A0A077ZGK1_TRITR Loading...

Pkinase Tyr domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGK1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 264 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	38.1	Very low	40.1	Very low	231 Å²	231	142.9 Å²	142.9	100%	1.138	84%	0.836	S	S	*	*				0	118.7	0	-71.5	-175.6	170	0	0	108
2	P	45.2	Very low	40.2	Very low	131 Å²	131	146.8 Å²	146.8	85%	0.851	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-77.6	129.6	175.9	31	-27.3	0	0	0	109.2
3	V	48.3	Very low	40.3	Very low	130 Å²	130	145.2 Å²	145.2	79%	0.788	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-70.5	131.5	176.6	-173.9	0	0	0	0	108.4
4	P	40.2	Very low	40.4	Very low	110 Å²	110	142.2 Å²	142.2	71%	0.714	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.6	177.4	27.9	-28.6	0	0	0	109.5	D6	P4-D6 PolarHBondContact O-N 2.95Å
5	F	43.5	Very low	41.3	Very low	213 Å²	213	145.9 Å²	145.9	93%	0.934	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-72.1	117	167.7	-104.2	-93.1	0	0	0	108.2
6	D	40.7	Very low	42.1	Very low	150 Å²	150	144.9 Å²	144.9	80%	0.802	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-59.3	146.9	175.2	-95.8	-40.1	0	0	0	112.5	P4	P4-D6 PolarHBondContact O-N 2.95Å
7	H	40.2	Very low	43.2	Very low	171 Å²	171	143.2 Å²	143.2	79%	0.792	81%	0.811	S	S	*	*			trans	-42.9	134.4	-175	-78.6	-92.1	0	0	0	114.6	T9	H7-T9 PolarHBondContact O-N 3.02Å
8	A	35.2	Very low	45	Very low	102 Å²	102	139.8 Å²	139.8	84%	0.843	79%	0.793	S	S	*	*			trans	-48.7	103.9	165.5	0	0	0	0	0	110.7	S10	A8-S10 PolarHBondContact O-N 2.85Å
9	T	36.4	Very low	46.7	Very low	135 Å²	135	134.3 Å²	134.3	83%	0.828	77%	0.765	S	S	*	*			trans	-70.3	112.2	163.5	-24.5	0	0	0	0	106.6	H7 A11	H7-T9 PolarHBondContact O-N 3.02Å; T9-A11 VanDerWaalsContact C-N 3.28Å; T9-A11 PolarHBondContact O-N 3.35Å
10	S	35.9	Very low	48.3	Very low	112 Å²	112	130.5 Å²	130.5	78%	0.783	74%	0.742	S	S	*	*			trans	-56.2	92.4	167.9	161.3	0	0	0	0	108.9	A8 K12	A8-S10 PolarHBondContact O-N 2.85Å; S10-K12 PolarHBondContact O-N 3.29Å
11	A	37.6	Very low	49.7	Very low	87 Å²	87	130.3 Å²	130.3	72%	0.719	74%	0.735	S	S	*	*			trans	-64.7	107	171.3	0	0	0	0	0	108.1	T9 C13	T9-A11 VanDerWaalsContact C-N 3.28Å; T9-A11 PolarHBondContact O-N 3.35Å; A11-C13 PolarHBondContact O-N 3.07Å
12	K	41.6	Very low	51.5	Low	189 Å²	189	125.7 Å²	125.7	82%	0.822	70%	0.704	S	S	*	*			trans	-46.7	126.9	157.1	-87.1	175.9	173.8	174.2	0	106.7	S10 C14	S10-K12 PolarHBondContact O-N 3.29Å; K12-C14 VanDerWaalsContact C-N 3.27Å; K12-C14 PolarHBondContact O-N 3.49Å
13	C	41.5	Very low	52.9	Low	126 Å²	126	123.5 Å²	123.5	85%	0.851	69%	0.69	S	S	*	*			trans	-56.4	88.7	177.5	-70.4	0	0	0	0	110.8	A11 K15	A11-C13 PolarHBondContact O-N 3.07Å; C13-K15 PolarHBondContact O-N 3.25Å; C13-K15 VanDerWaalsContact O-N 3.13Å
14	C	41.9	Very low	53.8	Low	104 Å²	104	119.1 Å²	119.1	70%	0.703	66%	0.662	S	S	*	*			trans	-72.8	100	161.8	-68.9	0	0	0	0	106	K12 H16	K12-C14 VanDerWaalsContact C-N 3.27Å; K12-C14 PolarHBondContact O-N 3.49Å; C14-H16 PolarHBondContact O-N 3.25Å
15	K	52.8	Low	55.1	Low	198 Å²	198	120.3 Å²	120.3	86%	0.861	67%	0.667	S	S	*	*			trans	-62.7	90.6	163.5	-77.3	-175	176.8	-178.7	0	107.1	C13 P17	C13-K15 PolarHBondContact O-N 3.25Å; C13-K15 VanDerWaalsContact O-N 3.13Å; K15-P17 WeakPolarHBondContact O-CD 3.17Å
16	H	54.1	Low	55.8	Low	129 Å²	129	112.5 Å²	112.5	60%	0.597	65%	0.647	S	S	*	*			trans	-68.4	120.2	166.7	-100.9	-71.2	0	0	0	107.2	C14 T18 S19	C14-H16 PolarHBondContact O-N 3.25Å; H16-T18 PolarHBondContact O-N 3.47Å; H16-S19 PolarHBondContact O-N 2.64Å; H16-S19 PolarHBondContact O-OG 2.89Å
17	P	61.8	Low	56.7	Low	116 Å²	116	114 Å²	114	75%	0.753	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-1.6	-173.9	24.2	-32.9	0	0	0	114.2	K15	K15-P17 WeakPolarHBondContact O-CD 3.17Å
18	T	74.3	Confident	57.8	Low	82 Å²	82	116 Å²	116	50%	0.503	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.9	27.2	-170.2	53.8	0	0	0	0	113.1	H16 L73	H16-T18 PolarHBondContact O-N 3.47Å; T18-L73 WeakPolarHBondContact O-CB 3.26Å; T18-L73 PolarHBondContact O-N 2.85Å
19	S	77.5	Confident	59.2	Low	35 Å²	35	117 Å²	117	25%	0.245	65%	0.65	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	146.7	-179.3	65.8	0	0	0	0	113.6	H16 L71	H16-S19 PolarHBondContact O-N 2.64Å; H16-S19 PolarHBondContact O-OG 2.89Å; S19-L71 WeakPolarHBondContact CA-O 3.34Å
20	L	79.6	Confident	61.2	Low	59 Å²	59	112.5 Å²	112.5	31%	0.309	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	126.3	174.4	-179	71.2	0	0	0	109.6	L71 L73	L20-L71 PolarHBondContact N-O 3.38Å; L20-L71 PolarHBondContact O-N 2.97Å; L20-L73 HydrophobicContact CB-CD1 4.32Å
21	E	76.5	Confident	63.6	Low	126 Å²	126	109.7 Å²	109.7	59%	0.589	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.8	127.5	174	-72.2	-176.3	-171.3	0	0	110.7	V68	E21-V68 HydrophobicContact CB-CG1 3.7Å; E21-V68 HydrophobicContact CG-CG1 4.01Å
22	R	77	Confident	66	Low	134 Å²	134	109.6 Å²	109.6	51%	0.506	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	105.8	173.9	-167.6	174.6	-178.1	171.9	1.4	110.8	M69	R22-M69 PolarHBondContact N-O 3.43Å; R22-M69 PolarHBondContact O-N 2.9Å
23	P	74.7	Confident	68.2	Low	85 Å²	85	105.5 Å²	105.5	55%	0.552	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.5	149.8	178.4	29	-33.3	0	0	0	111.8	V25 V68	P23-V25 PolarHBondContact O-N 2.79Å; P23-V68 HydrophobicContact CB-CG2 4.49Å
24	L	67.9	Low	70.4	Confident	38 Å²	38	102.9 Å²	102.9	20%	0.199	57%	0.565	C	S	.	*			trans	-64.8	127.8	160.4	-78.7	172.6	0	0	0	109.6	G26 L30 F38 S67	L24-G26 PolarHBondContact O-N 2.94Å; L24-L30 HydrophobicContact CB-CD1 4.32Å; L24-L30 HydrophobicContact CB-CD2 4.11Å; L24-L30 HydrophobicContact CD1-CD1 3.79Å; L24-L30 HydrophobicContact CD1-CD2 4.15Å; L24-F38 HydrophobicContact CD1-CB 3.69Å; L24-F38 HydrophobicContact CD1-CD1 4.39Å; L24-F38 HydrophobicContact CD1-CD2 3.46Å; L24-F38 VanDerWaalsContact CD1-CD2 3.46Å; L24-F38 HydrophobicContact CD1-CE2 4.08Å; L24-F38 HydrophobicContact CD1-CG 3.6Å; L24-F38 HydrophobicContact CD2-CB 4.1Å; L24-F38 HydrophobicContact CD2-CD2 3.5Å; L24-F38 HydrophobicContact CD2-CE2 4.31Å; L24-F38 HydrophobicContact CD2-CG 4.2Å; L24-F38 HydrophobicContact CG-CB 4.33Å; L24-F38 HydrophobicContact CG-CD2 3.39Å; L24-F38 HydrophobicContact CG-CE2 3.85Å; L24-F38 HydrophobicContact CG-CG 4.06Å; L24-S67 PolarHBondContact N-O 3.41Å
25	V	65.6	Low	72.6	Confident	135 Å²	135	100.2 Å²	100.2	82%	0.818	54%	0.544	S	S	*	.	S	Bend	trans	-18.8	109.4	173.5	-177.9	0	0	0	0	115.1	P23	P23-V25 PolarHBondContact O-N 2.79Å
