204-Q227 VanDerWaalsContact CA-O 3.24Å; T204-Q227 WeakPolarHBondContact CA-O 3.38Å; T204-Q227 WeakPolarHBondContact CB-O 3.33Å; T204-E228 HydrophobicContact CG2-CB 3.97Å; T204-P268 VanDerWaalsContact OG1-CG 3.28Å; T204-P268 WeakPolarHBondContact OG1-CG 3.39Å
205	G	92.1	Very high	71.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174	-177	177.6	0	0	0	0	0	114.3	Q227 D264	G205-Q227 PolarHBondContact N-O 2.86Å; G205-Q227 PolarHBondContact O-N 2.86Å; G205-D264 VanDerWaalsContact C-OD1 3.23Å; G205-D264 WeakPolarHBondContact CA-OD1 3.07Å
206	W	89.5	Confident	69.1	Low	9 Å²	9	54.9 Å²	54.9	3%	0.034	29%	0.293	C	S	.	.			trans	-116.4	21.3	-179.2	-60.8	-88.5	0	0	0	111.6	Q72 L74 A135 H136 I138 L226 D264	Q72-W206 HydrophobicContact CB-CH2 4.43Å; Q72-W206 HydrophobicContact CG-CH2 3.32Å; Q72-W206 HydrophobicContact CG-CZ2 4.15Å; Q72-W206 HydrophobicContact CG-CZ3 3.53Å; L74-W206 HydrophobicContact CB-CE3 4.4Å; L74-W206 HydrophobicContact CB-CH2 4.1Å; L74-W206 HydrophobicContact CB-CZ3 3.78Å; L74-W206 HydrophobicContact CD1-CE3 4.02Å; L74-W206 HydrophobicContact CD1-CZ3 4.24Å; A135-W206 HydrophobicContact CB-CZ2 4.17Å; H136-W206 PolarHBondContact O-NE1 2.98Å; I138-W206 HydrophobicContact CD1-CB 3.94Å; I138-W206 HydrophobicContact CD1-CG 4.13Å; I138-W206 HydrophobicContact CG1-CG 4.49Å; I138-W206 HydrophobicContact CG2-CD2 3.87Å; I138-W206 HydrophobicContact CG2-CG 3.89Å; I138-W206 HydrophobicContact CG2-CZ2 4.09Å; W206-L226 HydrophobicContact CD2-CD1 3.99Å; W206-L226 HydrophobicContact CE3-CD1 4.3Å; W206-L226 HydrophobicContact CH2-CD1 4.2Å; W206-L226 HydrophobicContact CZ2-CB 4.26Å; W206-L226 HydrophobicContact CZ2-CD1 3.83Å; W206-L226 HydrophobicContact CZ2-CG 4.49Å; W206-L226 HydrophobicContact CZ3-CD1 4.4Å; W206-D264 PolarHBondContact N-OD1 3.35Å
207	G	75.7	Confident	67	Low	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.315	C	S	.	.			trans	-60.9	171.7	178	0	0	0	0	0	112.7	G223 K262 D264	G207-G223 PolarHBondContact O-N 3.08Å; G207-K262 CarbonylContact C-O 3.58Å; G207-K262 WeakPolarHBondContact CA-O 3.38Å; G207-D264 VanDerWaalsContact CA-OD1 3.29Å; G207-D264 WeakPolarHBondContact CA-OD1 3.43Å; G207-D264 PolarHBondContact N-OD1 3.2Å
208	Q	59.5	Low	64.8	Low	9 Å²	9	58 Å²	58	4%	0.042	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-58.4	139.2	177.3	-72.2	179.2	-36.8	0	0	111.3	Y222 R261 K262	Q208-Y222 HydrophobicContact CG-CD1 3.79Å; Q208-Y222 HydrophobicContact CG-CD2 4.41Å; Q208-Y222 HydrophobicContact CG-CE1 3.57Å; Q208-Y222 HydrophobicContact CG-CE2 4.22Å; Q208-Y222 HydrophobicContact CG-CG 4.22Å; Q208-R261 HydrophobicContact CB-CB 4.38Å; Q208-R261 WeakPolarHBondContact O-CB 3.46Å; Q208-R261 WeakPolarHBondContact O-CG 3.31Å; Q208-K262 PolarHBondContact N-O 3.44Å
209	L	51.8	Low	63.2	Low	29 Å²	29	57.7 Å²	57.7	15%	0.152	31%	0.307	C	S	.	.	S	Bend	trans	-83.7	-12.8	-174.6	-61.1	176.7	0	0	0	114.1	I58 S59 Q221 Q227	I58-L209 HydrophobicContact CG1-CD2 4.19Å; S59-L209 PolarHBondContact N-O 3.33Å; L209-Q221 PolarHBondContact N-O 3.14Å; L209-Q227 HydrophobicContact CD2-CG 3.71Å
210	A	45.7	Very low	61.3	Low	52 Å²	52	57.1 Å²	57.1	43%	0.43	31%	0.306	S	S	.	.	S	Bend	trans	-126.4	150.5	-167.3	0	0	0	0	0	113.6
211	Y	48.2	Very low	59.5	Low	110 Å²	110	61.9 Å²	61.9	43%	0.431	33%	0.327	S	S	.	.			trans	-79.1	151.4	-179.8	-177.9	-102.9	0	0	0	115	L213 F214 D257	Y211-L213 VanDerWaalsContact CD1-N 3.3Å; Y211-L213 PolarHBondContact O-N 2.74Å; Y211-F214 PolarHBondContact O-N 3.06Å; Y211-D257 WeakPolarHBondContact CB-OD1 3.14Å; Y211-D257 WeakPolarHBondContact CB-OD2 3.49Å; Y211-D257 WeakPolarHBondContact CD2-OD1 3.27Å
212	C	40	Very low	57.9	Low	48 Å²	48	66 Å²	66	32%	0.324	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	71.7	170.1	-165.3	0	0	0	0	114.2	E215	C212-E215 HydrophobicContact CB-CB 3.97Å; C212-E215 HydrophobicContact CB-CG 3.46Å; C212-E215 VanDerWaalsContact CB-CG 3.46Å; C212-E215 VanDerWaalsContact CB-OE2 3.32Å; C212-E215 WeakPolarHBondContact CB-OE2 3.36Å; C212-E215 WeakPolarHBondContact SG-CB 3.32Å; C212-E215 VanDerWaalsContact SG-CG 3.54Å; C212-E215 PolarHBondContact SG-OE2 2.69Å
213	L	37.4	Very low	56.4	Low	148 Å²	148	66 Å²	66	78%	0.775	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn		-107.9	-13.6	126.8	-154.7	79	0	0	0	110.3	Y211	Y211-L213 VanDerWaalsContact CD1-N 3.3Å; Y211-L213 PolarHBondContact O-N 2.74Å
214	F	35.7	Very low	55.9	Low	132 Å²	132	71 Å²	71	58%	0.579	37%	0.366	S	S	*	.	S	Bend	trans	-98.9	-9	176.1	-124.4	-85.7	0	0	0	113.8	Y211 L216 L217 A218	Y211-F214 PolarHBondContact O-N 3.06Å; F214-L216 PolarHBondContact O-N 3.36Å; F214-L217 HydrophobicContact CD1-CB 3.88Å; F214-L217 HydrophobicContact CE1-CB 3.93Å; F214-L217 CarbonylContact O-C 2.82Å; F214-L217 WeakPolarHBondContact O-CA 3.43Å; F214-L217 PolarHBondContact O-N 3.08Å; F214-A218 HydrophobicContact CD1-CB 3.72Å; F214-A218 HydrophobicContact CE1-CB 4.1Å; F214-A218 PolarHBondContact O-N 3.26Å
215	E	37.3	Very low	55.7	Low	103 Å²	103	74.5 Å²	74.5	48%	0.481	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.2	173.4	-60.5	177.6	165.3	0	0	112	C212 L217	C212-E215 HydrophobicContact CB-CB 3.97Å; C212-E215 HydrophobicContact CB-CG 3.46Å; C212-E215 VanDerWaalsContact CB-CG 3.46Å; C212-E215 VanDerWaalsContact CB-OE2 3.32Å; C212-E215 WeakPolarHBondContact CB-OE2 3.36Å; C212-E215 WeakPolarHBondContact SG-CB 3.32Å; C212-E215 VanDerWaalsContact SG-CG 3.54Å; C212-E215 PolarHBondContact SG-OE2 2.69Å; E215-L217 PolarHBondContact O-N 3.14Å
216	L	42.9	Very low	55.6	Low	157 Å²	157	74.8 Å²	74.8	82%	0.822	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.9	169.9	-75.9	173.1	0	0	0	112.9	F214	F214-L216 PolarHBondContact O-N 3.36Å
217	L	39.8	Very low	55.6	Low	139 Å²	139	75 Å²	75	73%	0.728	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-17.6	-170.5	-64.3	177.6	0	0	0	115.2	F214 E215	F214-L217 HydrophobicContact CD1-CB 3.88Å; F214-L217 HydrophobicContact CE1-CB 3.93Å; F214-L217 CarbonylContact O-C 2.82Å; F214-L217 WeakPolarHBondContact O-CA 3.43Å; F214-L217 PolarHBondContact O-N 3.08Å; E215-L217 PolarHBondContact O-N 3.14Å
218	A	36.8	Very low	56.2	Low	44 Å²	44	75.5 Å²	75.5	36%	0.364	39%	0.386	S	S	.	.			trans	-149.6	135.6	176.5	0	0	0	0	0	111.7	F214 G220	F214-A218 HydrophobicContact CD1-CB 3.72Å; F214-A218 HydrophobicContact CE1-CB 4.1Å; F214-A218 PolarHBondContact O-N 3.26Å; A218-G220 PolarHBondContact O-N 2.82Å
219	D	46	Very low	57.5	Low	143 Å²	143	75.4 Å²	75.4	77%	0.765	39%	0.386	S	S	*	.			trans	-55	103.9	158.6	-160	7.4	0	0	0	107
220	G	47.9	Very low	59.1	Low	17 Å²	17	77.3 Å²	77.3	18%	0.175	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-60	143.5	-171.6	0	0	0	0	0	111	A218 Y222	A218-G220 PolarHBondContact O-N 2.82Å; G220-Y222 PolarHBondContact O-N 2.04Å; G220-Y222 VanDerWaalsContact O-N 3.12Å
221	Q	53.8	Low	61.1	Low	150 Å²	150	75 Å²	75	70%	0.701	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-60.6	118.1	174.5	-70.5	-178.8	7.6	0	0	109.3	L209	L209-Q221 PolarHBondContact N-O 3.14Å
222	Y	58.8	Low	63.1	Low	87 Å²	87	70.9 Å²	70.9	34%	0.341	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-69.2	144.1	168.8	-73.5	-87.3	0	0	0	109.3	Q208 G220 E224	Q208-Y222 HydrophobicContact CG-CD1 3.79Å; Q208-Y222 HydrophobicContact CG-CD2 4.41Å; Q208-Y222 HydrophobicContact CG-CE1 3.57Å; Q208-Y222 HydrophobicContact CG-CE2 4.22Å; Q208-Y222 HydrophobicContact CG-CG 4.22Å; G220-Y222 PolarHBondContact O-N 2.04Å; G220-Y222 VanDerWaalsContact O-N 3.12Å; Y222-E224 PolarHBondContact O-N 3.09Å; Y222-E224 VanDerWaalsContact O-N 3.1Å
223	G	62.2	Low	65.5	Low	1 Å²	1	69.4 Å²	69.4	1%	0.01	36%	0.355	C	S	.	.			trans	-67.2	107.1	168.2	0	0	0	0	0	109.4	G207 K225	G207-G223 PolarHBondContact O-N 3.08Å; G223-K225 PolarHBondContact O-N 2.88Å
224	E	80.1	Confident	67.9	Low	112 Å²	112	63.8 Å²	63.8	52%	0.523	33%	0.327	S	S	.	.	S	Bend	trans	-61.7	-37.4	172.2	-59	175	179.4	0	0	109.6	D137 I138 D139 Y222	D137-E224 CarbonylContact C-O 3.56Å; D137-E224 WeakPolarHBondContact CA-O 3.08Å; I138-E224 WeakPolarHBondContact CG1-O 3.42Å; I138-E224 PolarHBondContact N-O 2.64Å; D139-E224 VanDerWaalsContact OD2-CG 3.28Å; D139-E224 WeakPolarHBondContact OD2-CG 3.07Å; Y222-E224 PolarHBondContact O-N 3.09Å; Y222-E224 VanDerWaalsContact O-N 3.1Å