26	G	59.6	Low	74.4	Confident	49 Å²	49	96.2 Å²	96.2	51%	0.505	53%	0.526	S	S	.	.	S	Bend	trans	58	151.7	159.8	0	0	0	0	0	117.9	L24 R28	L24-G26 PolarHBondContact O-N 2.94Å; G26-R28 PolarHBondContact O-N 3.01Å
27	E	58.8	Low	76	Confident	181 Å²	181	92.2 Å²	92.2	85%	0.846	51%	0.511	S	S	*	.	S	Bend	trans	-66	19.2	178.8	-65.3	-179.1	149.4	0	0	115.4
28	R	63.4	Low	77.2	Confident	214 Å²	214	87 Å²	87	81%	0.808	48%	0.476	S	S	*	.	S	Bend	trans	-79.4	142.4	174.5	-65	-175.4	-178.5	178.4	0.2	109.1	G26 L30	G26-R28 PolarHBondContact O-N 3.01Å; R28-L30 PolarHBondContact O-N 2.96Å
29	S	64.9	Low	78	Confident	122 Å²	122	88.4 Å²	88.4	85%	0.853	47%	0.473	S	S	*	.			trans	-49.8	114.3	176.3	44.6	0	0	0	0	110.6	S31	S29-S31 PolarHBondContact O-N 3.35Å
30	L	77.7	Confident	78.5	Confident	42 Å²	42	91.5 Å²	91.5	22%	0.22	48%	0.479	C	S	.	.			trans	-67.3	126.7	177.6	-70.6	167	0	0	0	108.5	L24 R28 D34 L35 L66	L24-L30 HydrophobicContact CB-CD1 4.32Å; L24-L30 HydrophobicContact CB-CD2 4.11Å; L24-L30 HydrophobicContact CD1-CD1 3.79Å; L24-L30 HydrophobicContact CD1-CD2 4.15Å; R28-L30 PolarHBondContact O-N 2.96Å; L30-D34 HydrophobicContact CB-CB 4.44Å; L30-D34 HydrophobicContact CD2-CB 4.04Å; L30-L35 HydrophobicContact CB-CG 4.26Å; L30-L35 HydrophobicContact CD1-CD2 3.99Å; L30-L66 HydrophobicContact CD1-CD2 4.16Å
31	S	87	Confident	78.8	Confident	52 Å²	52	91.8 Å²	91.8	36%	0.364	48%	0.478	S	S	.	.			trans	-67.3	155.1	172.2	73.7	0	0	0	0	109.7	S29 N33 D34 L35	S29-S31 PolarHBondContact O-N 3.35Å; S31-N33 PolarHBondContact O-N 3.03Å; S31-N33 PolarHBondContact OG-N 3.26Å; S31-D34 WeakPolarHBondContact CB-OD2 3.43Å; S31-D34 PolarHBondContact N-OD2 2.73Å; S31-D34 WeakPolarHBondContact O-CB 3.47Å; S31-D34 PolarHBondContact O-N 3.14Å; S31-D34 PolarHBondContact OG-N 2.92Å; S31-D34 VanDerWaalsContact OG-N 3.14Å; S31-D34 PolarHBondContact OG-OD2 2.64Å; S31-L35 PolarHBondContact O-N 3.4Å; S31-L35 VanDerWaalsContact O-N 3.16Å
32	A	88.6	Confident	79.4	Confident	86 Å²	86	86 Å²	86	71%	0.711	45%	0.451	S	S	*	.	H	α-helix	trans	-54.4	-29.4	172.8	0	0	0	0	0	112.1	K36	A32-K36 WeakPolarHBondContact O-CB 3.22Å; A32-K36 PolarHBondContact O-N 3.44Å
33	N	87.8	Confident	80	Confident	103 Å²	103	82 Å²	82	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-72.3	-34.4	176	-169.6	62.1	0	0	0	112.9	S31 K36 T37	S31-N33 PolarHBondContact O-N 3.03Å; S31-N33 PolarHBondContact OG-N 3.26Å; N33-K36 PolarHBondContact O-N 3.44Å; N33-T37 WeakPolarHBondContact O-CB 3.06Å; N33-T37 PolarHBondContact O-N 3.35Å; N33-T37 PolarHBondContact O-OG1 3.4Å
34	D	87.2	Confident	80.6	Confident	70 Å²	70	79.9 Å²	79.9	37%	0.374	43%	0.434	S	S	.	.	H	α-helix	trans	-67.6	-43.8	175.8	-61.6	-43.9	0	0	0	111	L30 S31 T37 F38	L30-D34 HydrophobicContact CB-CB 4.44Å; L30-D34 HydrophobicContact CD2-CB 4.04Å; S31-D34 WeakPolarHBondContact CB-OD2 3.43Å; S31-D34 PolarHBondContact N-OD2 2.73Å; S31-D34 WeakPolarHBondContact O-CB 3.47Å; S31-D34 PolarHBondContact O-N 3.14Å; S31-D34 PolarHBondContact OG-N 2.92Å; S31-D34 VanDerWaalsContact OG-N 3.14Å; S31-D34 PolarHBondContact OG-OD2 2.64Å; D34-T37 WeakPolarHBondContact O-CB 3.22Å; D34-T37 PolarHBondContact O-N 3.41Å; D34-F38 WeakPolarHBondContact O-CB 3.42Å; D34-F38 PolarHBondContact O-N 3.23Å
35	L	88.4	Confident	81.4	Confident	48 Å²	48	78.8 Å²	78.8	25%	0.251	43%	0.428	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.9	-72.6	173.8	0	0	0	111.5	L30 S31 T37 F38 W39 W61 S67	L30-L35 HydrophobicContact CB-CG 4.26Å; L30-L35 HydrophobicContact CD1-CD2 3.99Å; S31-L35 PolarHBondContact O-N 3.4Å; S31-L35 VanDerWaalsContact O-N 3.16Å; L35-T37 VanDerWaalsContact C-N 3.29Å; L35-T37 PolarHBondContact O-N 2.88Å; L35-F38 WeakPolarHBondContact O-CB 3.46Å; L35-F38 PolarHBondContact O-N 3.47Å; L35-W39 PolarHBondContact O-N 3Å; L35-W61 HydrophobicContact CD2-CH2 3.99Å; L35-W61 HydrophobicContact CD2-CZ3 4.06Å; L35-S67 WeakPolarHBondContact CD2-OG 3.14Å
36	K	90.2	Very high	82.5	Confident	115 Å²	115	82 Å²	82	50%	0.5	43%	0.426	S	S	.	.	H	α-helix	trans	-59.1	-42.2	175.6	-168.3	179.9	-165.1	-177.7	0	111.7	A32 N33 R40	A32-K36 WeakPolarHBondContact O-CB 3.22Å; A32-K36 PolarHBondContact O-N 3.44Å; N33-K36 PolarHBondContact O-N 3.44Å; K36-R40 VanDerWaalsContact O-CG 3.28Å; K36-R40 WeakPolarHBondContact O-CG 3.32Å; K36-R40 PolarHBondContact O-N 2.89Å; K36-R40 VanDerWaalsContact O-N 3.08Å
37	T	86.7	Confident	83.8	Confident	44 Å²	44	87.5 Å²	87.5	27%	0.27	44%	0.438	S	S	.	.	H	α-helix	trans	-65.6	-41	177.4	-60.6	0	0	0	0	111.4	N33 D34 L35 K41	N33-T37 WeakPolarHBondContact O-CB 3.06Å; N33-T37 PolarHBondContact O-N 3.35Å; N33-T37 PolarHBondContact O-OG1 3.4Å; D34-T37 WeakPolarHBondContact O-CB 3.22Å; D34-T37 PolarHBondContact O-N 3.41Å; L35-T37 VanDerWaalsContact C-N 3.29Å; L35-T37 PolarHBondContact O-N 2.88Å; T37-K41 HydrophobicContact CG2-CD 4.33Å; T37-K41 WeakPolarHBondContact O-CG 3.14Å; T37-K41 PolarHBondContact O-N 3.27Å; T37-K41 VanDerWaalsContact O-N 3.07Å
38	F	88.4	Confident	85.1	Confident	6 Å²	6	81.8 Å²	81.8	3%	0.026	41%	0.413	C	S	.	.	H	α-helix	trans	-61.3	-51.3	175.4	174	-95.2	0	0	0	112.1	L24 D34 L35 R40 K41 A42 V59 S67 M69	L24-F38 HydrophobicContact CD1-CB 3.69Å; L24-F38 HydrophobicContact CD1-CD1 4.39Å; L24-F38 HydrophobicContact CD1-CD2 3.46Å; L24-F38 VanDerWaalsContact CD1-CD2 3.46Å; L24-F38 HydrophobicContact CD1-CE2 4.08Å; L24-F38 HydrophobicContact CD1-CG 3.6Å; L24-F38 HydrophobicContact CD2-CB 4.1Å; L24-F38 HydrophobicContact CD2-CD2 3.5Å; L24-F38 HydrophobicContact CD2-CE2 4.31Å; L24-F38 HydrophobicContact CD2-CG 4.2Å; L24-F38 HydrophobicContact CG-CB 4.33Å; L24-F38 HydrophobicContact CG-CD2 3.39Å; L24-F38 HydrophobicContact CG-CE2 3.85Å; L24-F38 HydrophobicContact CG-CG 4.06Å; D34-F38 WeakPolarHBondContact O-CB 3.42Å; D34-F38 PolarHBondContact O-N 3.23Å; L35-F38 WeakPolarHBondContact O-CB 3.46Å; L35-F38 PolarHBondContact O-N 3.47Å; F38-R40 VanDerWaalsContact C-N 3.29Å; F38-R40 PolarHBondContact O-N 3.41Å; F38-K41 WeakPolarHBondContact O-CB 3.42Å; F38-K41 PolarHBondContact O-N 2.86Å; F38-K41 VanDerWaalsContact O-N 3.07Å; F38-A42 PolarHBondContact O-N 3.22Å; F38-V59 HydrophobicContact CE1-CG1 3.58Å; F38-V59 HydrophobicContact CE1-CG2 4.1Å; F38-V59 HydrophobicContact CZ-CG1 3.89Å; F38-V59 HydrophobicContact CZ-CG2 4.34Å; F38-S67 VanDerWaalsContact CZ-CB 3.47Å; F38-M69 HydrophobicContact CD2-CE 3.45Å; F38-M69 VanDerWaalsContact CD2-CE 3.45Å; F38-M69 HydrophobicContact CD2-CG 4.43Å; F38-M69 HydrophobicContact CE2-CE 3.45Å; F38-M69 VanDerWaalsContact CE2-CE 3.45Å; F38-M69 HydrophobicContact CE2-CG 3.47Å; F38-M69 VanDerWaalsContact CE2-CG 3.47Å; F38-M69 HydrophobicContact CE2-SD 4.3Å; F38-M69 HydrophobicContact CG-CE 4.12Å; F38-M69 HydrophobicContact CZ-CE 4Å; F38-M69 HydrophobicContact CZ-CG 3.6Å; F38-M69 WeakPolarHBondContact O-CE 3.3Å
39	W	90.3	Very high	86.1	Confident	113 Å²	113	77.9 Å²	77.9	43%	0.428	41%	0.408	S	S	.	.	H	α-helix	trans	-60.7	-39.3	-179.7	-78.9	115.5	0	0	0	112.2	L35 A42 A43 V59 W61	L35-W39 PolarHBondContact O-N 3Å; W39-A42 PolarHBondContact O-N 3.1Å; W39-A43 VanDerWaalsContact O-CB 3.31Å; W39-A43 WeakPolarHBondContact O-CB 3.26Å; W39-A43 PolarHBondContact O-N 3.48Å; W39-V59 HydrophobicContact CE3-CG2 4.35Å; W39-V59 HydrophobicContact CH2-CB 4.03Å; W39-V59 HydrophobicContact CH2-CG1 3.62Å; W39-V59 HydrophobicContact CH2-CG2 4.31Å; W39-V59 HydrophobicContact CZ2-CG1 4.21Å; W39-V59 HydrophobicContact CZ3-CB 3.97Å; W39-V59 HydrophobicContact CZ3-CG1 3.93Å; W39-V59 HydrophobicContact CZ3-CG2 3.76Å; W39-W61 HydrophobicContact CZ2-CH2 4.46Å; W39-W61 AromaticContact CZ2-CZ2 3.55Å; W39-W61 HydrophobicContact CZ2-CZ2 3.55Å
40	R	89	Confident	87.1	Confident	100 Å²	100	79.1 Å²	79.1	38%	0.377	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-42.5	173.2	-74.9	175.1	-178.6	177.9	-0.2	112.7	K36 F38 A43 S44 E109	K36-R40 VanDerWaalsContact O-CG 3.28Å; K36-R40 WeakPolarHBondContact O-CG 3.32Å; K36-R40 PolarHBondContact O-N 2.89Å; K36-R40 VanDerWaalsContact O-N 3.08Å; F38-R40 VanDerWaalsContact C-N 3.29Å; F38-R40 PolarHBondContact O-N 3.41Å; R40-A43 PolarHBondContact O-N 3.46Å; R40-S44 WeakPolarHBondContact O-CB 3.46Å; R40-S44 PolarHBondContact O-N 3.02Å; R40-S44 PolarHBondContact O-OG 2.83Å; R40-E109 IonicContact CZ-OE1 2.68Å; R40-E109 IonicContact NH1-OE1 3.68Å; R40-E109 PolarHBondContact NH1-OE1 2.94Å
41	K	85.4	Confident	87.5	Confident	65 Å²	65	80.3 Å²	80.3	28%	0.283	41%	0.411	S	S	.	.	H	α-helix	trans	-64.7	-46.3	176.8	-73.4	174.3	-173.1	179	0	111.3	T37 F38 A43 S44 M45 M69 G102	T37-K41 HydrophobicContact CG2-CD 4.33Å; T37-K41 WeakPolarHBondContact O-CG 3.14Å; T37-K41 PolarHBondContact O-N 3.27Å; T37-K41 VanDerWaalsContact O-N 3.07Å; F38-K41 WeakPolarHBondContact O-CB 3.42Å; F38-K41 PolarHBondContact O-N 2.86Å; F38-K41 VanDerWaalsContact O-N 3.07Å; K41-A43 PolarHBondContact O-N 3.33Å; K41-S44 PolarHBondContact O-N 3.28Å; K41-M45 WeakPolarHBondContact O-CG 3.26Å; K41-M45 PolarHBondContact O-N 3.3Å; K41-M69 HydrophobicContact CB-CE 3.85Å; K41-G102 WeakPolarHBondContact CE-O 3.33Å; K41-G102 PolarHBondContact NZ-O 3.27Å
42	A	88.6	Confident	87.5	Confident	3 Å²	3	82.1 Å²	82.1	3%	0.025	42%	0.417	C	S	.	.	H	α-helix	trans	-59	-46.4	176.1	0	0	0	0	0	111.5	F38 W39 S44 M45 R46 F56 V59 M69	F38-A42 PolarHBondContact O-N 3.22Å; W39-A42 PolarHBondContact O-N 3.1Å; A42-S44 VanDerWaalsContact C-N 3.33Å; A42-S44 PolarHBondContact O-N 3.23Å; A42-M45 PolarHBondContact O-N 3.29Å; A42-R46 WeakPolarHBondContact O-CB 3.41Å; A42-R46 PolarHBondContact O-N 3.46Å; A42-F56 HydrophobicContact CB-CE2 4Å; A42-F56 HydrophobicContact CB-CZ 4.04Å; A42-V59 HydrophobicContact CB-CG2 3.62Å; A42-M69 HydrophobicContact CB-CE 3.84Å; A42-M69 HydrophobicContact CB-SD 4.41Å
43	A	89.9	Confident	87.4	Confident	52 Å²	52	79.7 Å²	79.7	43%	0.43	39%	0.391	S	S	.	.	H	α-helix	trans	-61.7	-40.3	177.5	0	0	0	0	0	112.3	W39 R40 K41 R46	W39-A43 VanDerWaalsContact O-CB 3.31Å; W39-A43 WeakPolarHBondContact O-CB 3.26Å; W39-A43 PolarHBondContact O-N 3.48Å; R40-A43 PolarHBondContact O-N 3.46Å; K41-A43 PolarHBondContact O-N 3.33Å; A43-R46 PolarHBondContact O-N 3.2Å
44	S	86.5	Confident	87.4	Confident	39 Å²	39	75.5 Å²	75.5	27%	0.273	37%	0.369	S	S	.	.	H	α-helix	trans	-66	-43.3	176.6	-56.8	0	0	0	0	111.5	R40 K41 A42 R46 Q47	R40-S44 WeakPolarHBondContact O-CB 3.46Å; R40-S44 PolarHBondContact O-N 3.02Å; R40-S44 PolarHBondContact O-OG 2.83Å; K41-S44 PolarHBondContact O-N 3.28Å; A42-S44 VanDerWaalsContact C-N 3.33Å; A42-S44 PolarHBondContact O-N 3.23Å; S44-R46 VanDerWaalsContact C-N 3.34Å; S44-R46 PolarHBondContact O-N 2.99Å; S44-Q47 PolarHBondContact O-N 2.77Å
45	M	86.4	Confident	87.4	Confident	16 Å²	16	75.1 Å²	75.1	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-66.8	-34.6	178	-70.7	-176.6	63.7	0	0	112.6	K41 A42 Q47 L48 F56 M69 L71 F101	K41-M45 WeakPolarHBondContact O-CG 3.26Å; K41-M45 PolarHBondContact O-N 3.3Å; A42-M45 PolarHBondContact O-N 3.29Å; M45-Q47 PolarHBondContact O-N 2.97Å; M45-L48 WeakPolarHBondContact O-CB 3.11Å; M45-L48 PolarHBondContact O-N 2.77Å; M45-F56 HydrophobicContact CB-CB 3.91Å; M45-F56 HydrophobicContact CB-CD2 4.18Å; M45-F56 HydrophobicContact CB-CG 4.13Å; M45-F56 HydrophobicContact CE-CB 4.41Å; M45-M69 HydrophobicContact SD-SD 4.02Å; M45-L71 HydrophobicContact CE-CD2 3.56Å; M45-F101 HydrophobicContact CE-CD2 4.05Å; M45-F101 HydrophobicContact CG-CB 4.29Å; M45-F101 HydrophobicContact SD-CB 4.21Å
46	R	88.6	Confident	87.4	Confident	203 Å²	203	74.5 Å²	74.5	77%	0.766	36%	0.362	S	S	*	.	H	α-helix	trans	-61.8	-25.7	176.6	-174	176.1	178	172.2	0.9	113.2	A42 A43 S44 L48 F56	A42-R46 WeakPolarHBondContact O-CB 3.41Å; A42-R46 PolarHBondContact O-N 3.46Å; A43-R46 PolarHBondContact O-N 3.2Å; S44-R46 VanDerWaalsContact C-N 3.34Å; S44-R46 PolarHBondContact O-N 2.99Å; R46-L48 VanDerWaalsContact C-N 3.31Å; R46-F56 HydrophobicContact CB-CD1 3.81Å; R46-F56 HydrophobicContact CB-CE1 4.08Å; R46-F56 HydrophobicContact CG-CD1 4.26Å; R46-F56 HydrophobicContact CG-CE1 4.44Å
47	Q	87.1	Confident	87.4	Confident	164 Å²	164	73.4 Å²	73.4	77%	0.766	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-7.1	177.6	-64.9	176.8	7.2	0	0	113	S44 M45	S44-Q47 PolarHBondContact O-N 2.77Å; M45-Q47 PolarHBondContact O-N 2.97Å
48	L	84.3	Confident	87.7	Confident	60 Å²	60	73 Å²	73	31%	0.314	36%	0.362	S	S	.	.			trans	-98.4	94.7	-179.1	-62	176.5	0	0	0	109.4	M45 R46 Y50 L53	M45-L48 WeakPolarHBondContact O-CB 3.11Å; M45-L48 PolarHBondContact O-N 2.77Å; R46-L48 VanDerWaalsContact C-N 3.31Å; L48-Y50 HydrophobicContact CD2-CE2 4.21Å; L48-L53 HydrophobicContact CB-CD1 3.96Å; L48-L53 HydrophobicContact CD1-CD1 4.34Å; L48-L53 HydrophobicContact CD2-CD1 4.43Å; L48-L53 HydrophobicContact CG-CD1 4.47Å
49	D	84.7	Confident	87.8	Confident	133 Å²	133	74.5 Å²	74.5	71%	0.711	37%	0.372	S	S	*	.			trans	-111.5	91.3	172.8	-171.8	14.7	0	0	0	109.7
50	Y	86	Confident	87.9	Confident	147 Å²	147	71.5 Å²	71.5	58%	0.576	37%	0.368	S	S	*	.			trans	-141.2	136.1	-178.3	-67.5	-83.7	0	0	0	109.4	L48 N52 L53	L48-Y50 HydrophobicContact CD2-CE2 4.21Å; Y50-N52 PolarHBondContact O-N 3.15Å; Y50-L53 HydrophobicContact CD2-CD1 3.52Å; Y50-L53 HydrophobicContact CD2-CG 4.42Å; Y50-L53 HydrophobicContact CE2-CD1 4.44Å; Y50-L53 HydrophobicContact CG-CD1 4.03Å; Y50-L53 HydrophobicContact CG-CG 4.48Å; Y50-L53 PolarHBondContact O-N 3.39Å