225	K	88.3	Confident	70	Confident	75 Å²	75	60.6 Å²	60.6	33%	0.326	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-100.9	153.1	177.1	-60.2	-178.3	-176.3	178.4	0	112.3	E63 H136 D137 G223 Q227	E63-K225 HydrophobicContact CG-CB 4.17Å; E63-K225 HydrophobicContact CG-CD 4.15Å; E63-K225 VanDerWaalsContact OE1-CD 3.25Å; E63-K225 WeakPolarHBondContact OE1-CD 3.37Å; E63-K225 IonicContact OE1-NZ 3.31Å; E63-K225 PolarHBondContact OE1-NZ 2.9Å; E63-K225 WeakPolarHBondContact OE2-CD 3.46Å; E63-K225 IonicContact OE2-NZ 3.21Å; E63-K225 PolarHBondContact OE2-NZ 2.93Å; H136-K225 CarbonylContact O-C 3.52Å; H136-K225 WeakPolarHBondContact O-CA 3.32Å; D137-K225 HydrophobicContact CB-CG 4.16Å; G223-K225 PolarHBondContact O-N 2.88Å; K225-Q227 WeakPolarHBondContact O-CG 3.31Å; K225-Q227 PolarHBondContact O-N 2.87Å; K225-Q227 PolarHBondContact O-NE2 3Å
226	L	90.9	Very high	72	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	34%	0.336	C	S	.	.			trans	-60.6	131.5	177	-175.1	64.8	0	0	0	110.3	A64 Y69 Q72 H136 W206	A64-L226 HydrophobicContact CB-CB 4.31Å; A64-L226 HydrophobicContact CB-CD2 4.2Å; A64-L226 HydrophobicContact CB-CG 4.08Å; A64-L226 WeakPolarHBondContact CB-O 3.33Å; A64-L226 PolarHBondContact N-O 2.8Å; Y69-L226 HydrophobicContact CD2-CD2 4.16Å; Q72-L226 HydrophobicContact CB-CD2 4.29Å; Q72-L226 HydrophobicContact CG-CD1 3.78Å; Q72-L226 HydrophobicContact CG-CD2 4.21Å; H136-L226 PolarHBondContact O-N 3.48Å; W206-L226 HydrophobicContact CD2-CD1 3.99Å; W206-L226 HydrophobicContact CE3-CD1 4.3Å; W206-L226 HydrophobicContact CH2-CD1 4.2Å; W206-L226 HydrophobicContact CZ2-CB 4.26Å; W206-L226 HydrophobicContact CZ2-CD1 3.83Å; W206-L226 HydrophobicContact CZ2-CG 4.49Å; W206-L226 HydrophobicContact CZ3-CD1 4.4Å
227	Q	89.2	Confident	73.7	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.065	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	152.3	177.1	-50.7	-63.1	-56.5	0	0	110.3	R57 I58 A62 T204 G205 L209 K225	R57-Q227 PolarHBondContact O-OE1 2.86Å; I58-Q227 HydrophobicContact CD1-CB 3.69Å; I58-Q227 HydrophobicContact CD1-CG 4.14Å; I58-Q227 HydrophobicContact CG1-CB 3.23Å; I58-Q227 HydrophobicContact CG1-CG 3.69Å; A62-Q227 WeakPolarHBondContact O-CA 3.42Å; T204-Q227 VanDerWaalsContact CA-O 3.24Å; T204-Q227 WeakPolarHBondContact CA-O 3.38Å; T204-Q227 WeakPolarHBondContact CB-O 3.33Å; G205-Q227 PolarHBondContact N-O 2.86Å; G205-Q227 PolarHBondContact O-N 2.86Å; L209-Q227 HydrophobicContact CD2-CG 3.71Å; K225-Q227 WeakPolarHBondContact O-CG 3.31Å; K225-Q227 PolarHBondContact O-N 2.87Å; K225-Q227 PolarHBondContact O-NE2 3Å
228	E	88	Confident	75.9	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.047	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.6	173.5	62.5	179.5	-122.2	0	0	110.8	R47 G61 A62 A64 Y69 V202 T204	R47-E228 PolarHBondContact N-OE1 3.32Å; R47-E228 VanDerWaalsContact O-OE1 3.11Å; G61-E228 CarbonylContact C-O 3.56Å; G61-E228 WeakPolarHBondContact CA-O 3.39Å; A62-E228 PolarHBondContact N-O 2.8Å; A62-E228 PolarHBondContact O-N 2.88Å; A64-E228 VanDerWaalsContact CA-OE2 3.3Å; A64-E228 WeakPolarHBondContact CA-OE2 3.23Å; A64-E228 HydrophobicContact CB-CB 4.22Å; A64-E228 HydrophobicContact CB-CG 4.2Å; Y69-E228 HydrophobicContact CE2-CB 3.8Å; Y69-E228 HydrophobicContact CE2-CG 4.43Å; Y69-E228 WeakPolarHBondContact CE2-OE2 3.03Å; Y69-E228 WeakPolarHBondContact OH-CB 3.27Å; Y69-E228 PolarHBondContact OH-OE2 2.92Å; V202-E228 HydrophobicContact CG1-CB 3.9Å; T204-E228 HydrophobicContact CG2-CB 3.97Å
229	L	86.2	Confident	78.2	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	119.9	172.8	176.3	64.6	0	0	0	109.5	V202 V203 V231 T258	V202-L229 WeakPolarHBondContact CA-O 3.38Å; V203-L229 PolarHBondContact N-O 2.8Å; V203-L229 PolarHBondContact O-N 3.5Å; L229-V231 HydrophobicContact CD2-CG1 3.94Å; L229-V231 HydrophobicContact CG-CG1 3.91Å; L229-T258 HydrophobicContact CD1-CG2 3.49Å; L229-T258 VanDerWaalsContact CD1-CG2 3.49Å; L229-T258 HydrophobicContact CD2-CG2 3.83Å; L229-T258 HydrophobicContact CG-CG2 4.29Å
230	Q	86.9	Confident	80.1	Confident	68 Å²	68	50 Å²	50	32%	0.318	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.7	169.6	-175	173.5	-23.9	0	0	109.6	C201 H253	C201-Q230 CarbonylContact O-C 3.46Å; C201-Q230 WeakPolarHBondContact O-CA 3.5Å; Q230-H253 PolarHBondContact O-CD2 2.79Å; Q230-H253 VanDerWaalsContact O-CD2 3.24Å
231	V	87.8	Confident	81.9	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.024	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.1	-179.6	-63.3	0	0	0	0	110.6	C201 V203 L229 T251 L269	C201-V231 HydrophobicContact CB-CG2 4.3Å; C201-V231 PolarHBondContact O-N 2.7Å; V203-V231 HydrophobicContact CG2-CG1 4.17Å; V203-V231 HydrophobicContact CG2-CG2 3.77Å; L229-V231 HydrophobicContact CD2-CG1 3.94Å; L229-V231 HydrophobicContact CG-CG1 3.91Å; V231-T251 HydrophobicContact CG2-CG2 3.85Å; V231-L269 HydrophobicContact CG2-CD1 3.68Å
232	G	88.9	Confident	83.6	Confident	23 Å²	23	51.2 Å²	51.2	24%	0.237	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.9	171.4	0	0	0	0	0	110.9	V234 T251 G252	G232-V234 PolarHBondContact O-N 2.86Å; G232-T251 CarbonylContact O-C 3.29Å; G232-T251 WeakPolarHBondContact O-CA 3.45Å; G232-T251 WeakPolarHBondContact O-CB 3.34Å; G232-G252 PolarHBondContact N-O 2.94Å; G232-G252 PolarHBondContact O-N 3.08Å
233	V	91	Very high	85.1	Confident	17 Å²	17	48.6 Å²	48.6	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	128.7	168	177.2	0	0	0	0	109	P194 P195 G235 V249	P194-V233 HydrophobicContact CB-CG1 4.12Å; P194-V233 HydrophobicContact CB-CG2 4.3Å; P195-V233 WeakPolarHBondContact O-CB 3.02Å; V233-G235 PolarHBondContact O-N 3.02Å; V233-V249 HydrophobicContact CG1-CG1 4.11Å
234	V	88	Confident	86.6	Confident	30 Å²	30	52 Å²	52	18%	0.182	30%	0.304	C	S	.	.			trans	-86.5	112.2	-179.7	-175.3	0	0	0	0	109	G232 V238 C250	G232-V234 PolarHBondContact O-N 2.86Å; V234-V238 HydrophobicContact CG1-CG2 4.32Å; V234-C250 HydrophobicContact CB-CB 4.12Å; V234-C250 PolarHBondContact N-O 3.26Å
235	G	79.1	Confident	87.1	Confident	65 Å²	65	53.3 Å²	53.3	67%	0.67	31%	0.31	S	S	*	.			trans	-82.3	156.2	167.7	0	0	0	0	0	112.2	V233	V233-G235 PolarHBondContact O-N 3.02Å
236	G	79.1	Confident	87.3	Confident	56 Å²	56	57.8 Å²	57.8	58%	0.577	33%	0.329	S	S	*	.	S	Bend	trans	83.1	-158.3	175.2	0	0	0	0	0	114	V238	G236-V238 PolarHBondContact O-N 2.74Å
237	Q	80	Confident	87.5	Confident	165 Å²	165	57.7 Å²	57.7	77%	0.771	33%	0.329	S	S	*	.			trans	-77.8	119.1	-171.9	-172.9	176.9	-18.9	0	0	111.8	N239	Q237-N239 PolarHBondContact NE2-OD1 2.84Å
238	V	85.9	Confident	87.8	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.091	33%	0.327	C	S	.	.			trans	-91.1	124.4	171.2	176.1	0	0	0	0	108.9	V234 G236 S240 F243 C250 F287	V234-V238 HydrophobicContact CG1-CG2 4.32Å; G236-V238 PolarHBondContact O-N 2.74Å; V238-S240 VanDerWaalsContact C-N 3.3Å; V238-S240 PolarHBondContact O-N 3.29Å; V238-F243 HydrophobicContact CB-CB 4.39Å; V238-F243 HydrophobicContact CB-CD1 3.46Å; V238-F243 VanDerWaalsContact CB-CD1 3.46Å; V238-F243 HydrophobicContact CB-CE1 3.8Å; V238-F243 HydrophobicContact CB-CG 3.91Å; V238-F243 HydrophobicContact CG1-CB 3.83Å; V238-F243 HydrophobicContact CG1-CD1 3.78Å; V238-F243 HydrophobicContact CG1-CD2 4.21Å; V238-F243 HydrophobicContact CG1-CE1 4.39Å; V238-F243 HydrophobicContact CG1-CG 3.65Å; V238-F243 HydrophobicContact CG2-CD1 3.87Å; V238-F243 HydrophobicContact CG2-CE1 3.66Å; V238-F243 HydrophobicContact CG2-CG 4.4Å; V238-F243 HydrophobicContact CG2-CZ 4.07Å; V238-C250 HydrophobicContact CG2-CB 3.66Å; V238-F287 HydrophobicContact CG1-CE2 3.83Å; V238-F287 HydrophobicContact CG1-CZ 3.59Å
239	N	84.1	Confident	88.2	Confident	106 Å²	106	57 Å²	57	57%	0.567	33%	0.326	S	S	*	.			trans	-90.2	61.1	-172.9	-76	-35.9	0	0	0	112.3	Q237 E289	Q237-N239 PolarHBondContact NE2-OD1 2.84Å; N239-E289 PolarHBondContact N-OE1 3.06Å
240	S	85.7	Confident	88.5	Confident	21 Å²	21	56.7 Å²	56.7	15%	0.147	33%	0.325	C	S	.	.			trans	-136.4	130.5	176.1	177.2	0	0	0	0	111	V238 L242 F243	V238-S240 VanDerWaalsContact C-N 3.3Å; V238-S240 PolarHBondContact O-N 3.29Å; S240-L242 PolarHBondContact O-N 3.13Å; S240-L242 PolarHBondContact OG-N 3.18Å; S240-F243 PolarHBondContact O-N 2.93Å
241	P	86.9	Confident	88.7	Confident	136 Å²	136	53.5 Å²	53.5	88%	0.883	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.5	177.2	29.9	-35.5	0	0	0	113.1