51	A	87.6	Confident	87.9	Confident	67 Å²	67	72.7 Å²	72.7	55%	0.554	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.9	-177	0	0	0	0	0	114.9	I97	A51-I97 WeakPolarHBondContact O-CD1 3.49Å
52	N	86.7	Confident	88	Confident	90 Å²	90	71.7 Å²	71.7	48%	0.481	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	11.9	-178.3	-61.4	-9.5	0	0	0	113	Y50 I97 V98	Y50-N52 PolarHBondContact O-N 3.15Å; N52-I97 WeakPolarHBondContact O-CA 3.22Å; N52-V98 PolarHBondContact O-N 2.91Å
53	L	86.7	Confident	87.8	Confident	35 Å²	35	84.3 Å²	84.3	18%	0.183	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-116.5	151.4	175.1	-55	-178.6	0	0	0	110.1	L48 Y50 N55 I97 V98 F101	L48-L53 HydrophobicContact CB-CD1 3.96Å; L48-L53 HydrophobicContact CD1-CD1 4.34Å; L48-L53 HydrophobicContact CD2-CD1 4.43Å; L48-L53 HydrophobicContact CG-CD1 4.47Å; Y50-L53 HydrophobicContact CD2-CD1 3.52Å; Y50-L53 HydrophobicContact CD2-CG 4.42Å; Y50-L53 HydrophobicContact CE2-CD1 4.44Å; Y50-L53 HydrophobicContact CG-CD1 4.03Å; Y50-L53 HydrophobicContact CG-CG 4.48Å; Y50-L53 PolarHBondContact O-N 3.39Å; L53-N55 PolarHBondContact O-N 3.42Å; L53-N55 VanDerWaalsContact O-N 3.13Å; L53-N55 PolarHBondContact O-OD1 3.05Å; L53-I97 VanDerWaalsContact C-CG2 3.49Å; L53-V98 HydrophobicContact CD2-CB 3.9Å; L53-V98 HydrophobicContact CD2-CG2 4.3Å; L53-F101 HydrophobicContact CB-CZ 4.1Å; L53-F101 HydrophobicContact CD1-CZ 4.47Å; L53-F101 HydrophobicContact CD2-CE1 4.19Å; L53-F101 HydrophobicContact CD2-CZ 3.71Å; L53-F101 HydrophobicContact CG-CZ 4.28Å
54	L	86.9	Confident	87.7	Confident	16 Å²	16	85.8 Å²	85.8	8%	0.084	43%	0.426	C	S	.	.			trans	-70	109.8	177.3	-174.5	63.9	0	0	0	110	F56 L71 S72 M74 I97 V98 A99 F101	L54-F56 PolarHBondContact O-N 3.25Å; L54-L71 HydrophobicContact CD2-CB 4.11Å; L54-L71 HydrophobicContact CD2-CD1 3.63Å; L54-L71 HydrophobicContact CD2-CG 4.38Å; L54-L71 HydrophobicContact CG-CB 4.19Å; L54-L71 HydrophobicContact CG-CD1 4.42Å; L54-S72 WeakPolarHBondContact CD1-O 3.47Å; L54-M74 HydrophobicContact CD1-CG 4.21Å; L54-M74 HydrophobicContact CD1-SD 4.13Å; L54-I97 HydrophobicContact CB-CG2 3.92Å; L54-I97 HydrophobicContact CD1-CG2 4.39Å; L54-I97 VanDerWaalsContact N-CG2 3.31Å; L54-V98 PolarHBondContact N-O 2.95Å; L54-V98 VanDerWaalsContact N-O 3.08Å; L54-A99 HydrophobicContact CB-CB 4.4Å; L54-A99 HydrophobicContact CD2-CB 4.07Å; L54-F101 HydrophobicContact CB-CE2 4.37Å
55	N	86.9	Confident	87.7	Confident	62 Å²	62	86 Å²	86	33%	0.332	43%	0.434	S	S	.	.			trans	-63.6	130.7	-176.3	-75.9	-1.3	0	0	0	112.1	L53 L71 S72	L53-N55 PolarHBondContact O-N 3.42Å; L53-N55 VanDerWaalsContact O-N 3.13Å; L53-N55 PolarHBondContact O-OD1 3.05Å; N55-L71 WeakPolarHBondContact O-CA 3.45Å; N55-S72 PolarHBondContact O-N 2.98Å; N55-S72 VanDerWaalsContact O-N 3.11Å
56	F	88.7	Confident	87.7	Confident	35 Å²	35	86.5 Å²	86.5	15%	0.154	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.9	171.7	175.1	-92.3	0	0	0	109.5	A42 M45 R46 L54 A58 V59 M69 L71	A42-F56 HydrophobicContact CB-CE2 4Å; A42-F56 HydrophobicContact CB-CZ 4.04Å; M45-F56 HydrophobicContact CB-CB 3.91Å; M45-F56 HydrophobicContact CB-CD2 4.18Å; M45-F56 HydrophobicContact CB-CG 4.13Å; M45-F56 HydrophobicContact CE-CB 4.41Å; R46-F56 HydrophobicContact CB-CD1 3.81Å; R46-F56 HydrophobicContact CB-CE1 4.08Å; R46-F56 HydrophobicContact CG-CD1 4.26Å; R46-F56 HydrophobicContact CG-CE1 4.44Å; L54-F56 PolarHBondContact O-N 3.25Å; F56-A58 WeakPolarHBondContact CE2-O 3.13Å; F56-A58 WeakPolarHBondContact CZ-O 3.36Å; F56-V59 HydrophobicContact CE2-CG2 4.1Å; F56-V59 HydrophobicContact CZ-CG2 3.61Å; F56-M69 HydrophobicContact CE2-CB 4.21Å; F56-M69 HydrophobicContact CE2-CG 4.11Å; F56-M69 HydrophobicContact CE2-SD 4.28Å; F56-L71 HydrophobicContact CB-CD2 4.36Å; F56-L71 HydrophobicContact CD2-CD2 4.03Å
57	I	90.5	Very high	87.6	Confident	91 Å²	91	76.8 Å²	76.8	47%	0.467	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-56.8	-178.5	-59.2	176.6	0	0	0	109.7	I70	I57-I70 HydrophobicContact CB-CB 4.41Å; I57-I70 HydrophobicContact CB-CG2 4.08Å; I57-I70 WeakPolarHBondContact CB-O 3.38Å; I57-I70 HydrophobicContact CD1-CG2 4.28Å; I57-I70 HydrophobicContact CG2-CG2 4.32Å; I57-I70 PolarHBondContact N-O 3.07Å
58	A	91.5	Very high	87.7	Confident	36 Å²	36	69.3 Å²	69.3	30%	0.298	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	167	-173.4	0	0	0	0	0	112.8	F56 I70	F56-A58 WeakPolarHBondContact CE2-O 3.13Å; F56-A58 WeakPolarHBondContact CZ-O 3.36Å; A58-I70 HydrophobicContact CB-CB 4.34Å; A58-I70 HydrophobicContact CB-CD1 4.28Å; A58-I70 PolarHBondContact N-O 3.12Å; A58-I70 PolarHBondContact O-N 3.42Å
59	V	91.5	Very high	88	Confident	38 Å²	38	67.3 Å²	67.3	23%	0.23	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.7	159.4	176.4	0	0	0	0	108.1	F38 W39 A42 F56 V68	F38-V59 HydrophobicContact CE1-CG1 3.58Å; F38-V59 HydrophobicContact CE1-CG2 4.1Å; F38-V59 HydrophobicContact CZ-CG1 3.89Å; F38-V59 HydrophobicContact CZ-CG2 4.34Å; W39-V59 HydrophobicContact CE3-CG2 4.35Å; W39-V59 HydrophobicContact CH2-CB 4.03Å; W39-V59 HydrophobicContact CH2-CG1 3.62Å; W39-V59 HydrophobicContact CH2-CG2 4.31Å; W39-V59 HydrophobicContact CZ2-CG1 4.21Å; W39-V59 HydrophobicContact CZ3-CB 3.97Å; W39-V59 HydrophobicContact CZ3-CG1 3.93Å; W39-V59 HydrophobicContact CZ3-CG2 3.76Å; A42-V59 HydrophobicContact CB-CG2 3.62Å; F56-V59 HydrophobicContact CE2-CG2 4.1Å; F56-V59 HydrophobicContact CZ-CG2 3.61Å; V59-V68 WeakPolarHBondContact CA-O 3.26Å
60	S	91.7	Very high	88.2	Confident	50 Å²	50	62.4 Å²	62.4	35%	0.35	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	174.6	169.3	-169.3	0	0	0	0	110.7	V68	S60-V68 PolarHBondContact N-O 3.28Å; S60-V68 PolarHBondContact O-N 3.35Å
61	W	89.7	Confident	88.4	Confident	124 Å²	124	55.8 Å²	55.8	47%	0.47	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.2	176.4	-61.4	91.3	0	0	0	109.6	L35 W39 G65 L66 S67	L35-W61 HydrophobicContact CD2-CH2 3.99Å; L35-W61 HydrophobicContact CD2-CZ3 4.06Å; W39-W61 HydrophobicContact CZ2-CH2 4.46Å; W39-W61 AromaticContact CZ2-CZ2 3.55Å; W39-W61 HydrophobicContact CZ2-CZ2 3.55Å; W61-G65 VanDerWaalsContact CE3-O 3.31Å; W61-G65 WeakPolarHBondContact CZ3-O 3.47Å; W61-L66 CarbonylContact C-O 3.52Å; W61-L66 WeakPolarHBondContact CA-O 3.25Å; W61-S67 VanDerWaalsContact CH2-OG 3.26Å; W61-S67 WeakPolarHBondContact CH2-OG 3.36Å; W61-S67 WeakPolarHBondContact CZ3-OG 3.28Å