242	L	88.5	Confident	88.5	Confident	58 Å²	58	53.5 Å²	53.5	30%	0.304	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-18.2	177.2	-61.9	175.5	0	0	0	112.3	F163 S240 F285	F163-L242 HydrophobicContact CD2-CD1 4.11Å; F163-L242 HydrophobicContact CD2-CD2 4.28Å; F163-L242 HydrophobicContact CE2-CD1 4.03Å; F163-L242 HydrophobicContact CE2-CD2 4.49Å; S240-L242 PolarHBondContact O-N 3.13Å; S240-L242 PolarHBondContact OG-N 3.18Å; L242-F285 HydrophobicContact CB-CE2 4.22Å; L242-F285 HydrophobicContact CB-CZ 4Å
243	F	90.9	Very high	88	Confident	32 Å²	32	54.5 Å²	54.5	14%	0.14	31%	0.309	C	S	.	.			trans	-80.4	125.2	-177.2	-177.1	-100.4	0	0	0	111.2	V238 S240 E245 M248 C250 A299	V238-F243 HydrophobicContact CB-CB 4.39Å; V238-F243 HydrophobicContact CB-CD1 3.46Å; V238-F243 VanDerWaalsContact CB-CD1 3.46Å; V238-F243 HydrophobicContact CB-CE1 3.8Å; V238-F243 HydrophobicContact CB-CG 3.91Å; V238-F243 HydrophobicContact CG1-CB 3.83Å; V238-F243 HydrophobicContact CG1-CD1 3.78Å; V238-F243 HydrophobicContact CG1-CD2 4.21Å; V238-F243 HydrophobicContact CG1-CE1 4.39Å; V238-F243 HydrophobicContact CG1-CG 3.65Å; V238-F243 HydrophobicContact CG2-CD1 3.87Å; V238-F243 HydrophobicContact CG2-CE1 3.66Å; V238-F243 HydrophobicContact CG2-CG 4.4Å; V238-F243 HydrophobicContact CG2-CZ 4.07Å; S240-F243 PolarHBondContact O-N 2.93Å; F243-E245 HydrophobicContact CE1-CB 4.07Å; F243-M248 HydrophobicContact CD2-CB 3.94Å; F243-M248 HydrophobicContact CD2-SD 4.2Å; F243-M248 HydrophobicContact CE2-CB 3.53Å; F243-M248 HydrophobicContact CZ-CB 4.21Å; F243-C250 HydrophobicContact CD2-CB 4.21Å; F243-C250 HydrophobicContact CE2-CB 3.52Å; F243-C250 HydrophobicContact CZ-CB 3.72Å; F243-A299 HydrophobicContact CD2-CB 4.46Å
244	Q	92.6	Very high	87	Confident	71 Å²	71	60.4 Å²	60.4	33%	0.332	34%	0.34	S	S	.	.			trans	-113.4	102.2	177	-65.4	-161.6	60	0	0	110.9	D164 K246 S247 M248	D164-Q244 PolarHBondContact OD2-NE2 3.43Å; Q244-K246 PolarHBondContact O-N 3.04Å; Q244-S247 WeakPolarHBondContact CB-OG 3.4Å; Q244-S247 PolarHBondContact O-N 3.39Å; Q244-S247 VanDerWaalsContact O-N 3.1Å; Q244-M248 HydrophobicContact CB-CE 4.42Å; Q244-M248 HydrophobicContact CB-CG 4.33Å; Q244-M248 HydrophobicContact CB-SD 4.21Å; Q244-M248 PolarHBondContact N-SD 3.14Å; Q244-M248 VanDerWaalsContact N-SD 3.39Å; Q244-M248 VanDerWaalsContact O-CB 3.28Å; Q244-M248 WeakPolarHBondContact O-CB 3.48Å; Q244-M248 PolarHBondContact O-N 2.88Å
245	E	91.2	Very high	85.9	Confident	140 Å²	140	62.9 Å²	62.9	65%	0.654	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.5	-173.9	-173.6	-179.4	-176.1	0	0	114.7	F243	F243-E245 HydrophobicContact CE1-CB 4.07Å
246	K	93	Very high	85.1	Confident	170 Å²	170	64.9 Å²	64.9	74%	0.739	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-42.7	-179.9	-69	-175	178.5	-180	0	113	Q244 Y305	Q244-K246 PolarHBondContact O-N 3.04Å; K246-Y305 WeakPolarHBondContact O-CD2 3.48Å
247	S	95.1	Very high	84.2	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-7.8	-172.3	56.6	0	0	0	0	113.6	D164 Q244 K302 Y306	D164-S247 WeakPolarHBondContact OD1-CB 3.17Å; D164-S247 PolarHBondContact OD1-OG 3.46Å; Q244-S247 WeakPolarHBondContact CB-OG 3.4Å; Q244-S247 PolarHBondContact O-N 3.39Å; Q244-S247 VanDerWaalsContact O-N 3.1Å; S247-K302 WeakPolarHBondContact O-CB 3.44Å; S247-K302 PolarHBondContact O-N 3.39Å; S247-Y306 WeakPolarHBondContact CB-OH 3.38Å; S247-Y306 WeakPolarHBondContact O-CE2 3.49Å
248	M	95.8	Very high	83.1	Confident	5 Å²	5	57 Å²	57	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	152.9	-175.9	-58.1	178.5	178.4	0	0	112.9	F163 D164 F243 Q244 F285 A299 F300	F163-M248 WeakPolarHBondContact O-CE 3.39Å; D164-M248 HydrophobicContact CB-CE 4.48Å; F243-M248 HydrophobicContact CD2-CB 3.94Å; F243-M248 HydrophobicContact CD2-SD 4.2Å; F243-M248 HydrophobicContact CE2-CB 3.53Å; F243-M248 HydrophobicContact CZ-CB 4.21Å; Q244-M248 HydrophobicContact CB-CE 4.42Å; Q244-M248 HydrophobicContact CB-CG 4.33Å; Q244-M248 HydrophobicContact CB-SD 4.21Å; Q244-M248 PolarHBondContact N-SD 3.14Å; Q244-M248 VanDerWaalsContact N-SD 3.39Å; Q244-M248 VanDerWaalsContact O-CB 3.28Å; Q244-M248 WeakPolarHBondContact O-CB 3.48Å; Q244-M248 PolarHBondContact O-N 2.88Å; M248-F285 HydrophobicContact CE-CE1 4.05Å; M248-F285 HydrophobicContact SD-CE1 4.1Å; M248-F285 HydrophobicContact SD-CZ 4.22Å; M248-A299 HydrophobicContact SD-CB 4.42Å; M248-F300 CarbonylContact C-O 3.56Å; M248-F300 WeakPolarHBondContact CA-O 3.33Å
249	V	95	Very high	81.8	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.03	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	134.6	166.7	-176.6	0	0	0	0	107.8	P194 V233 L269 A299 F300 K302	P194-V249 HydrophobicContact CB-CG1 4.25Å; P194-V249 HydrophobicContact CG-CB 4.34Å; P194-V249 HydrophobicContact CG-CG1 3.86Å; P194-V249 HydrophobicContact CG-CG2 3.5Å; V233-V249 HydrophobicContact CG1-CG1 4.11Å; V249-L269 HydrophobicContact CB-CD2 4.4Å; V249-L269 HydrophobicContact CG1-CD2 3.83Å; V249-A299 WeakPolarHBondContact O-CA 3.49Å; V249-F300 HydrophobicContact CB-CB 4.36Å; V249-F300 PolarHBondContact N-O 2.91Å; V249-F300 PolarHBondContact O-N 3.4Å; V249-K302 HydrophobicContact CG2-CB 3.73Å; V249-K302 HydrophobicContact CG2-CD 4.4Å; V249-K302 HydrophobicContact CG2-CG 3.74Å
250	C	93	Very high	80.8	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.014	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.6	174.5	-174.2	0	0	0	0	109.4	V234 V238 F243 Q298	V234-C250 HydrophobicContact CB-CB 4.12Å; V234-C250 PolarHBondContact N-O 3.26Å; V238-C250 HydrophobicContact CG2-CB 3.66Å; F243-C250 HydrophobicContact CD2-CB 4.21Å; F243-C250 HydrophobicContact CE2-CB 3.52Å; F243-C250 HydrophobicContact CZ-CB 3.72Å; C250-Q298 CarbonylContact C-O 3.52Å; C250-Q298 WeakPolarHBondContact CA-O 3.37Å
251	T	90.4	Very high	80	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	161.3	167.6	76	0	0	0	0	110.8	V231 G232 L269 R297 Q298 F300	V231-T251 HydrophobicContact CG2-CG2 3.85Å; G232-T251 CarbonylContact O-C 3.29Å; G232-T251 WeakPolarHBondContact O-CA 3.45Å; G232-T251 WeakPolarHBondContact O-CB 3.34Å; T251-L269 HydrophobicContact CG2-CD1 3.82Å; T251-L269 HydrophobicContact CG2-CD2 3.68Å; T251-L269 HydrophobicContact CG2-CG 4.42Å; T251-R297 VanDerWaalsContact O-CA 3.26Å; T251-R297 WeakPolarHBondContact O-CA 3.41Å; T251-R297 WeakPolarHBondContact O-CD 3.32Å; T251-Q298 PolarHBondContact N-O 2.81Å; T251-Q298 PolarHBondContact O-N 3.37Å; T251-F300 HydrophobicContact CG2-CD2 4.04Å; T251-F300 HydrophobicContact CG2-CE2 3.58Å; T251-F300 HydrophobicContact CG2-CZ 4.38Å; T251-F300 WeakPolarHBondContact OG1-CE2 3.43Å
252	G	85.3	Confident	78.8	Confident	5 Å²	5	51.8 Å²	51.8	5%	0.052	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	174.2	167.6	0	0	0	0	0	111.3	G232	G232-G252 PolarHBondContact N-O 2.94Å; G232-G252 PolarHBondContact O-N 3.08Å
253	H	78.3	Confident	77.7	Confident	44 Å²	44	49.6 Å²	49.6	20%	0.204	24%	0.241	C	C	.	.			trans	-123.6	153.7	173.9	-163.7	-104.3	0	0	0	109.2	Q230 E255 T258	Q230-H253 PolarHBondContact O-CD2 2.79Å; Q230-H253 VanDerWaalsContact O-CD2 3.24Å; H253-E255 IonicContact CE1-OE2 3.76Å; H253-E255 WeakPolarHBondContact ND1-CB 3.27Å; H253-E255 PolarHBondContact ND1-N 2.81Å; H253-E255 VanDerWaalsContact ND1-N 3.2Å; H253-T258 HydrophobicContact CB-CG2 3.82Å; H253-T258 WeakPolarHBondContact ND1-CG2 3.41Å
254	D	69.1	Low	77.3	Confident	141 Å²	141	48.1 Å²	48.1	75%	0.754	23%	0.234	S	C	*	.	S	Bend	trans	-75.9	-28.8	179.7	-80.5	-32.8	0	0	0	112.2	K295	D254-K295 IonicContact OD1-NZ 2.74Å
255	E	65.1	Low	77.2	Confident	81 Å²	81	45.9 Å²	45.9	38%	0.379	23%	0.226	S	C	.	.	S	Bend	trans	-75	138.6	172.7	-57.4	-178.6	175.6	0	0	110.8	N60 H253	N60-E255 WeakPolarHBondContact CB-OE2 3.48Å; N60-E255 PolarHBondContact ND2-OE2 2.73Å; H253-E255 IonicContact CE1-OE2 3.76Å; H253-E255 WeakPolarHBondContact ND1-CB 3.27Å; H253-E255 PolarHBondContact ND1-N 2.81Å; H253-E255 VanDerWaalsContact ND1-N 3.2Å
256	I	61.7	Low	77.4	Confident	107 Å²	107	39.2 Å²	39.2	55%	0.549	20%	0.195	S	C	.	.	S	Bend	trans	-69.4	147.4	175.9	-59.3	172.3	0	0	0	108	T258 L293	I256-T258 PolarHBondContact O-N 3.46Å; I256-T258 PolarHBondContact O-OG1 3.37Å; I256-L293 HydrophobicContact CD1-CD2 4.41Å
257	D	61.2	Low	77.5	Confident	55 Å²	55	31.1 Å²	31.1	29%	0.294	16%	0.16	S	C	.	.	S	Bend	trans	59.3	46.6	178.1	-170	19	0	0	0	112.1	S59 Y211 R261	S59-D257 WeakPolarHBondContact CB-O 3.25Å; S59-D257 PolarHBondContact OG-O 2.89Å; Y211-D257 WeakPolarHBondContact CB-OD1 3.14Å; Y211-D257 WeakPolarHBondContact CB-OD2 3.49Å; Y211-D257 WeakPolarHBondContact CD2-OD1 3.27Å; D257-R261 IonicContact OD1-CZ 3.26Å; D257-R261 IonicContact OD1-NH2 3.69Å; D257-R261 PolarHBondContact OD1-NH2 3.12Å
258	T	57.1	Low	77.6	Confident	1 Å²	1	31 Å²	31	1%	0.006	16%	0.159	C	C	.	.			trans	-131.8	113.5	178.8	-55	0	0	0	0	110.2	S59 N60 L229 H253 I256	S59-T258 VanDerWaalsContact O-CA 3.23Å; S59-T258 WeakPolarHBondContact O-CA 3.28Å; S59-T258 WeakPolarHBondContact O-CB 3.34Å; S59-T258 VanDerWaalsContact O-CG2 3.31Å; S59-T258 WeakPolarHBondContact O-CG2 3.33Å; S59-T258 PolarHBondContact O-OG1 2.8Å; S59-T258 WeakPolarHBondContact OG-CA 3.28Å; N60-T258 HydrophobicContact CB-CG2 3.91Å; N60-T258 PolarHBondContact ND2-OG1 3.42Å; L229-T258 HydrophobicContact CD1-CG2 3.49Å; L229-T258 VanDerWaalsContact CD1-CG2 3.49Å; L229-T258 HydrophobicContact CD2-CG2 3.83Å; L229-T258 HydrophobicContact CG-CG2 4.29Å; H253-T258 HydrophobicContact CB-CG2 3.82Å; H253-T258 WeakPolarHBondContact ND1-CG2 3.41Å; I256-T258 PolarHBondContact O-N 3.46Å; I256-T258 PolarHBondContact O-OG1 3.37Å
259	G	58.6	Low	77.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	177.9	172.3	176.3	0	0	0	0	0	113.8	I58 R261	I58-G259 WeakPolarHBondContact CG2-O 3.33Å; G259-R261 VanDerWaalsContact C-NH1 3.26Å; G259-R261 PolarHBondContact O-NH1 3.05Å
260	A	61.9	Low	77.7	Confident	5 Å²	5	30.5 Å²	30.5	4%	0.041	16%	0.157	C	C	.	.			trans	-63.4	153.2	172	0	0	0	0	0	111.7	V203 D264 L283 Q298	V203-A260 HydrophobicContact CG1-CB 4.04Å; A260-D264 WeakPolarHBondContact CA-OD2 3.2Å; A260-D264 HydrophobicContact CB-CB 3.85Å; A260-L283 HydrophobicContact CB-CD1 4.37Å; A260-L283 HydrophobicContact CB-CD2 3.28Å; A260-L283 HydrophobicContact CB-CG 4.49Å; A260-Q298 VanDerWaalsContact N-CD 3.28Å
261	R	68.8	Low	77.9	Confident	24 Å²	24	30.4 Å²	30.4	9%	0.091	16%	0.156	C	C	.	.			trans	-132.6	-176.7	-169.1	-60.9	-72.3	178.5	-103.7	13	110.7	I58 S59 Q208 D257 G259 G263 D264 E296	I58-R261 HydrophobicContact CG2-CG 4.39Å; S59-R261 PolarHBondContact OG-NH2 3.26Å; S59-R261 VanDerWaalsContact OG-NH2 3.08Å; Q208-R261 HydrophobicContact CB-CB 4.38Å; Q208-R261 WeakPolarHBondContact O-CB 3.46Å; Q208-R261 WeakPolarHBondContact O-CG 3.31Å; D257-R261 IonicContact OD1-CZ 3.26Å; D257-R261 IonicContact OD1-NH2 3.69Å; D257-R261 PolarHBondContact OD1-NH2 3.12Å; G259-R261 VanDerWaalsContact C-NH1 3.26Å; G259-R261 PolarHBondContact O-NH1 3.05Å; R261-G263 PolarHBondContact O-N 3.25Å; R261-D264 PolarHBondContact N-OD2 3.49Å; R261-D264 WeakPolarHBondContact O-CB 3.29Å; R261-D264 PolarHBondContact O-N 3.09Å; R261-E296 IonicContact CZ-OE1 3.38Å; R261-E296 IonicContact CZ-OE2 3.96Å; R261-E296 IonicContact NH1-OE1 3.92Å; R261-E296 PolarHBondContact NH1-OE1 2.77Å; R261-E296 IonicContact NH1-OE2 3.41Å; R261-E296 PolarHBondContact NH1-OE2 2.96Å; R261-E296 IonicContact NH2-OE1 2.73Å; R261-E296 IonicContact NH2-OE2 2.98Å; R261-E296 PolarHBondContact NH2-OE2 3.46Å
262	K	62.7	Low	78.1	Confident	139 Å²	139	33.1 Å²	33.1	60%	0.604	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	122	177.5	-173.2	-179.4	-179.5	-174.5	0	110.4	G207 Q208	G207-K262 CarbonylContact C-O 3.58Å; G207-K262 WeakPolarHBondContact CA-O 3.38Å; Q208-K262 PolarHBondContact N-O 3.44Å
263	G	65.2	Low	78.3	Confident	13 Å²	13	36 Å²	36	13%	0.134	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.9	-19.9	-176.4	0	0	0	0	0	113.7	G87 R261	G87-G263 PolarHBondContact N-O 2.88Å; R261-G263 PolarHBondContact O-N 3.25Å
264	D	82.4	Confident	78.7	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.207	C	C	.	.			trans	-81.3	-18.3	173.5	-61.3	-41.1	0	0	0	112.4	G205 W206 G207 A260 R261 G266 G267 L283	G205-D264 VanDerWaalsContact C-OD1 3.23Å; G205-D264 WeakPolarHBondContact CA-OD1 3.07Å; W206-D264 PolarHBondContact N-OD1 3.35Å; G207-D264 VanDerWaalsContact CA-OD1 3.29Å; G207-D264 WeakPolarHBondContact CA-OD1 3.43Å; G207-D264 PolarHBondContact N-OD1 3.2Å; A260-D264 WeakPolarHBondContact CA-OD2 3.2Å; A260-D264 HydrophobicContact CB-CB 3.85Å; R261-D264 PolarHBondContact N-OD2 3.49Å; R261-D264 WeakPolarHBondContact O-CB 3.29Å; R261-D264 PolarHBondContact O-N 3.09Å; D264-G266 PolarHBondContact O-N 3.48Å; D264-G267 WeakPolarHBondContact O-CA 3.41Å; D264-G267 PolarHBondContact O-N 2.92Å; D264-L283 HydrophobicContact CB-CD2 3.6Å
265	S	89.8	Confident	79.6	Confident	23 Å²	23	36.2 Å²	36.2	16%	0.161	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.6	136	179.7	-69.3	0	0	0	0	112.4	C86 G87 H107 C108 G267	C86-S265 CarbonylContact C-O 3.46Å; C86-S265 WeakPolarHBondContact CB-O 3.43Å; G87-S265 PolarHBondContact N-O 3.4Å; H107-S265 WeakPolarHBondContact NE2-CB 3.35Å; H107-S265 PolarHBondContact NE2-OG 2.6Å; H107-S265 VanDerWaalsContact NE2-OG 3.11Å; C108-S265 PolarHBondContact SG-O 3.13Å; S265-G267 PolarHBondContact O-N 3.15Å
266	G	95.6	Very high	80.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-9.2	-173	0	0	0	0	0	114.7	G87 G88 D264 L283	G87-G266 VanDerWaalsContact C-C 3.45Å; G87-G266 CarbonylContact C-O 3.6Å; G87-G266 CarbonylContact O-C 3.6Å; G87-G266 VanDerWaalsContact O-C 3.29Å; G87-G266 WeakPolarHBondContact O-CA 3.24Å; G88-G266 WeakPolarHBondContact CA-O 3.41Å; D264-G266 PolarHBondContact O-N 3.48Å; G266-L283 PolarHBondContact N-O 3.15Å
267	G	95.4	Very high	82.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.			trans	-65	161.4	175.6	0	0	0	0	0	113.6	D264 S265 L283	D264-G267 WeakPolarHBondContact O-CA 3.41Å; D264-G267 PolarHBondContact O-N 2.92Å; S265-G267 PolarHBondContact O-N 3.15Å; G267-L283 PolarHBondContact O-N 3.29Å
268	P	97.4	Very high	84.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142.9	-175.4	29.2	-33.8	0	0	0	112.7	Q72 S89 V203 T204 A270 L279	Q72-P268 VanDerWaalsContact OE1-CD 3.24Å; S89-P268 WeakPolarHBondContact OG-CB 3.43Å; V203-P268 WeakPolarHBondContact CA-O 3.08Å; T204-P268 VanDerWaalsContact OG1-CG 3.28Å; T204-P268 WeakPolarHBondContact OG1-CG 3.39Å; P268-A270 HydrophobicContact CB-CB 4.4Å; P268-L279 HydrophobicContact CB-CD1 3.48Å; P268-L279 VanDerWaalsContact CB-CD1 3.48Å
269	L	96.6	Very high	86.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	93.8	147.1	179.3	64.1	0	0	0	107.8	C201 V203 V231 V249 T251 Y280 G281 F300	C201-L269 HydrophobicContact CB-CD1 3.92Å; V203-L269 HydrophobicContact CG2-CD1 3.95Å; V231-L269 HydrophobicContact CG2-CD1 3.68Å; V249-L269 HydrophobicContact CB-CD2 4.4Å; V249-L269 HydrophobicContact CG1-CD2 3.83Å; T251-L269 HydrophobicContact CG2-CD1 3.82Å; T251-L269 HydrophobicContact CG2-CD2 3.68Å; T251-L269 HydrophobicContact CG2-CG 4.42Å; L269-Y280 PolarHBondContact O-N 3.45Å; L269-G281 PolarHBondContact N-O 2.97Å; L269-F300 HydrophobicContact CB-CD1 3.63Å; L269-F300 HydrophobicContact CB-CE1 3.74Å; L269-F300 HydrophobicContact CB-CG 4.18Å; L269-F300 HydrophobicContact CB-CZ 4.36Å; L269-F300 HydrophobicContact CD1-CZ 4.4Å; L269-F300 HydrophobicContact CD2-CD1 4.49Å; L269-F300 HydrophobicContact CD2-CD2 4.17Å; L269-F300 HydrophobicContact CD2-CE2 4.45Å; L269-F300 HydrophobicContact CD2-CG 4.23Å
270	A	97.3	Very high	88.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116	-178.5	0	0	0	0	0	109.7	W71 I185 C201 V202 P268 F277	W71-A270 HydrophobicContact CZ2-CB 4.2Å; I185-A270 HydrophobicContact CD1-CB 3.58Å; C201-A270 CarbonylContact C-O 3.47Å; C201-A270 WeakPolarHBondContact CA-O 3.28Å; V202-A270 PolarHBondContact N-O 3.16Å; V202-A270 PolarHBondContact O-N 2.8Å; P268-A270 HydrophobicContact CB-CB 4.4Å; A270-F277 HydrophobicContact CB-CD1 4.01Å
271	C	96.2	Very high	89.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.3	177.4	-55.2	0	0	0	0	111.6	P195 I200 C201 K273 F277 T278 Y280	P195-C271 HydrophobicContact CG-CB 3.58Å; I200-C271 CarbonylContact O-C 3.51Å; I200-C271 VanDerWaalsContact O-CA 3.28Å; I200-C271 WeakPolarHBondContact O-CA 2.94Å; C201-C271 HydrophobicContact CB-CB 4.1Å; C201-C271 WeakPolarHBondContact CB-SG 3.23Å; C201-C271 WeakPolarHBondContact SG-CB 3.42Å; C201-C271 CovalentContact SG-SG 2.04Å; C201-C271 PolarHBondContact SG-SG 3.24Å; C271-K273 PolarHBondContact O-N 2.82Å; C271-F277 WeakPolarHBondContact O-CA 3.05Å; C271-T278 PolarHBondContact N-O 2.04Å; C271-T278 PolarHBondContact O-N 2.87Å; C271-Y280 HydrophobicContact CB-CD2 3.61Å; C271-Y280 HydrophobicContact CB-CE2 3.85Å