62	T	86.9	Confident	88.4	Confident	45 Å²	45	54.6 Å²	54.6	28%	0.276	29%	0.291	S	S	.	.			trans	-73.3	165.9	170.6	67.1	0	0	0	0	110.6	S64 G65 L66 V68	T62-S64 PolarHBondContact O-N 3.06Å; T62-S64 PolarHBondContact OG1-N 3.47Å; T62-S64 PolarHBondContact OG1-OG 3.37Å; T62-G65 PolarHBondContact O-N 3.37Å; T62-G65 PolarHBondContact OG1-N 3.04Å; T62-L66 HydrophobicContact CG2-CB 4.09Å; T62-L66 PolarHBondContact N-O 3.43Å; T62-L66 WeakPolarHBondContact OG1-CB 3.39Å; T62-L66 PolarHBondContact OG1-N 3.08Å; T62-V68 HydrophobicContact CG2-CG2 3.61Å
63	R	85.9	Confident	88.3	Confident	268 Å²	268	53.8 Å²	53.8	100%	1.011	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.9	171	-70.1	-173.6	177.4	-173.6	-1.1	113.2	G65	R63-G65 VanDerWaalsContact C-N 3.26Å; R63-G65 PolarHBondContact O-N 3.23Å
64	S	87	Confident	87.9	Confident	83 Å²	83	53 Å²	53	58%	0.58	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	1.6	174.7	52.3	0	0	0	0	113.9	T62	T62-S64 PolarHBondContact O-N 3.06Å; T62-S64 PolarHBondContact OG1-N 3.47Å; T62-S64 PolarHBondContact OG1-OG 3.37Å
65	G	86	Confident	87.4	Confident	42 Å²	42	58 Å²	58	43%	0.433	31%	0.309	S	S	.	.			trans	80.2	13.6	-179.3	0	0	0	0	0	114.5	W61 T62 R63	W61-G65 VanDerWaalsContact CE3-O 3.31Å; W61-G65 WeakPolarHBondContact CZ3-O 3.47Å; T62-G65 PolarHBondContact O-N 3.37Å; T62-G65 PolarHBondContact OG1-N 3.04Å; R63-G65 VanDerWaalsContact C-N 3.26Å; R63-G65 PolarHBondContact O-N 3.23Å
66	L	86.3	Confident	86.6	Confident	27 Å²	27	60.4 Å²	60.4	14%	0.141	32%	0.316	C	S	.	.			trans	-79.7	129.2	175.3	-61.6	172.2	0	0	0	110	L30 W61 T62	L30-L66 HydrophobicContact CD1-CD2 4.16Å; W61-L66 CarbonylContact C-O 3.52Å; W61-L66 WeakPolarHBondContact CA-O 3.25Å; T62-L66 HydrophobicContact CG2-CB 4.09Å; T62-L66 PolarHBondContact N-O 3.43Å; T62-L66 WeakPolarHBondContact OG1-CB 3.39Å; T62-L66 PolarHBondContact OG1-N 3.08Å
67	S	87.3	Confident	85.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	134.5	173.1	-37.1	0	0	0	0	110.7	L24 L35 F38 W61	L24-S67 PolarHBondContact N-O 3.41Å; L35-S67 WeakPolarHBondContact CD2-OG 3.14Å; F38-S67 VanDerWaalsContact CZ-CB 3.47Å; W61-S67 VanDerWaalsContact CH2-OG 3.26Å; W61-S67 WeakPolarHBondContact CH2-OG 3.36Å; W61-S67 WeakPolarHBondContact CZ3-OG 3.28Å
68	V	89.7	Confident	83.8	Confident	6 Å²	6	60 Å²	60	4%	0.036	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.5	-178.3	-179.9	0	0	0	0	108.9	E21 P23 V59 S60 T62	E21-V68 HydrophobicContact CB-CG1 3.7Å; E21-V68 HydrophobicContact CG-CG1 4.01Å; P23-V68 HydrophobicContact CB-CG2 4.49Å; V59-V68 WeakPolarHBondContact CA-O 3.26Å; S60-V68 PolarHBondContact N-O 3.28Å; S60-V68 PolarHBondContact O-N 3.35Å; T62-V68 HydrophobicContact CG2-CG2 3.61Å
69	M	89.4	Confident	82	Confident	19 Å²	19	60.4 Å²	60.4	9%	0.094	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	131.9	166.2	-62.3	-173.2	-168.6	0	0	109.4	R22 F38 K41 A42 M45 F56 L71	R22-M69 PolarHBondContact N-O 3.43Å; R22-M69 PolarHBondContact O-N 2.9Å; F38-M69 HydrophobicContact CD2-CE 3.45Å; F38-M69 VanDerWaalsContact CD2-CE 3.45Å; F38-M69 HydrophobicContact CD2-CG 4.43Å; F38-M69 HydrophobicContact CE2-CE 3.45Å; F38-M69 VanDerWaalsContact CE2-CE 3.45Å; F38-M69 HydrophobicContact CE2-CG 3.47Å; F38-M69 VanDerWaalsContact CE2-CG 3.47Å; F38-M69 HydrophobicContact CE2-SD 4.3Å; F38-M69 HydrophobicContact CG-CE 4.12Å; F38-M69 HydrophobicContact CZ-CE 4Å; F38-M69 HydrophobicContact CZ-CG 3.6Å; F38-M69 WeakPolarHBondContact O-CE 3.3Å; K41-M69 HydrophobicContact CB-CE 3.85Å; A42-M69 HydrophobicContact CB-CE 3.84Å; A42-M69 HydrophobicContact CB-SD 4.41Å; M45-M69 HydrophobicContact SD-SD 4.02Å; F56-M69 HydrophobicContact CE2-CB 4.21Å; F56-M69 HydrophobicContact CE2-CG 4.11Å; F56-M69 HydrophobicContact CE2-SD 4.28Å; M69-L71 HydrophobicContact CB-CD2 4.45Å
70	I	89.5	Confident	80.1	Confident	30 Å²	30	60.6 Å²	60.6	15%	0.154	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.5	173.5	-56.1	-179.4	0	0	0	107.2	I57 A58	I57-I70 HydrophobicContact CB-CB 4.41Å; I57-I70 HydrophobicContact CB-CG2 4.08Å; I57-I70 WeakPolarHBondContact CB-O 3.38Å; I57-I70 HydrophobicContact CD1-CG2 4.28Å; I57-I70 HydrophobicContact CG2-CG2 4.32Å; I57-I70 PolarHBondContact N-O 3.07Å; A58-I70 HydrophobicContact CB-CB 4.34Å; A58-I70 HydrophobicContact CB-CD1 4.28Å; A58-I70 PolarHBondContact N-O 3.12Å; A58-I70 PolarHBondContact O-N 3.42Å
71	L	90.1	Very high	78.1	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.042	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	155	-178.5	-55.3	175.3	0	0	0	109.5	S19 L20 M45 L54 N55 F56 M69 L73	S19-L71 WeakPolarHBondContact CA-O 3.34Å; L20-L71 PolarHBondContact N-O 3.38Å; L20-L71 PolarHBondContact O-N 2.97Å; M45-L71 HydrophobicContact CE-CD2 3.56Å; L54-L71 HydrophobicContact CD2-CB 4.11Å; L54-L71 HydrophobicContact CD2-CD1 3.63Å; L54-L71 HydrophobicContact CD2-CG 4.38Å; L54-L71 HydrophobicContact CG-CB 4.19Å; L54-L71 HydrophobicContact CG-CD1 4.42Å; N55-L71 WeakPolarHBondContact O-CA 3.45Å; F56-L71 HydrophobicContact CB-CD2 4.36Å; F56-L71 HydrophobicContact CD2-CD2 4.03Å; M69-L71 HydrophobicContact CB-CD2 4.45Å; L71-L73 PolarHBondContact O-N 3.46Å
72	S	87.6	Confident	76	Confident	41 Å²	41	60.6 Å²	60.6	29%	0.287	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	132.6	174	-62.5	0	0	0	0	111.2	L54 N55	L54-S72 WeakPolarHBondContact CD1-O 3.47Å; N55-S72 PolarHBondContact O-N 2.98Å; N55-S72 VanDerWaalsContact O-N 3.11Å
73	L	83.7	Confident	74	Confident	73 Å²	73	64 Å²	64	38%	0.382	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-72.4	137.9	172.1	-172.5	67.9	0	0	0	109.2	T18 L20 L71	T18-L73 WeakPolarHBondContact O-CB 3.26Å; T18-L73 PolarHBondContact O-N 2.85Å; L20-L73 HydrophobicContact CB-CD1 4.32Å; L71-L73 PolarHBondContact O-N 3.46Å
74	M	78.9	Confident	72.1	Confident	20 Å²	20	57.4 Å²	57.4	10%	0.099	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-102.9	129.3	172.4	-63.8	-176	65.6	0	0	108.6	L54 K76 R89 D91 I97	L54-M74 HydrophobicContact CD1-CG 4.21Å; L54-M74 HydrophobicContact CD1-SD 4.13Å; M74-K76 VanDerWaalsContact C-N 3.27Å; M74-K76 PolarHBondContact O-N 2.99Å; M74-R89 HydrophobicContact CE-CB 3.4Å; M74-R89 VanDerWaalsContact CE-CB 3.4Å; M74-R89 HydrophobicContact SD-CB 3.4Å; M74-R89 WeakPolarHBondContact SD-CB 3.43Å; M74-R89 HydrophobicContact SD-CG 4.14Å; M74-D91 HydrophobicContact CE-CB 3.82Å; M74-I97 HydrophobicContact CE-CB 3.48Å; M74-I97 VanDerWaalsContact CE-CB 3.48Å; M74-I97 HydrophobicContact CE-CG1 3.22Å; M74-I97 HydrophobicContact CE-CG2 4.29Å; M74-I97 HydrophobicContact SD-CB 3.71Å; M74-I97 HydrophobicContact SD-CG1 3.91Å; M74-I97 HydrophobicContact SD-CG2 3.88Å
75	N	76.2	Confident	70.2	Confident	121 Å²	121	54.7 Å²	54.7	65%	0.647	34%	0.336	S	S	*	.	S	Bend	trans	-69.4	-26.7	-172.5	-70.7	-25.9	0	0	0	112.9