272	L	93.6	Very high	91.2	Very high	57 Å²	57	25.4 Å²	25.4	30%	0.298	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.5	176.4	-173.1	65.9	0	0	0	109.8	I200 F277	I200-L272 HydrophobicContact CB-CB 4.22Å; I200-L272 HydrophobicContact CD1-CD2 4.41Å; I200-L272 PolarHBondContact O-N 2.84Å; L272-F277 HydrophobicContact CB-CD1 4.37Å; L272-F277 HydrophobicContact CB-CE1 4.08Å; L272-F277 HydrophobicContact CB-CZ 4.33Å; L272-F277 HydrophobicContact CD1-CD2 4.04Å; L272-F277 HydrophobicContact CD1-CE2 3.96Å; L272-F277 HydrophobicContact CD1-CG 4.42Å; L272-F277 HydrophobicContact CD1-CZ 4.25Å
273	K	90.3	Very high	92.8	Very high	65 Å²	65	19 Å²	19	28%	0.283	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	128.9	175.7	177.2	178.9	173.2	-166.6	0	109.5	E192 C271 G275 T276 Y280	E192-K273 IonicContact OE1-NZ 3.2Å; E192-K273 PolarHBondContact OE1-NZ 2.89Å; E192-K273 IonicContact OE2-NZ 3.9Å; E192-K273 PolarHBondContact OE2-NZ 2.7Å; C271-K273 PolarHBondContact O-N 2.82Å; K273-G275 PolarHBondContact O-N 2.89Å; K273-T276 PolarHBondContact N-O 3.16Å; K273-T276 PolarHBondContact O-N 2.82Å; K273-T276 PolarHBondContact O-OG1 2.92Å; K273-Y280 WeakPolarHBondContact CD-OH 3.34Å
274	D	86.7	Confident	94.1	Very high	141 Å²	141	18.7 Å²	18.7	75%	0.754	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	34.1	176.8	-55.4	-41.7	0	0	0	114.1
275	G	87.7	Confident	94.5	Very high	49 Å²	49	19.9 Å²	19.9	51%	0.505	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	19.7	-178.4	0	0	0	0	0	115	R41 K273	R41-G275 PolarHBondContact NE-O 3.24Å; K273-G275 PolarHBondContact O-N 2.89Å
276	T	92.5	Very high	94.3	Very high	25 Å²	25	21 Å²	21	15%	0.153	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140.6	174.1	49.9	0	0	0	0	110.9	I38 R41 K273	I38-T276 HydrophobicContact CG2-CG2 4.38Å; R41-T276 HydrophobicContact CG-CG2 3.81Å; R41-T276 VanDerWaalsContact NE-CG2 3.27Å; K273-T276 PolarHBondContact N-O 3.16Å; K273-T276 PolarHBondContact O-N 2.82Å; K273-T276 PolarHBondContact O-OG1 2.92Å
277	F	96.3	Very high	93.6	Very high	9 Å²	9	22.3 Å²	22.3	4%	0.039	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	126.9	170.2	-77.4	-84.1	0	0	0	110.9	G40 P46 W71 I185 C186 A270 C271 L272	G40-F277 WeakPolarHBondContact CA-O 3.36Å; G40-F277 PolarHBondContact O-N 3.15Å; P46-F277 HydrophobicContact CG-CE2 4.08Å; P46-F277 HydrophobicContact CG-CZ 3.97Å; W71-F277 HydrophobicContact CH2-CB 3.46Å; W71-F277 VanDerWaalsContact CH2-CB 3.46Å; W71-F277 HydrophobicContact CH2-CD1 4.37Å; W71-F277 AromaticContact CH2-CD2 3.54Å; W71-F277 HydrophobicContact CH2-CD2 3.54Å; W71-F277 HydrophobicContact CH2-CE2 4.35Å; W71-F277 AromaticContact CH2-CG 3.54Å; W71-F277 HydrophobicContact CH2-CG 3.54Å; W71-F277 HydrophobicContact CZ2-CB 3.72Å; W71-F277 HydrophobicContact CZ2-CD1 4.21Å; W71-F277 HydrophobicContact CZ2-CD2 4.17Å; W71-F277 AromaticContact CZ2-CG 3.78Å; W71-F277 HydrophobicContact CZ2-CG 3.78Å; W71-F277 HydrophobicContact CZ3-CB 4.17Å; I185-F277 HydrophobicContact CD1-CB 4.4Å; I185-F277 HydrophobicContact CG1-CB 4.45Å; I185-F277 WeakPolarHBondContact CG1-O 3.32Å; C186-F277 WeakPolarHBondContact CB-O 3.13Å; C186-F277 PolarHBondContact N-O 3.35Å; A270-F277 HydrophobicContact CB-CD1 4.01Å; C271-F277 WeakPolarHBondContact O-CA 3.05Å; L272-F277 HydrophobicContact CB-CD1 4.37Å; L272-F277 HydrophobicContact CB-CE1 4.08Å; L272-F277 HydrophobicContact CB-CZ 4.33Å; L272-F277 HydrophobicContact CD1-CD2 4.04Å; L272-F277 HydrophobicContact CD1-CE2 3.96Å; L272-F277 HydrophobicContact CD1-CG 4.42Å; L272-F277 HydrophobicContact CD1-CZ 4.25Å
278	T	97.3	Very high	92.7	Very high	10 Å²	10	25.2 Å²	25.2	6%	0.061	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.1	179.7	-62.1	0	0	0	0	109.9	C186 P188 C271 Y280	C186-T278 WeakPolarHBondContact O-CA 3.28Å; P188-T278 HydrophobicContact CB-CG2 3.84Å; P188-T278 HydrophobicContact CG-CG2 4.39Å; C271-T278 PolarHBondContact N-O 2.04Å; C271-T278 PolarHBondContact O-N 2.87Å; T278-Y280 HydrophobicContact CG2-CD2 4.18Å; T278-Y280 HydrophobicContact CG2-CE2 3.71Å; T278-Y280 WeakPolarHBondContact O-CD2 3.23Å; T278-Y280 PolarHBondContact O-N 2.89Å
279	L	98.4	Very high	91.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	98.7	-178	-175.3	69.4	0	0	0	111.1	S89 I91 L103 I185 C186 L187 P188 P268 G281 V303	S89-L279 WeakPolarHBondContact OG-CD1 3.2Å; I91-L279 HydrophobicContact CG2-CD2 4.02Å; L103-L279 HydrophobicContact CD1-CD2 3.81Å; I185-L279 HydrophobicContact CD1-CB 3.86Å; I185-L279 HydrophobicContact CD1-CD1 4.27Å; I185-L279 HydrophobicContact CG1-CB 4.11Å; I185-L279 HydrophobicContact CG2-CB 3.78Å; I185-L279 HydrophobicContact CG2-CD2 4.18Å; I185-L279 HydrophobicContact CG2-CG 4.39Å; C186-L279 PolarHBondContact O-N 3.06Å; L187-L279 HydrophobicContact CD2-CD2 4.41Å; P188-L279 WeakPolarHBondContact CD-O 3.33Å; P268-L279 HydrophobicContact CB-CD1 3.48Å; P268-L279 VanDerWaalsContact CB-CD1 3.48Å; L279-G281 WeakPolarHBondContact CD1-O 3.49Å; L279-V303 HydrophobicContact CD2-CG2 4.18Å; L279-V303 HydrophobicContact CG-CG2 4.05Å; L279-V303 VanDerWaalsContact O-CB 3.32Å; L279-V303 WeakPolarHBondContact O-CB 3.27Å
280	Y	98	Very high	89.5	Confident	1 Å²	1	35.7 Å²	35.7	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-21.3	179.4	-76.4	-84.3	0	0	0	113.9	P188 E192 P194 P195 L269 C271 K273 T278 V303	P188-Y280 HydrophobicContact CB-CD1 4.2Å; P188-Y280 HydrophobicContact CB-CE1 3.89Å; E192-Y280 HydrophobicContact CG-CE1 4.36Å; E192-Y280 PolarHBondContact OE1-OH 3.02Å; P194-Y280 HydrophobicContact CB-CD1 4.03Å; P194-Y280 HydrophobicContact CB-CG 4.32Å; P194-Y280 HydrophobicContact CG-CD1 4.3Å; P195-Y280 HydrophobicContact CG-CE2 4.21Å; L269-Y280 PolarHBondContact O-N 3.45Å; C271-Y280 HydrophobicContact CB-CD2 3.61Å; C271-Y280 HydrophobicContact CB-CE2 3.85Å; K273-Y280 WeakPolarHBondContact CD-OH 3.34Å; T278-Y280 HydrophobicContact CG2-CD2 4.18Å; T278-Y280 HydrophobicContact CG2-CE2 3.71Å; T278-Y280 WeakPolarHBondContact O-CD2 3.23Å; T278-Y280 PolarHBondContact O-N 2.89Å; Y280-V303 PolarHBondContact O-N 3.2Å
281	G	97.9	Very high	86.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	149.8	-174.7	0	0	0	0	0	113.1	L269 L279 S301	L269-G281 PolarHBondContact N-O 2.97Å; L279-G281 WeakPolarHBondContact CD1-O 3.49Å; G281-S301 WeakPolarHBondContact CA-O 3.38Å
282	V	98.2	Very high	84.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.2	165.9	173.6	0	0	0	0	107.5	L103 T104 A105 I167 S284 F300 S301 V303	L103-V282 HydrophobicContact CB-CG2 4.21Å; T104-V282 VanDerWaalsContact C-CG1 3.42Å; A105-V282 HydrophobicContact CB-CG1 4.39Å; I167-V282 HydrophobicContact CD1-CG2 4.33Å; I167-V282 HydrophobicContact CG1-CG2 4.48Å; V282-S284 PolarHBondContact O-N 2.86Å; V282-F300 CarbonylContact O-C 3.59Å; V282-F300 WeakPolarHBondContact O-CA 3.26Å; V282-F300 WeakPolarHBondContact O-CB 3.34Å; V282-S301 PolarHBondContact N-O 2.99Å; V282-S301 VanDerWaalsContact N-O 3.13Å; V282-S301 PolarHBondContact O-N 2.9Å; V282-V303 HydrophobicContact CG2-CG2 3.94Å
283	L	95.6	Very high	82.7	Confident	6 Å²	6	48.8 Å²	48.8	3%	0.031	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	126.1	-172.8	179.2	61.5	0	0	0	111.3	A260 D264 G266 G267 Q298 F300	A260-L283 HydrophobicContact CB-CD1 4.37Å; A260-L283 HydrophobicContact CB-CD2 3.28Å; A260-L283 HydrophobicContact CB-CG 4.49Å; D264-L283 HydrophobicContact CB-CD2 3.6Å; G266-L283 PolarHBondContact N-O 3.15Å; G267-L283 PolarHBondContact O-N 3.29Å; L283-Q298 HydrophobicContact CD1-CB 4.11Å; L283-Q298 HydrophobicContact CD1-CG 4.5Å; L283-F300 HydrophobicContact CB-CD1 3.83Å; L283-F300 HydrophobicContact CB-CE1 3.66Å; L283-F300 HydrophobicContact CD1-CD1 4.15Å; L283-F300 HydrophobicContact CD1-CE1 3.68Å; L283-F300 HydrophobicContact CD1-CE2 4.24Å; L283-F300 HydrophobicContact CD1-CZ 3.71Å; L283-F300 HydrophobicContact CG-CE1 4.2Å
284	S	93.6	Very high	81.1	Confident	6 Å²	6	50 Å²	50	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-63.3	-178.2	-179.6	0	0	0	0	111.3	H107 D166 V282 A299	H107-S284 PolarHBondContact CE1-O 2.83Å; H107-S284 VanDerWaalsContact CE1-O 3.29Å; D166-S284 VanDerWaalsContact CB-OG 3.27Å; D166-S284 WeakPolarHBondContact CB-OG 3.44Å; D166-S284 WeakPolarHBondContact OD2-CA 3.18Å; D166-S284 VanDerWaalsContact OD2-CB 3.32Å; D166-S284 WeakPolarHBondContact OD2-CB 3.06Å; D166-S284 PolarHBondContact OD2-OG 2.8Å; V282-S284 PolarHBondContact O-N 2.86Å; S284-A299 WeakPolarHBondContact CB-O 3.24Å; S284-A299 PolarHBondContact N-O 3.22Å