76	K	69.8	Low	69.2	Low	111 Å²	111	59.2 Å²	59.2	48%	0.483	34%	0.343	S	S	.	.	S	Bend	trans	-103.7	117.1	172.6	-73.5	-178.6	-177.7	163.1	0	108.1	M74 V90 S92	M74-K76 VanDerWaalsContact C-N 3.27Å; M74-K76 PolarHBondContact O-N 2.99Å; K76-V90 VanDerWaalsContact CB-O 3.27Å; K76-V90 WeakPolarHBondContact CB-O 3.46Å; K76-S92 PolarHBondContact NZ-O 3.14Å
77	G	61.2	Low	68.3	Low	59 Å²	59	59.7 Å²	59.7	61%	0.608	35%	0.346	S	S	*	.			trans	-58.6	175.6	176.9	0	0	0	0	0	112.4	S79	G77-S79 PolarHBondContact O-N 3.37Å
78	D	60.4	Low	67.4	Low	58 Å²	58	60.2 Å²	60.2	31%	0.31	35%	0.348	S	S	.	.			trans	-45.7	113.9	179.1	-72.4	-52.1	0	0	0	110.8	L80 R89	D78-L80 PolarHBondContact O-N 2.92Å; D78-R89 WeakPolarHBondContact OD1-CG 3.46Å; D78-R89 IonicContact OD1-CZ 3.94Å; D78-R89 IonicContact OD1-NE 2.66Å; D78-R89 PolarHBondContact OD1-NE 3.27Å; D78-R89 IonicContact OD1-NH2 2.99Å; D78-R89 PolarHBondContact OD1-NH2 2.72Å; D78-R89 IonicContact OD2-CZ 3.06Å; D78-R89 IonicContact OD2-NE 3.19Å; D78-R89 IonicContact OD2-NH2 3.18Å; D78-R89 PolarHBondContact OD2-NH2 2.85Å
79	S	53.3	Low	66.7	Low	45 Å²	45	62.3 Å²	62.3	32%	0.315	36%	0.355	S	S	.	.	S	Bend	trans	-62.2	-2.7	177.4	-173.2	0	0	0	0	112.7	G77	G77-S79 PolarHBondContact O-N 3.37Å
80	L	52.1	Low	66	Low	43 Å²	43	63 Å²	63	23%	0.225	36%	0.361	C	S	.	.			trans	-127.7	91.6	175.5	-65.5	165.8	0	0	0	107.3	D78 S82 C85	D78-L80 PolarHBondContact O-N 2.92Å; L80-S82 PolarHBondContact O-N 3.46Å; L80-C85 HydrophobicContact CD1-CB 4Å
81	S	48.2	Very low	65.6	Low	127 Å²	127	62.7 Å²	62.7	89%	0.888	36%	0.359	S	S	*	.			trans	-63.1	-3.3	172.4	70.5	0	0	0	0	113.3
82	S	45.8	Very low	65.3	Low	46 Å²	46	64.9 Å²	64.9	32%	0.322	38%	0.375	S	S	.	.	S	Bend	trans	-85.9	119.1	172.9	68	0	0	0	0	111.3	L80 N84	L80-S82 PolarHBondContact O-N 3.46Å; S82-N84 PolarHBondContact O-N 3.39Å
83	T	46.3	Very low	65.1	Low	116 Å²	116	67.4 Å²	67.4	71%	0.712	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	2.3	-169.4	42	0	0	0	0	120.5
84	N	45.4	Very low	65.1	Low	131 Å²	131	66.1 Å²	66.1	70%	0.701	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	-8.7	-167.2	-68.6	-23.9	0	0	0	116.4	S82 W125	S82-N84 PolarHBondContact O-N 3.39Å; N84-W125 WeakPolarHBondContact O-CZ3 2.99Å
85	C	47.5	Very low	65.2	Low	25 Å²	25	70.1 Å²	70.1	17%	0.169	40%	0.404	C	S	.	.			trans	-124.6	70.2	-178.6	-137.4	0	0	0	0	113.1	L80 I87	L80-C85 HydrophobicContact CD1-CB 4Å; C85-I87 PolarHBondContact O-N 3.17Å
86	K	64.5	Low	65.5	Low	137 Å²	137	66 Å²	66	60%	0.596	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	15.6	178.9	-61.4	-177.9	178.8	179.1	0	114.6
87	I	67	Low	66.1	Low	37 Å²	37	61.1 Å²	61.1	19%	0.19	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-22.7	-169.6	-54.5	176.6	0	0	0	111	C85 V98 A99 W125 L151	C85-I87 PolarHBondContact O-N 3.17Å; I87-V98 HydrophobicContact CG2-CG1 4.05Å; I87-V98 CarbonylContact O-C 3.58Å; I87-V98 WeakPolarHBondContact O-CA 2.97Å; I87-A99 PolarHBondContact O-N 3.26Å; I87-W125 HydrophobicContact CD1-CE3 4.41Å; I87-W125 HydrophobicContact CD1-CH2 3.67Å; I87-W125 HydrophobicContact CD1-CZ2 4.21Å; I87-W125 HydrophobicContact CD1-CZ3 3.76Å; I87-W125 HydrophobicContact CG1-CH2 4.31Å; I87-W125 HydrophobicContact CG1-CZ3 4.36Å; I87-L151 HydrophobicContact CG2-CD2 4.43Å
88	H	69.3	Low	67.2	Low	11 Å²	11	60.1 Å²	60.1	5%	0.051	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.4	-178.2	-61.2	-76.4	0	0	0	111.6	V96 I97 T139 L151	H88-V96 HydrophobicContact CB-CG1 4.29Å; H88-I97 WeakPolarHBondContact CA-O 3.46Å; H88-T139 WeakPolarHBondContact CD2-CG2 3.33Å; H88-T139 WeakPolarHBondContact NE2-CG2 3.25Å; H88-L151 WeakPolarHBondContact CE1-CD2 3.36Å; H88-L151 WeakPolarHBondContact NE2-CD2 3.23Å
89	R	73.6	Confident	68.3	Low	51 Å²	51	57.7 Å²	57.7	19%	0.192	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.7	170.7	-69.8	-179.1	174.5	-174.6	-12.1	108.4	M74 D78 V96 I97	M74-R89 HydrophobicContact CE-CB 3.4Å; M74-R89 VanDerWaalsContact CE-CB 3.4Å; M74-R89 HydrophobicContact SD-CB 3.4Å; M74-R89 WeakPolarHBondContact SD-CB 3.43Å; M74-R89 HydrophobicContact SD-CG 4.14Å; D78-R89 WeakPolarHBondContact OD1-CG 3.46Å; D78-R89 IonicContact OD1-CZ 3.94Å; D78-R89 IonicContact OD1-NE 2.66Å; D78-R89 PolarHBondContact OD1-NE 3.27Å; D78-R89 IonicContact OD1-NH2 2.99Å; D78-R89 PolarHBondContact OD1-NH2 2.72Å; D78-R89 IonicContact OD2-CZ 3.06Å; D78-R89 IonicContact OD2-NE 3.19Å; D78-R89 IonicContact OD2-NH2 3.18Å; D78-R89 PolarHBondContact OD2-NH2 2.85Å; R89-V96 CarbonylContact O-C 3.59Å; R89-V96 WeakPolarHBondContact O-CA 3.46Å; R89-I97 PolarHBondContact N-O 3.49Å; R89-I97 PolarHBondContact O-N 3.28Å
90	V	76.2	Confident	69.6	Low	33 Å²	33	57.1 Å²	57.1	20%	0.2	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.2	174.8	-177.5	0	0	0	0	106.5	K76 R95 I137	K76-V90 VanDerWaalsContact CB-O 3.27Å; K76-V90 WeakPolarHBondContact CB-O 3.46Å; V90-R95 CarbonylContact C-O 3.54Å; V90-R95 WeakPolarHBondContact CA-O 2.74Å; V90-I137 HydrophobicContact CG2-CD1 4.28Å
91	D	80.5	Confident	70.7	Confident	23 Å²	23	56.3 Å²	56.3	12%	0.123	33%	0.328	C	S	.	.			trans	-74.9	170.9	178.5	-165.1	15.4	0	0	0	111.1	M74 D93 G94 R95 I97	M74-D91 HydrophobicContact CE-CB 3.82Å; D91-D93 WeakPolarHBondContact CB-OD1 3.4Å; D91-D93 PolarHBondContact O-N 3.42Å; D91-D93 VanDerWaalsContact O-N 3.15Å; D91-G94 PolarHBondContact O-N 3.18Å; D91-R95 HydrophobicContact CB-CB 4.42Å; D91-R95 PolarHBondContact N-O 3.09Å; D91-R95 IonicContact OD2-CZ 3.68Å; D91-R95 IonicContact OD2-NH2 2.87Å; D91-R95 PolarHBondContact OD2-NH2 3.01Å; D91-I97 HydrophobicContact CB-CG1 4.31Å
92	S	82.9	Confident	71.9	Confident	54 Å²	54	51.6 Å²	51.6	38%	0.378	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-33.1	-178.6	38.8	0	0	0	0	113.5	K76 G94	K76-S92 PolarHBondContact NZ-O 3.14Å; S92-G94 VanDerWaalsContact C-N 3.32Å
93	D	84.8	Confident	73	Confident	94 Å²	94	54.9 Å²	54.9	50%	0.503	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	4.7	179.3	65.3	-0.3	0	0	0	114.3	D91 R95	D91-D93 WeakPolarHBondContact CB-OD1 3.4Å; D91-D93 PolarHBondContact O-N 3.42Å; D91-D93 VanDerWaalsContact O-N 3.15Å; D93-R95 VanDerWaalsContact CG-NE 3.3Å; D93-R95 WeakPolarHBondContact OD1-CB 3.26Å; D93-R95 WeakPolarHBondContact OD1-CG 3.47Å; D93-R95 PolarHBondContact OD1-N 3.43Å; D93-R95 IonicContact OD1-NE 2.95Å; D93-R95 PolarHBondContact OD1-NE 3.13Å; D93-R95 WeakPolarHBondContact OD2-CD 3.37Å; D93-R95 IonicContact OD2-CZ 3.43Å; D93-R95 IonicContact OD2-NE 3.8Å; D93-R95 PolarHBondContact OD2-NE 2.79Å; D93-R95 IonicContact OD2-NH2 3.33Å; D93-R95 PolarHBondContact OD2-NH2 2.94Å
94	G	82.5	Confident	74.1	Confident	46 Å²	46	52.2 Å²	52.2	47%	0.474	30%	0.296	S	S	.	.	S	Bend	trans	86.6	1.4	178.6	0	0	0	0	0	114.7	D91 S92	D91-G94 PolarHBondContact O-N 3.18Å; S92-G94 VanDerWaalsContact C-N 3.32Å
95	R	81.5	Confident	75.4	Confident	105 Å²	105	49.2 Å²	49.2	40%	0.396	28%	0.28	S	S	.	.			trans	-67.5	137.9	174.5	-69.2	-178.2	-60.7	-176.8	-1.8	111.3	V90 D91 D93 I97	V90-R95 CarbonylContact C-O 3.54Å; V90-R95 WeakPolarHBondContact CA-O 2.74Å; D91-R95 HydrophobicContact CB-CB 4.42Å; D91-R95 PolarHBondContact N-O 3.09Å; D91-R95 IonicContact OD2-CZ 3.68Å; D91-R95 IonicContact OD2-NH2 2.87Å; D91-R95 PolarHBondContact OD2-NH2 3.01Å; D93-R95 VanDerWaalsContact CG-NE 3.3Å; D93-R95 WeakPolarHBondContact OD1-CB 3.26Å; D93-R95 WeakPolarHBondContact OD1-CG 3.47Å; D93-R95 PolarHBondContact OD1-N 3.43Å; D93-R95 IonicContact OD1-NE 2.95Å; D93-R95 PolarHBondContact OD1-NE 3.13Å; D93-R95 WeakPolarHBondContact OD2-CD 3.37Å; D93-R95 IonicContact OD2-CZ 3.43Å; D93-R95 IonicContact OD2-NE 3.8Å; D93-R95 PolarHBondContact OD2-NE 2.79Å; D93-R95 IonicContact OD2-NH2 3.33Å; D93-R95 PolarHBondContact OD2-NH2 2.94Å; R95-I97 HydrophobicContact CB-CD1 4.38Å
96	V	81.9	Confident	76.6	Confident	33 Å²	33	50.8 Å²	50.8	20%	0.2	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	113.9	172.1	-178.5	0	0	0	0	108.7	H88 R89 I137	H88-V96 HydrophobicContact CB-CG1 4.29Å; R89-V96 CarbonylContact O-C 3.59Å; R89-V96 WeakPolarHBondContact O-CA 3.46Å; V96-I137 HydrophobicContact CG1-CD1 4.4Å; V96-I137 HydrophobicContact CG2-CD1 3.85Å
97	I	83	Confident	76.9	Confident	10 Å²	10	48.5 Å²	48.5	5%	0.051	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.5	174.3	-54.6	-54.6	0	0	0	109.1	A51 N52 L53 L54 M74 H88 R89 D91 R95	A51-I97 WeakPolarHBondContact O-CD1 3.49Å; N52-I97 WeakPolarHBondContact O-CA 3.22Å; L53-I97 VanDerWaalsContact C-CG2 3.49Å; L54-I97 HydrophobicContact CB-CG2 3.92Å; L54-I97 HydrophobicContact CD1-CG2 4.39Å; L54-I97 VanDerWaalsContact N-CG2 3.31Å; M74-I97 HydrophobicContact CE-CB 3.48Å; M74-I97 VanDerWaalsContact CE-CB 3.48Å; M74-I97 HydrophobicContact CE-CG1 3.22Å; M74-I97 HydrophobicContact CE-CG2 4.29Å; M74-I97 HydrophobicContact SD-CB 3.71Å; M74-I97 HydrophobicContact SD-CG1 3.91Å; M74-I97 HydrophobicContact SD-CG2 3.88Å; H88-I97 WeakPolarHBondContact CA-O 3.46Å; R89-I97 PolarHBondContact N-O 3.49Å; R89-I97 PolarHBondContact O-N 3.28Å; D91-I97 HydrophobicContact CB-CG1 4.31Å; R95-I97 HydrophobicContact CB-CD1 4.38Å
98	V	84.2	Confident	77.2	Confident	37 Å²	37	50 Å²	50	22%	0.224	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126	170.7	-170.4	0	0	0	0	108.7	N52 L53 L54 I87 F101	N52-V98 PolarHBondContact O-N 2.91Å; L53-V98 HydrophobicContact CD2-CB 3.9Å; L53-V98 HydrophobicContact CD2-CG2 4.3Å; L54-V98 PolarHBondContact N-O 2.95Å; L54-V98 VanDerWaalsContact N-O 3.08Å; I87-V98 HydrophobicContact CG2-CG1 4.05Å; I87-V98 CarbonylContact O-C 3.58Å; I87-V98 WeakPolarHBondContact O-CA 2.97Å; V98-F101 HydrophobicContact CB-CZ 4.25Å; V98-F101 HydrophobicContact CG1-CE1 4.39Å; V98-F101 HydrophobicContact CG1-CZ 4.18Å; V98-F101 WeakPolarHBondContact O-CE2 3.35Å; V98-F101 VanDerWaalsContact O-CZ 3.23Å; V98-F101 WeakPolarHBondContact O-CZ 3.45Å
99	A	82.9	Confident	77.1	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	31%	0.311	C	S	.	.			trans	-121.3	-177.1	175.2	0	0	0	0	0	109.9	L54 I87	L54-A99 HydrophobicContact CB-CB 4.4Å; L54-A99 HydrophobicContact CD2-CB 4.07Å; I87-A99 PolarHBondContact O-N 3.26Å
100	G	80.6	Confident	77	Confident	34 Å²	34	51.5 Å²	51.5	35%	0.351	31%	0.312	S	S	.	.			trans	83.8	26.5	173.2	0	0	0	0	0	115.2	G102	G100-G102 PolarHBondContact O-N 2.94Å
101	F	76.7	Confident	77	Confident	25 Å²	25	57.5 Å²	57.5	11%	0.11	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-64.8	12.2	173.9	-52.2	-75.8	0	0	0	114.9	M45 L53 L54 V98 L103 T104	M45-F101 HydrophobicContact CE-CD2 4.05Å; M45-F101 HydrophobicContact CG-CB 4.29Å; M45-F101 HydrophobicContact SD-CB 4.21Å; L53-F101 HydrophobicContact CB-CZ 4.1Å; L53-F101 HydrophobicContact CD1-CZ 4.47Å; L53-F101 HydrophobicContact CD2-CE1 4.19Å; L53-F101 HydrophobicContact CD2-CZ 3.71Å; L53-F101 HydrophobicContact CG-CZ 4.28Å; L54-F101 HydrophobicContact CB-CE2 4.37Å; V98-F101 HydrophobicContact CB-CZ 4.25Å; V98-F101 HydrophobicContact CG1-CE1 4.39Å; V98-F101 HydrophobicContact CG1-CZ 4.18Å; V98-F101 WeakPolarHBondContact O-CE2 3.35Å; V98-F101 VanDerWaalsContact O-CZ 3.23Å; V98-F101 WeakPolarHBondContact O-CZ 3.45Å; F101-L103 PolarHBondContact O-N 2.97Å; F101-T104 HydrophobicContact CB-CG2 4.15Å; F101-T104 HydrophobicContact CD1-CG2 3.82Å; F101-T104 HydrophobicContact CG-CG2 4.49Å; F101-T104 PolarHBondContact O-N 3.38Å; F101-T104 VanDerWaalsContact O-N 3.09Å; F101-T104 PolarHBondContact O-OG1 3.21Å
102	G	73.1	Confident	76.9	Confident	28 Å²	28	60.4 Å²	60.4	29%	0.289	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-61.9	-16.1	-178.6	0	0	0	0	0	114.1	K41 G100	K41-G102 WeakPolarHBondContact CE-O 3.33Å; K41-G102 PolarHBondContact NZ-O 3.27Å; G100-G102 PolarHBondContact O-N 2.94Å
103	L	68.5	Low	76.3	Confident	116 Å²	116	61.4 Å²	61.4	61%	0.607	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-116.9	6.9	177.7	-61.7	177.7	0	0	0	113.3	F101	F101-L103 PolarHBondContact O-N 2.97Å
104	T	70	Confident	75.3	Confident	59 Å²	59	58.9 Å²	58.9	36%	0.362	36%	0.357	S	S	.	.			trans	-70.5	139.5	175.5	48.5	0	0	0	0	110.6	F101	F101-T104 HydrophobicContact CB-CG2 4.15Å; F101-T104 HydrophobicContact CD1-CG2 3.82Å; F101-T104 HydrophobicContact CG-CG2 4.49Å; F101-T104 PolarHBondContact O-N 3.38Å; F101-T104 VanDerWaalsContact O-N 3.09Å; F101-T104 PolarHBondContact O-OG1 3.21Å
105	I	71.9	Confident	74.1	Confident	69 Å²	69	68.1 Å²	68.1	35%	0.354	38%	0.377	S	S	.	.			trans	-129	147	173	58.3	175.5	0	0	0	107.8	H110	I105-H110 HydrophobicContact CD1-CB 3.89Å
106	S	72.4	Confident	72.9	Confident	58 Å²	58	72.6 Å²	72.6	41%	0.406	39%	0.394	S	S	.	.			trans	-63.7	144.8	171.1	165.5	0	0	0	0	109.9	A108 E109 H110	S106-A108 PolarHBondContact O-N 3.45Å; S106-A108 PolarHBondContact OG-N 2.67Å; S106-A108 VanDerWaalsContact OG-N 3.17Å; S106-E109 WeakPolarHBondContact O-CB 3.48Å; S106-E109 PolarHBondContact O-N 3.3Å; S106-E109 VanDerWaalsContact O-N 3.07Å; S106-H110 PolarHBondContact O-N 2.81Å
107	L	71.3	Confident	71.5	Confident	89 Å²	89	80.3 Å²	80.3	47%	0.466	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-36.3	173.8	-173.2	65.4	0	0	0	111.4	E109 H110 Y111 F148	L107-E109 VanDerWaalsContact C-N 3.33Å; L107-E109 PolarHBondContact O-N 3.29Å; L107-H110 WeakPolarHBondContact O-CB 3.46Å; L107-H110 PolarHBondContact O-N 3.33Å; L107-Y111 HydrophobicContact CD1-CD2 4.32Å; L107-Y111 HydrophobicContact CD1-CE2 3.72Å; L107-Y111 HydrophobicContact CD2-CE2 3.82Å; L107-Y111 HydrophobicContact CG-CD2 3.9Å; L107-Y111 HydrophobicContact CG-CE2 3.43Å; L107-Y111 VanDerWaalsContact CG-CE2 3.43Å; L107-Y111 WeakPolarHBondContact O-CD2 3.35Å; L107-Y111 PolarHBondContact O-N 3.48Å; L107-F148 HydrophobicContact CD1-CE1 4Å; L107-F148 HydrophobicContact CD1-CZ 4.19Å