285	F	89.7	Confident	80.2	Confident	26 Å²	26	46.4 Å²	46.4	11%	0.114	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	159.9	-178.4	63.6	-87.2	0	0	0	112.4	F163 L242 M248 F287 A299	F163-F285 HydrophobicContact CB-CD1 3.61Å; F163-F285 HydrophobicContact CB-CE1 3.58Å; F163-F285 HydrophobicContact CD1-CD1 4.44Å; F163-F285 AromaticContact CG-CD1 3.96Å; F163-F285 HydrophobicContact CG-CD1 3.96Å; F163-F285 HydrophobicContact CG-CE1 4.21Å; L242-F285 HydrophobicContact CB-CE2 4.22Å; L242-F285 HydrophobicContact CB-CZ 4Å; M248-F285 HydrophobicContact CE-CE1 4.05Å; M248-F285 HydrophobicContact SD-CE1 4.1Å; M248-F285 HydrophobicContact SD-CZ 4.22Å; F285-F287 HydrophobicContact CD2-CB 4.41Å; F285-F287 AromaticContact CD2-CD1 3.85Å; F285-F287 HydrophobicContact CD2-CD1 3.85Å; F285-F287 HydrophobicContact CE2-CB 4.39Å; F285-F287 AromaticContact CE2-CD1 3.48Å; F285-F287 HydrophobicContact CE2-CD1 3.48Å; F285-F287 VanDerWaalsContact CE2-CD1 3.48Å; F285-F287 HydrophobicContact CE2-CE1 4.09Å; F285-F287 HydrophobicContact CE2-CG 4.19Å; F285-F287 HydrophobicContact CZ-CD1 4.49Å; F285-A299 HydrophobicContact CD1-CB 3.92Å; F285-A299 HydrophobicContact CD2-CB 4.13Å; F285-A299 HydrophobicContact CE1-CB 3.49Å; F285-A299 VanDerWaalsContact CE1-CB 3.49Å; F285-A299 HydrophobicContact CE2-CB 3.75Å; F285-A299 HydrophobicContact CG-CB 4.21Å; F285-A299 HydrophobicContact CZ-CB 3.4Å; F285-A299 VanDerWaalsContact CZ-CB 3.4Å; F285-A299 PolarHBondContact N-O 2.89Å; F285-A299 PolarHBondContact O-N 3.28Å
286	A	85.8	Confident	79.6	Confident	47 Å²	47	45.6 Å²	45.6	39%	0.388	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	151.6	169.4	0	0	0	0	0	110.4	R297 Q298	A286-R297 CarbonylContact C-O 3.55Å; A286-R297 VanDerWaalsContact CA-O 3.32Å; A286-R297 WeakPolarHBondContact CA-O 3.35Å; A286-Q298 HydrophobicContact CB-CG 4.48Å
287	F	82.3	Confident	79.3	Confident	26 Å²	26	46.3 Å²	46.3	11%	0.114	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	155.3	176.7	63.3	-81.7	0	0	0	111.1	V238 F285 E289 R297 A299	V238-F287 HydrophobicContact CG1-CE2 3.83Å; V238-F287 HydrophobicContact CG1-CZ 3.59Å; F285-F287 HydrophobicContact CD2-CB 4.41Å; F285-F287 AromaticContact CD2-CD1 3.85Å; F285-F287 HydrophobicContact CD2-CD1 3.85Å; F285-F287 HydrophobicContact CE2-CB 4.39Å; F285-F287 AromaticContact CE2-CD1 3.48Å; F285-F287 HydrophobicContact CE2-CD1 3.48Å; F285-F287 VanDerWaalsContact CE2-CD1 3.48Å; F285-F287 HydrophobicContact CE2-CE1 4.09Å; F285-F287 HydrophobicContact CE2-CG 4.19Å; F285-F287 HydrophobicContact CZ-CD1 4.49Å; F287-E289 HydrophobicContact CE2-CG 4.04Å; F287-R297 HydrophobicContact CD1-CB 4.17Å; F287-R297 HydrophobicContact CD2-CB 4.09Å; F287-R297 HydrophobicContact CE1-CB 3.67Å; F287-R297 HydrophobicContact CE2-CB 3.59Å; F287-R297 HydrophobicContact CE2-CG 3.94Å; F287-R297 HydrophobicContact CG-CB 4.36Å; F287-R297 HydrophobicContact CZ-CB 3.36Å; F287-R297 HydrophobicContact CZ-CG 4.05Å; F287-R297 PolarHBondContact N-O 3.17Å; F287-R297 PolarHBondContact O-N 2.96Å; F287-A299 HydrophobicContact CD1-CB 4.42Å; F287-A299 HydrophobicContact CE1-CB 3.97Å
288	A	76.2	Confident	79	Confident	61 Å²	61	45.9 Å²	45.9	50%	0.504	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.9	173.8	0	0	0	0	0	110.9	L294	A288-L294 HydrophobicContact CB-CD2 4.03Å
289	E	68.7	Low	78.7	Confident	27 Å²	27	45.4 Å²	45.4	13%	0.126	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-74.2	144.7	166.4	-71.9	-177.9	155.7	0	0	109.9	N239 F287 K295 R297	N239-E289 PolarHBondContact N-OE1 3.06Å; F287-E289 HydrophobicContact CE2-CG 4.04Å; E289-K295 PolarHBondContact N-O 3.27Å; E289-R297 HydrophobicContact CG-CG 3.74Å; E289-R297 IonicContact OE1-NE 3.2Å; E289-R297 IonicContact OE2-CZ 2.8Å; E289-R297 IonicContact OE2-NE 2.7Å; E289-R297 PolarHBondContact OE2-NE 3.34Å; E289-R297 IonicContact OE2-NH2 3.94Å; E289-R297 PolarHBondContact OE2-NH2 3.33Å
290	K	56.9	Low	78.6	Confident	194 Å²	194	45.4 Å²	45.4	84%	0.843	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-56.4	147.5	-173	-73.9	-177.5	177.9	177.8	0	113.1
291	C	42.3	Very low	78.6	Confident	98 Å²	98	45.5 Å²	45.5	66%	0.662	25%	0.252	S	S	*	.	S	Bend	trans	-37.3	150.4	175.8	-78.9	0	0	0	0	116.2
292	P	48.8	Very low	78.6	Confident	127 Å²	127	46 Å²	46	83%	0.825	25%	0.254	S	S	*	.	S	Bend	cis	-99.7	-14.9	24.3	35	-34.3	0	0	0	116.1
293	L	53.1	Low	78.6	Confident	106 Å²	106	46 Å²	46	56%	0.555	25%	0.254	S	S	*	.	S	Bend	trans	-103.3	103.4	174.3	-65.7	164.9	0	0	0	106.3	I256 K295	I256-L293 HydrophobicContact CD1-CD2 4.41Å; L293-K295 HydrophobicContact CB-CG 4.35Å; L293-K295 PolarHBondContact O-N 2.82Å
294	L	56.9	Low	78.7	Confident	90 Å²	90	45.8 Å²	45.8	47%	0.471	25%	0.253	S	S	.	.			trans	-65.2	77.1	171.7	-69.6	166.7	0	0	0	108.2	A288 E296	A288-L294 HydrophobicContact CB-CD2 4.03Å; L294-E296 PolarHBondContact O-N 3.22Å
295	K	67.7	Low	78.9	Confident	67 Å²	67	50.3 Å²	50.3	29%	0.291	27%	0.27	S	S	.	.			trans	-76.2	115	170.5	-71.2	-165	174.8	-160.5	0	106.6	D254 E289 L293	D254-K295 IonicContact OD1-NZ 2.74Å; E289-K295 PolarHBondContact N-O 3.27Å; L293-K295 HydrophobicContact CB-CG 4.35Å; L293-K295 PolarHBondContact O-N 2.82Å
296	E	75.7	Confident	79.3	Confident	32 Å²	32	49.4 Å²	49.4	15%	0.15	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	136.2	174.4	-167.3	174.6	-175	0	0	109.6	R261 L294	R261-E296 IonicContact CZ-OE1 3.38Å; R261-E296 IonicContact CZ-OE2 3.96Å; R261-E296 IonicContact NH1-OE1 3.92Å; R261-E296 PolarHBondContact NH1-OE1 2.77Å; R261-E296 IonicContact NH1-OE2 3.41Å; R261-E296 PolarHBondContact NH1-OE2 2.96Å; R261-E296 IonicContact NH2-OE1 2.73Å; R261-E296 IonicContact NH2-OE2 2.98Å; R261-E296 PolarHBondContact NH2-OE2 3.46Å; L294-E296 PolarHBondContact O-N 3.22Å
297	R	86.5	Confident	79.9	Confident	39 Å²	39	47.5 Å²	47.5	15%	0.147	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.1	177.5	-60.4	-58	-170	176.1	5.2	109.3	T251 A286 F287 E289	T251-R297 VanDerWaalsContact O-CA 3.26Å; T251-R297 WeakPolarHBondContact O-CA 3.41Å; T251-R297 WeakPolarHBondContact O-CD 3.32Å; A286-R297 CarbonylContact C-O 3.55Å; A286-R297 VanDerWaalsContact CA-O 3.32Å; A286-R297 WeakPolarHBondContact CA-O 3.35Å; F287-R297 HydrophobicContact CD1-CB 4.17Å; F287-R297 HydrophobicContact CD2-CB 4.09Å; F287-R297 HydrophobicContact CE1-CB 3.67Å; F287-R297 HydrophobicContact CE2-CB 3.59Å; F287-R297 HydrophobicContact CE2-CG 3.94Å; F287-R297 HydrophobicContact CG-CB 4.36Å; F287-R297 HydrophobicContact CZ-CB 3.36Å; F287-R297 HydrophobicContact CZ-CG 4.05Å; F287-R297 PolarHBondContact N-O 3.17Å; F287-R297 PolarHBondContact O-N 2.96Å; E289-R297 HydrophobicContact CG-CG 3.74Å; E289-R297 IonicContact OE1-NE 3.2Å; E289-R297 IonicContact OE2-CZ 2.8Å; E289-R297 IonicContact OE2-NE 2.7Å; E289-R297 PolarHBondContact OE2-NE 3.34Å; E289-R297 IonicContact OE2-NH2 3.94Å; E289-R297 PolarHBondContact OE2-NH2 3.33Å
298	Q	88.9	Confident	80.6	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.6	175.3	-64.8	165.1	59.8	0	0	108.7	C250 T251 A260 L283 A286 F300	C250-Q298 CarbonylContact C-O 3.52Å; C250-Q298 WeakPolarHBondContact CA-O 3.37Å; T251-Q298 PolarHBondContact N-O 2.81Å; T251-Q298 PolarHBondContact O-N 3.37Å; A260-Q298 VanDerWaalsContact N-CD 3.28Å; L283-Q298 HydrophobicContact CD1-CB 4.11Å; L283-Q298 HydrophobicContact CD1-CG 4.5Å; A286-Q298 HydrophobicContact CB-CG 4.48Å; Q298-F300 HydrophobicContact CB-CD2 4.39Å; Q298-F300 HydrophobicContact CB-CE2 3.47Å; Q298-F300 VanDerWaalsContact CB-CE2 3.47Å; Q298-F300 HydrophobicContact CB-CZ 3.9Å
299	A	92.6	Very high	81.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.6	172.9	0	0	0	0	0	110	F243 M248 V249 S284 F285 F287	F243-A299 HydrophobicContact CD2-CB 4.46Å; M248-A299 HydrophobicContact SD-CB 4.42Å; V249-A299 WeakPolarHBondContact O-CA 3.49Å; S284-A299 WeakPolarHBondContact CB-O 3.24Å; S284-A299 PolarHBondContact N-O 3.22Å; F285-A299 HydrophobicContact CD1-CB 3.92Å; F285-A299 HydrophobicContact CD2-CB 4.13Å; F285-A299 HydrophobicContact CE1-CB 3.49Å; F285-A299 VanDerWaalsContact CE1-CB 3.49Å; F285-A299 HydrophobicContact CE2-CB 3.75Å; F285-A299 HydrophobicContact CG-CB 4.21Å; F285-A299 HydrophobicContact CZ-CB 3.4Å; F285-A299 VanDerWaalsContact CZ-CB 3.4Å; F285-A299 PolarHBondContact N-O 2.89Å; F285-A299 PolarHBondContact O-N 3.28Å; F287-A299 HydrophobicContact CD1-CB 4.42Å; F287-A299 HydrophobicContact CE1-CB 3.97Å
300	F	95.9	Very high	83	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.4	176.8	-58	-105.2	0	0	0	109.4	V203 M248 V249 T251 L269 V282 L283 Q298 K302	V203-F300 HydrophobicContact CG1-CE1 4.4Å; V203-F300 HydrophobicContact CG1-CZ 4.5Å; V203-F300 HydrophobicContact CG2-CE1 3.97Å; V203-F300 HydrophobicContact CG2-CZ 3.6Å; M248-F300 CarbonylContact C-O 3.56Å; M248-F300 WeakPolarHBondContact CA-O 3.33Å; V249-F300 HydrophobicContact CB-CB 4.36Å; V249-F300 PolarHBondContact N-O 2.91Å; V249-F300 PolarHBondContact O-N 3.4Å; T251-F300 HydrophobicContact CG2-CD2 4.04Å; T251-F300 HydrophobicContact CG2-CE2 3.58Å; T251-F300 HydrophobicContact CG2-CZ 4.38Å; T251-F300 WeakPolarHBondContact OG1-CE2 3.43Å; L269-F300 HydrophobicContact CB-CD1 3.63Å; L269-F300 HydrophobicContact CB-CE1 3.74Å; L269-F300 HydrophobicContact CB-CG 4.18Å; L269-F300 HydrophobicContact CB-CZ 4.36Å; L269-F300 HydrophobicContact CD1-CZ 4.4Å; L269-F300 HydrophobicContact CD2-CD1 4.49Å; L269-F300 HydrophobicContact CD2-CD2 4.17Å; L269-F300 HydrophobicContact CD2-CE2 4.45Å; L269-F300 HydrophobicContact CD2-CG 4.23Å; V282-F300 CarbonylContact O-C 3.59Å; V282-F300 WeakPolarHBondContact O-CA 3.26Å; V282-F300 WeakPolarHBondContact O-CB 3.34Å; L283-F300 HydrophobicContact CB-CD1 3.83Å; L283-F300 HydrophobicContact CB-CE1 3.66Å; L283-F300 HydrophobicContact CD1-CD1 4.15Å; L283-F300 HydrophobicContact CD1-CE1 3.68Å; L283-F300 HydrophobicContact CD1-CE2 4.24Å; L283-F300 HydrophobicContact CD1-CZ 3.71Å; L283-F300 HydrophobicContact CG-CE1 4.2Å; Q298-F300 HydrophobicContact CB-CD2 4.39Å; Q298-F300 HydrophobicContact CB-CE2 3.47Å; Q298-F300 VanDerWaalsContact CB-CE2 3.47Å; Q298-F300 HydrophobicContact CB-CZ 3.9Å; F300-K302 PolarHBondContact O-N 3.03Å
301	S	97.6	Very high	84.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	119	165.6	-66.4	0	0	0	0	109.2	D166 G281 V282 V303	D166-S301 VanDerWaalsContact C-OG 3.24Å; D166-S301 PolarHBondContact O-OG 3.38Å; G281-S301 WeakPolarHBondContact CA-O 3.38Å; V282-S301 PolarHBondContact N-O 2.99Å; V282-S301 VanDerWaalsContact N-O 3.13Å; V282-S301 PolarHBondContact O-N 2.9Å; S301-V303 PolarHBondContact O-N 3.13Å; S301-V303 VanDerWaalsContact O-N 3.15Å
302	K	97.6	Very high	87.5	Confident	12 Å²	12	44.1 Å²	44.1	5%	0.052	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	105.3	-176.3	-177.5	-179.7	-89.9	-172.9	0	110.2	E193 S247 V249 F300 S304 Y305 Y306	E193-K302 VanDerWaalsContact CD-NZ 3.28Å; E193-K302 IonicContact OE1-NZ 2.86Å; E193-K302 PolarHBondContact OE1-NZ 3.46Å; E193-K302 IonicContact OE2-NZ 3.58Å; E193-K302 PolarHBondContact OE2-NZ 3.41Å; S247-K302 WeakPolarHBondContact O-CB 3.44Å; S247-K302 PolarHBondContact O-N 3.39Å; V249-K302 HydrophobicContact CG2-CB 3.73Å; V249-K302 HydrophobicContact CG2-CD 4.4Å; V249-K302 HydrophobicContact CG2-CG 3.74Å; F300-K302 PolarHBondContact O-N 3.03Å; K302-S304 VanDerWaalsContact C-N 3.3Å; K302-S304 WeakPolarHBondContact CG-OG 3.33Å; K302-S304 PolarHBondContact O-N 3.4Å; K302-Y305 WeakPolarHBondContact O-CB 3.41Å; K302-Y305 PolarHBondContact O-N 2.74Å; K302-Y306 VanDerWaalsContact O-CD2 3.24Å; K302-Y306 WeakPolarHBondContact O-CD2 3.38Å; K302-Y306 PolarHBondContact O-N 3.11Å
303	V	98.4	Very high	89.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-36.9	-171.2	173.4	0	0	0	0	112.4	L103 L187 P188 L279 Y280 V282 S301 Y305 Y306 L307 I310	L103-V303 HydrophobicContact CD1-CG1 4.46Å; L187-V303 HydrophobicContact CD2-CG1 3.98Å; P188-V303 HydrophobicContact CG-CB 4.24Å; P188-V303 HydrophobicContact CG-CG1 4.01Å; L279-V303 HydrophobicContact CD2-CG2 4.18Å; L279-V303 HydrophobicContact CG-CG2 4.05Å; L279-V303 VanDerWaalsContact O-CB 3.32Å; L279-V303 WeakPolarHBondContact O-CB 3.27Å; Y280-V303 PolarHBondContact O-N 3.2Å; V282-V303 HydrophobicContact CG2-CG2 3.94Å; S301-V303 PolarHBondContact O-N 3.13Å; S301-V303 VanDerWaalsContact O-N 3.15Å; V303-Y305 VanDerWaalsContact C-N 3.26Å; V303-Y305 PolarHBondContact O-N 3.03Å; V303-Y306 CarbonylContact O-C 3.57Å; V303-Y306 PolarHBondContact O-N 2.52Å; V303-L307 PolarHBondContact O-N 2.93Å; V303-I310 HydrophobicContact CG1-CD1 4.04Å
304	S	97.9	Very high	91.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.1	-30.6	176.9	54.2	0	0	0	0	113.4	H189 N191 E192 K302	H189-S304 VanDerWaalsContact O-CB 3.24Å; H189-S304 WeakPolarHBondContact O-CB 3.13Å; N191-S304 PolarHBondContact N-O 2.96Å; E192-S304 WeakPolarHBondContact O-CB 3.28Å; E192-S304 PolarHBondContact O-OG 2.73Å; K302-S304 VanDerWaalsContact C-N 3.3Å; K302-S304 WeakPolarHBondContact CG-OG 3.33Å; K302-S304 PolarHBondContact O-N 3.4Å
305	Y	97.9	Very high	93.7	Very high	102 Å²	102	33.2 Å²	33.2	40%	0.4	16%	0.16	S	C	.	.	H	α-helix	trans	-72.7	-40.2	173.4	174.9	-98	0	0	0	111.7	K246 K302 V303 L307 P308	K246-Y305 WeakPolarHBondContact O-CD2 3.48Å; K302-Y305 WeakPolarHBondContact O-CB 3.41Å; K302-Y305 PolarHBondContact O-N 2.74Å; V303-Y305 VanDerWaalsContact C-N 3.26Å; V303-Y305 PolarHBondContact O-N 3.03Å; Y305-L307 VanDerWaalsContact C-N 3.3Å; Y305-L307 PolarHBondContact O-N 2.94Å; Y305-P308 WeakPolarHBondContact O-CD 3.2Å
306	Y	98.2	Very high	95	Very high	7 Å²	7	36.7 Å²	36.7	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-82.9	-2.6	179.4	-68.5	-71.4	0	0	0	114.2	D164 Q165 I167 S247 K302 V303 P308 W309 I310	D164-Y306 PolarHBondContact OD1-OH 3.45Å; Q165-Y306 WeakPolarHBondContact CA-OH 3.45Å; Q165-Y306 HydrophobicContact CB-CE1 4.07Å; Q165-Y306 HydrophobicContact CG-CE1 3.95Å; Q165-Y306 WeakPolarHBondContact CG-OH 3.42Å; Q165-Y306 PolarHBondContact N-OH 3.26Å; Q165-Y306 VanDerWaalsContact N-OH 3.13Å; I167-Y306 HydrophobicContact CD1-CD2 4.28Å; I167-Y306 HydrophobicContact CD1-CG 4.23Å; I167-Y306 HydrophobicContact CG2-CD1 3.88Å; I167-Y306 HydrophobicContact CG2-CD2 4.21Å; I167-Y306 HydrophobicContact CG2-CE1 4.2Å; I167-Y306 HydrophobicContact CG2-CG 3.91Å; S247-Y306 WeakPolarHBondContact CB-OH 3.38Å; S247-Y306 WeakPolarHBondContact O-CE2 3.49Å; K302-Y306 VanDerWaalsContact O-CD2 3.24Å; K302-Y306 WeakPolarHBondContact O-CD2 3.38Å; K302-Y306 PolarHBondContact O-N 3.11Å; V303-Y306 CarbonylContact O-C 3.57Å; V303-Y306 PolarHBondContact O-N 2.52Å; Y306-P308 VanDerWaalsContact C-CD 3.48Å; Y306-W309 WeakPolarHBondContact O-CA 3.46Å; Y306-W309 WeakPolarHBondContact O-CB 3.11Å; Y306-W309 PolarHBondContact O-N 2.63Å; Y306-I310 WeakPolarHBondContact O-CG1 3.48Å; Y306-I310 PolarHBondContact O-N 3.47Å
307	L	97.5	Very high	95.9	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-54	-43.3	-176.3	-163	68.7	0	0	0	113.3	L187 P188 E190 V303 Y305 W309 I310 M311	L187-L307 HydrophobicContact CB-CD1 4.29Å; L187-L307 HydrophobicContact CD1-CD1 4.04Å; P188-L307 WeakPolarHBondContact O-CD2 3.34Å; E190-L307 HydrophobicContact CB-CD2 4.02Å; V303-L307 PolarHBondContact O-N 2.93Å; Y305-L307 VanDerWaalsContact C-N 3.3Å; Y305-L307 PolarHBondContact O-N 2.94Å; L307-W309 VanDerWaalsContact C-N 3.3Å; L307-W309 PolarHBondContact O-N 2.96Å; L307-I310 HydrophobicContact CD1-CD1 4.49Å; L307-I310 WeakPolarHBondContact O-CB 3.36Å; L307-I310 PolarHBondContact O-N 2.65Å; L307-I310 VanDerWaalsContact O-N 3.14Å; L307-M311 HydrophobicContact CD1-CE 4.27Å; L307-M311 HydrophobicContact CD2-CE 3.65Å; L307-M311 HydrophobicContact CG-CE 3.72Å; L307-M311 HydrophobicContact CG-CG 4.36Å; L307-M311 VanDerWaalsContact O-CG 3.23Å; L307-M311 WeakPolarHBondContact O-CG 3.15Å; L307-M311 PolarHBondContact O-N 3.07Å
308	P	97.3	Very high	95.4	Very high	55 Å²	55	39.7 Å²	39.7	36%	0.357	20%	0.203	S	C	.	.	H	α-helix	trans	-59.8	-38.9	175.5	-25.8	37.6	0	0	0	113.1	E190 Y305 Y306 K312	E190-P308 VanDerWaalsContact CD-CG 3.48Å; E190-P308 HydrophobicContact CG-CG 3.85Å; E190-P308 WeakPolarHBondContact OE1-CG 3.14Å; Y305-P308 WeakPolarHBondContact O-CD 3.2Å; Y306-P308 VanDerWaalsContact C-CD 3.48Å; P308-K312 VanDerWaalsContact O-CB 3.27Å; P308-K312 WeakPolarHBondContact O-CB 3.48Å; P308-K312 PolarHBondContact O-N 3.13Å
309	W	97.9	Very high	95.7	Very high	57 Å²	57	41.6 Å²	41.6	22%	0.216	21%	0.213	C	C	.	.	H	α-helix	trans	-66.8	-43	175.1	172.2	90.6	0	0	0	111.2	A154 A156 I167 L169 Y306 L307 K312 T313	A154-W309 HydrophobicContact CB-CZ2 4.31Å; A156-W309 HydrophobicContact CB-CD2 4.35Å; A156-W309 HydrophobicContact CB-CZ2 4.16Å; I167-W309 HydrophobicContact CD1-CZ3 4.4Å; I167-W309 HydrophobicContact CG1-CZ3 4.17Å; I167-W309 HydrophobicContact CG2-CE3 4.21Å; I167-W309 HydrophobicContact CG2-CH2 4.44Å; I167-W309 HydrophobicContact CG2-CZ3 3.99Å; L169-W309 HydrophobicContact CB-CH2 3.9Å; L169-W309 HydrophobicContact CB-CZ3 4.25Å; Y306-W309 WeakPolarHBondContact O-CA 3.46Å; Y306-W309 WeakPolarHBondContact O-CB 3.11Å; Y306-W309 PolarHBondContact O-N 2.63Å; L307-W309 VanDerWaalsContact C-N 3.3Å; L307-W309 PolarHBondContact O-N 2.96Å; W309-K312 PolarHBondContact O-N 3.36Å; W309-T313 VanDerWaalsContact O-CB 3.28Å; W309-T313 WeakPolarHBondContact O-CB 3.2Å; W309-T313 PolarHBondContact O-N 2.91Å; W309-T313 PolarHBondContact O-OG1 2.71Å
310	I	97.9	Very high	95.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-52.2	176.6	-63.8	167.2	0	0	0	109.8	I91 L103 I167 V303 Y306 L307 K312 T313 I314	I91-I310 HydrophobicContact CD1-CG2 4.45Å; L103-I310 HydrophobicContact CD1-CD1 3.83Å; L103-I310 HydrophobicContact CD2-CD1 4.21Å; L103-I310 HydrophobicContact CD2-CG1 4.22Å; I167-I310 HydrophobicContact CD1-CD1 4.26Å; V303-I310 HydrophobicContact CG1-CD1 4.04Å; Y306-I310 WeakPolarHBondContact O-CG1 3.48Å; Y306-I310 PolarHBondContact O-N 3.47Å; L307-I310 HydrophobicContact CD1-CD1 4.49Å; L307-I310 WeakPolarHBondContact O-CB 3.36Å; L307-I310 PolarHBondContact O-N 2.65Å; L307-I310 VanDerWaalsContact O-N 3.14Å; I310-K312 PolarHBondContact O-N 2.98Å; I310-T313 PolarHBondContact O-N 2.87Å; I310-I314 HydrophobicContact CG2-CD1 3.74Å; I310-I314 HydrophobicContact CG2-CG1 4.42Å; I310-I314 WeakPolarHBondContact O-CG1 3.44Å; I310-I314 PolarHBondContact O-N 3.46Å
311	M	96.3	Very high	95.9	Very high	87 Å²	87	46.2 Å²	46.2	43%	0.429	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-46.4	-178.7	-59.9	-149.6	-177.8	0	0	112.1	W93 L307 T313 I314 S315	W93-M311 HydrophobicContact CH2-CB 4.14Å; W93-M311 HydrophobicContact CH2-CG 3.76Å; W93-M311 HydrophobicContact CH2-SD 4.23Å; W93-M311 HydrophobicContact CZ3-CG 4.29Å; L307-M311 HydrophobicContact CD1-CE 4.27Å; L307-M311 HydrophobicContact CD2-CE 3.65Å; L307-M311 HydrophobicContact CG-CE 3.72Å; L307-M311 HydrophobicContact CG-CG 4.36Å; L307-M311 VanDerWaalsContact O-CG 3.23Å; L307-M311 WeakPolarHBondContact O-CG 3.15Å; L307-M311 PolarHBondContact O-N 3.07Å; M311-T313 VanDerWaalsContact C-N 3.28Å; M311-T313 PolarHBondContact O-N 3.01Å; M311-I314 PolarHBondContact O-N 2.83Å; M311-S315 WeakPolarHBondContact O-CB 3.45Å; M311-S315 PolarHBondContact O-N 3.03Å
312	K	97.2	Very high	95.8	Very high	136 Å²	136	48.8 Å²	48.8	59%	0.591	25%	0.249	S	C	*	.	H	α-helix	trans	-61.5	-38.6	177.9	-176.1	178.5	-176.9	178.8	0	111.6	P308 W309 I310 K316	P308-K312 VanDerWaalsContact O-CB 3.27Å; P308-K312 WeakPolarHBondContact O-CB 3.48Å; P308-K312 PolarHBondContact O-N 3.13Å; W309-K312 PolarHBondContact O-N 3.36Å; I310-K312 PolarHBondContact O-N 2.98Å; K312-K316 WeakPolarHBondContact O-CG 3.24Å; K312-K316 PolarHBondContact O-N 3.1Å
313	T	97.6	Very high	95.7	Very high	8 Å²	8	51.1 Å²	51.1	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-71.3	-44.2	-179.9	-58.3	0	0	0	0	111.4	A154 L169 W309 I310 M311 S315 K316 F317	A154-T313 HydrophobicContact CB-CG2 3.34Å; L169-T313 HydrophobicContact CB-CG2 4.42Å; L169-T313 HydrophobicContact CD2-CG2 3.68Å; W309-T313 VanDerWaalsContact O-CB 3.28Å; W309-T313 WeakPolarHBondContact O-CB 3.2Å; W309-T313 PolarHBondContact O-N 2.91Å; W309-T313 PolarHBondContact O-OG1 2.71Å; I310-T313 PolarHBondContact O-N 2.87Å; M311-T313 VanDerWaalsContact C-N 3.28Å; M311-T313 PolarHBondContact O-N 3.01Å; T313-S315 VanDerWaalsContact C-N 3.27Å; T313-S315 PolarHBondContact O-N 2.74Å; T313-K316 WeakPolarHBondContact O-CB 3.42Å; T313-K316 PolarHBondContact O-N 3.02Å; T313-K316 VanDerWaalsContact O-N 3.1Å; T313-F317 HydrophobicContact CG2-CE1 4.11Å; T313-F317 HydrophobicContact CG2-CE2 4.1Å; T313-F317 HydrophobicContact CG2-CZ 3.89Å; T313-F317 PolarHBondContact O-N 3.21Å
314	I	96.1	Very high	95.5	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-39.6	175.3	-67.2	170.7	0	0	0	111.3	I91 W93 F101 L169 I310 M311 K316 F317 S318	I91-I314 HydrophobicContact CD1-CD1 4.3Å; W93-I314 HydrophobicContact CD2-CD1 3.48Å; W93-I314 VanDerWaalsContact CD2-CD1 3.48Å; W93-I314 HydrophobicContact CD2-CG2 4.32Å; W93-I314 HydrophobicContact CE3-CD1 3.56Å; W93-I314 HydrophobicContact CG-CD1 4.06Å; W93-I314 HydrophobicContact CG-CG2 4.49Å; W93-I314 HydrophobicContact CH2-CD1 3.97Å; W93-I314 HydrophobicContact CZ2-CB 4.09Å; W93-I314 HydrophobicContact CZ2-CD1 3.87Å; W93-I314 HydrophobicContact CZ2-CG2 3.86Å; W93-I314 HydrophobicContact CZ3-CD1 3.81Å; F101-I314 HydrophobicContact CD1-CG1 4.26Å; F101-I314 HydrophobicContact CD2-CD1 4.3Å; F101-I314 HydrophobicContact CD2-CG1 4.46Å; F101-I314 HydrophobicContact CD2-CG2 4.44Å; F101-I314 HydrophobicContact CE1-CG1 4.25Å; F101-I314 HydrophobicContact CE1-CG2 4.22Å; F101-I314 HydrophobicContact CE2-CG1 4.43Å; F101-I314 HydrophobicContact CE2-CG2 3.69Å; F101-I314 HydrophobicContact CG-CD1 4.41Å; F101-I314 HydrophobicContact CG-CG1 4.38Å; F101-I314 HydrophobicContact CZ-CB 4.43Å; F101-I314 HydrophobicContact CZ-CG1 4.34Å; F101-I314 HydrophobicContact CZ-CG2 3.56Å; L169-I314 HydrophobicContact CD2-CD1 4.42Å; L169-I314 HydrophobicContact CD2-CG1 3.53Å; I310-I314 HydrophobicContact CG2-CD1 3.74Å; I310-I314 HydrophobicContact CG2-CG1 4.42Å; I310-I314 WeakPolarHBondContact O-CG1 3.44Å; I310-I314 PolarHBondContact O-N 3.46Å; M311-I314 PolarHBondContact O-N 2.83Å; I314-K316 VanDerWaalsContact C-N 3.33Å; I314-K316 PolarHBondContact O-N 3.07Å; I314-F317 PolarHBondContact O-N 3.26Å; I314-F317 VanDerWaalsContact O-N 3.14Å; I314-S318 PolarHBondContact O-N 3.41Å; I314-S318 VanDerWaalsContact O-N 3.11Å; I314-S318 PolarHBondContact O-OG 3.31Å; I314-S318 VanDerWaalsContact O-OG 3.14Å
315	S	95.1	Very high	95.4	Very high	84 Å²	84	58.4 Å²	58.4	59%	0.587	30%	0.299	S	S	*	.	H	α-helix	trans	-60.2	-40.2	174.9	-177.2	0	0	0	0	112.6	M311 T313 F317 S318	M311-S315 WeakPolarHBondContact O-CB 3.45Å; M311-S315 PolarHBondContact O-N 3.03Å; T313-S315 VanDerWaalsContact C-N 3.27Å; T313-S315 PolarHBondContact O-N 2.74Å; S315-F317 VanDerWaalsContact C-N 3.3Å; S315-F317 PolarHBondContact O-N 3.1Å; S315-S318 PolarHBondContact O-N 3.39Å
316	K	95.7	Very high	95.2	Very high	141 Å²	141	55.1 Å²	55.1	61%	0.613	29%	0.291	S	S	*	.	H	α-helix	trans	-70.7	-24.2	175	-69.2	173.1	177.3	-176.7	0	113.8	K312 T313 I314	K312-K316 WeakPolarHBondContact O-CG 3.24Å; K312-K316 PolarHBondContact O-N 3.1Å; T313-K316 WeakPolarHBondContact O-CB 3.42Å; T313-K316 PolarHBondContact O-N 3.02Å; T313-K316 VanDerWaalsContact O-N 3.1Å; I314-K316 VanDerWaalsContact C-N 3.33Å; I314-K316 PolarHBondContact O-N 3.07Å
317	F	93.3	Very high	94.9	Very high	21 Å²	21	59.1 Å²	59.1	9%	0.092	31%	0.313	C	S	.	.	H	α-helix	trans	-81.1	-22.2	177	-75	-1.2	0	0	0	112.7	F101 K152 A154 L169 M171 T313 I314 S315	F101-F317 HydrophobicContact CE1-CB 4.36Å; F101-F317 HydrophobicContact CE1-CD2 4.02Å; K152-F317 HydrophobicContact CB-CD1 3.92Å; K152-F317 HydrophobicContact CB-CD2 4.14Å; K152-F317 HydrophobicContact CB-CE1 3.7Å; K152-F317 HydrophobicContact CB-CE2 3.93Å; K152-F317 HydrophobicContact CB-CG 4.12Å; K152-F317 HydrophobicContact CB-CZ 3.7Å; K152-F317 HydrophobicContact CD-CB 3.94Å; K152-F317 HydrophobicContact CD-CD1 3.6Å; K152-F317 HydrophobicContact CD-CE1 4.2Å; K152-F317 HydrophobicContact CD-CG 3.79Å; K152-F317 HydrophobicContact CG-CD1 4.37Å; K152-F317 PolarHBondContact NZ-O 3.46Å; A154-F317 HydrophobicContact CB-CE1 4.09Å; A154-F317 HydrophobicContact CB-CE2 4.47Å; A154-F317 HydrophobicContact CB-CZ 3.56Å; L169-F317 HydrophobicContact CD2-CD2 4.07Å; L169-F317 HydrophobicContact CD2-CE2 3.87Å; L169-F317 HydrophobicContact CG-CE2 4.2Å; M171-F317 HydrophobicContact CB-CD2 3.81Å; M171-F317 HydrophobicContact CB-CE2 4.1Å; M171-F317 HydrophobicContact SD-CB 3.91Å; M171-F317 HydrophobicContact SD-CD2 4.44Å; M171-F317 HydrophobicContact SD-CG 4.41Å; T313-F317 HydrophobicContact CG2-CE1 4.11Å; T313-F317 HydrophobicContact CG2-CE2 4.1Å; T313-F317 HydrophobicContact CG2-CZ 3.89Å; T313-F317 PolarHBondContact O-N 3.21Å; I314-F317 PolarHBondContact O-N 3.26Å; I314-F317 VanDerWaalsContact O-N 3.14Å; S315-F317 VanDerWaalsContact C-N 3.3Å; S315-F317 PolarHBondContact O-N 3.1Å
318	S	77.1	Confident	94.7	Very high	112 Å²	112	63.8 Å²	63.8	78%	0.783	34%	0.338	S	S	*	.			trans	-79.4	0	174	-56	0	0	0	0	111.5	I314 S315	I314-S318 PolarHBondContact O-N 3.41Å; I314-S318 VanDerWaalsContact O-N 3.11Å; I314-S318 PolarHBondContact O-OG 3.31Å; I314-S318 VanDerWaalsContact O-OG 3.14Å; S315-S318 PolarHBondContact O-N 3.39Å

Retrieved 318 of 318 residues in 192.5 ms (Link to these results)

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