108	A	72.5	Confident	70	Confident	68 Å²	68	85.4 Å²	85.4	56%	0.562	45%	0.448	S	S	*	.	H	α-helix	trans	-63.4	-39.7	174.1	0	0	0	0	0	111.6	S106 Y111 A112	S106-A108 PolarHBondContact O-N 3.45Å; S106-A108 PolarHBondContact OG-N 2.67Å; S106-A108 VanDerWaalsContact OG-N 3.17Å; A108-Y111 PolarHBondContact O-N 2.93Å; A108-A112 VanDerWaalsContact O-CB 3.27Å; A108-A112 WeakPolarHBondContact O-CB 3.37Å; A108-A112 PolarHBondContact O-N 2.86Å
109	E	69	Low	68.2	Low	50 Å²	50	88.6 Å²	88.6	23%	0.234	47%	0.473	C	S	.	.	H	α-helix	trans	-68.4	-38	176	-176.5	171	-154.9	0	0	111.7	R40 S106 L107 Y111 A112 N113	R40-E109 IonicContact CZ-OE1 2.68Å; R40-E109 IonicContact NH1-OE1 3.68Å; R40-E109 PolarHBondContact NH1-OE1 2.94Å; S106-E109 WeakPolarHBondContact O-CB 3.48Å; S106-E109 PolarHBondContact O-N 3.3Å; S106-E109 VanDerWaalsContact O-N 3.07Å; L107-E109 VanDerWaalsContact C-N 3.33Å; L107-E109 PolarHBondContact O-N 3.29Å; E109-Y111 VanDerWaalsContact C-N 3.34Å; E109-Y111 PolarHBondContact O-N 3.19Å; E109-A112 PolarHBondContact O-N 2.89Å; E109-N113 VanDerWaalsContact CG-ND2 3.29Å; E109-N113 WeakPolarHBondContact CG-ND2 3.49Å; E109-N113 VanDerWaalsContact O-CB 3.3Å; E109-N113 WeakPolarHBondContact O-CB 3.22Å; E109-N113 PolarHBondContact O-N 3.12Å; E109-N113 PolarHBondContact O-ND2 3.18Å
110	H	71.4	Confident	66.6	Low	43 Å²	43	97.5 Å²	97.5	20%	0.199	51%	0.506	C	S	.	.	H	α-helix	trans	-59.3	-45	172.8	178.7	-89.4	0	0	0	111.5	I105 S106 L107 R147	I105-H110 HydrophobicContact CD1-CB 3.89Å; S106-H110 PolarHBondContact O-N 2.81Å; L107-H110 WeakPolarHBondContact O-CB 3.46Å; L107-H110 PolarHBondContact O-N 3.33Å; H110-R147 VanDerWaalsContact NE2-CD 3.33Å; H110-R147 WeakPolarHBondContact NE2-CD 3.12Å
111	Y	75.4	Confident	65	Low	159 Å²	159	100.2 Å²	100.2	62%	0.624	51%	0.509	S	S	*	.	H	α-helix	trans	-69	-43	176.9	-71.4	-54	0	0	0	112.6	L107 A108 E109 N113 G114	L107-Y111 HydrophobicContact CD1-CD2 4.32Å; L107-Y111 HydrophobicContact CD1-CE2 3.72Å; L107-Y111 HydrophobicContact CD2-CE2 3.82Å; L107-Y111 HydrophobicContact CG-CD2 3.9Å; L107-Y111 HydrophobicContact CG-CE2 3.43Å; L107-Y111 VanDerWaalsContact CG-CE2 3.43Å; L107-Y111 WeakPolarHBondContact O-CD2 3.35Å; L107-Y111 PolarHBondContact O-N 3.48Å; A108-Y111 PolarHBondContact O-N 2.93Å; E109-Y111 VanDerWaalsContact C-N 3.34Å; E109-Y111 PolarHBondContact O-N 3.19Å; Y111-N113 VanDerWaalsContact C-N 3.35Å; Y111-N113 PolarHBondContact O-N 3.46Å; Y111-G114 PolarHBondContact O-N 2.84Å
112	A	78.7	Confident	63.3	Low	84 Å²	84	101.8 Å²	101.8	69%	0.694	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-35.6	-179.2	0	0	0	0	0	113	A108 E109 G114	A108-A112 VanDerWaalsContact O-CB 3.27Å; A108-A112 WeakPolarHBondContact O-CB 3.37Å; A108-A112 PolarHBondContact O-N 2.86Å; E109-A112 PolarHBondContact O-N 2.89Å; A112-G114 VanDerWaalsContact C-N 3.26Å; A112-G114 PolarHBondContact O-N 2.91Å
113	N	69.6	Low	61.6	Low	76 Å²	76	110.5 Å²	110.5	41%	0.406	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	-2.2	-176.3	-77.4	-28.9	0	0	0	114.5	E109 Y111	E109-N113 VanDerWaalsContact CG-ND2 3.29Å; E109-N113 WeakPolarHBondContact CG-ND2 3.49Å; E109-N113 VanDerWaalsContact O-CB 3.3Å; E109-N113 WeakPolarHBondContact O-CB 3.22Å; E109-N113 PolarHBondContact O-N 3.12Å; E109-N113 PolarHBondContact O-ND2 3.18Å; Y111-N113 VanDerWaalsContact C-N 3.35Å; Y111-N113 PolarHBondContact O-N 3.46Å
114	G	63.6	Low	60.1	Low	41 Å²	41	108 Å²	108	42%	0.423	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	55.8	-172	-178.7	0	0	0	0	0	113	Y111 A112 R116	Y111-G114 PolarHBondContact O-N 2.84Å; A112-G114 VanDerWaalsContact C-N 3.26Å; A112-G114 PolarHBondContact O-N 2.91Å; G114-R116 PolarHBondContact O-N 3.18Å
115	R	58.3	Low	58.5	Low	240 Å²	240	110.1 Å²	110.1	91%	0.906	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	20.6	-171.4	-56.7	-175.1	-160	175.1	6.2	115.8	K117 R147	R115-K117 PolarHBondContact O-N 3.09Å; R115-K117 VanDerWaalsContact O-N 3.1Å; R115-R147 PolarHBondContact O-NH2 2.86Å
116	R	56.9	Low	56.5	Low	199 Å²	199	114.7 Å²	114.7	75%	0.751	58%	0.582	S	S	*	*			trans	-56	120.3	178.2	-76	-171.9	-176.6	175.6	2.9	110.3	G114 Q118 R147	G114-R116 PolarHBondContact O-N 3.18Å; R116-Q118 PolarHBondContact O-N 3.2Å; R116-Q118 VanDerWaalsContact O-N 3.1Å; R116-R147 VanDerWaalsContact C-NH2 3.32Å; R116-R147 PolarHBondContact O-NH1 3.24Å; R116-R147 PolarHBondContact O-NH2 3.41Å
117	K	52	Low	54.6	Low	194 Å²	194	114.8 Å²	114.8	84%	0.843	58%	0.577	S	S	*	*			trans	-65.7	103.1	178	-72.6	179.1	177.5	176.4	0	108.5	R115 S119	R115-K117 PolarHBondContact O-N 3.09Å; R115-K117 VanDerWaalsContact O-N 3.1Å; K117-S119 PolarHBondContact O-N 3.29Å
118	Q	51.6	Low	52.8	Low	117 Å²	117	117.5 Å²	117.5	55%	0.547	59%	0.585	S	S	.	*			trans	-75.2	114.5	163.4	-78.7	-177.7	-10.2	0	0	107.7	R116	R116-Q118 PolarHBondContact O-N 3.2Å; R116-Q118 VanDerWaalsContact O-N 3.1Å
119	S	46.3	Very low	51	Low	105 Å²	105	116 Å²	116	73%	0.734	57%	0.573	S	S	*	*			trans	-99.1	24.4	-176.3	92.4	0	0	0	0	114.3	K117	K117-S119 PolarHBondContact O-N 3.29Å
120	Y	48.4	Very low	49.4	Very low	194 Å²	194	115.2 Å²	115.2	76%	0.761	57%	0.573	S	S	*	*			trans	-108.8	73.4	178.7	-66.8	-82.7	0	0	0	110.4
121	Q	47.9	Very low	47.7	Very low	90 Å²	90	118.7 Å²	118.7	42%	0.421	60%	0.602	S	S	.	*			trans	-137.1	134.7	170.4	-68.8	-170.4	-23.4	0	0	109.6	K123 Q143	Q121-K123 PolarHBondContact O-N 3.48Å; Q121-Q143 VanDerWaalsContact CD-NE2 3.26Å
122	S	40.9	Very low	46	Very low	58 Å²	58	116.2 Å²	116.2	41%	0.406	60%	0.604	S	S	.	*			trans	-60	116.7	171.8	42.5	0	0	0	0	109.1	G124 W125	S122-G124 PolarHBondContact O-N 3.4Å; S122-G124 VanDerWaalsContact O-N 3.14Å; S122-W125 WeakPolarHBondContact OG-CZ2 3.24Å; S122-W125 PolarHBondContact OG-NE1 2.81Å; S122-W125 VanDerWaalsContact OG-NE1 3.08Å
123	K	36.9	Very low	44	Very low	211 Å²	211	115.1 Å²	115.1	92%	0.917	59%	0.589	S	S	*	*	S	Bend	trans	-76.8	96.6	171.3	-67.7	-177.9	-179.1	178.4	0	107.5	Q121	Q121-K123 PolarHBondContact O-N 3.48Å
124	G	36.4	Very low	42.4	Very low	65 Å²	65	116.9 Å²	116.9	67%	0.67	60%	0.598	S	S	*	*			trans	112.8	104.3	174.1	0	0	0	0	0	113.3	S122	S122-G124 PolarHBondContact O-N 3.4Å; S122-G124 VanDerWaalsContact O-N 3.14Å
125	W	37.6	Very low	41.1	Very low	103 Å²	103	118 Å²	118	39%	0.39	60%	0.596	S	S	.	*			trans	-99.2	115.8	161.3	-65.6	85.3	0	0	0	107	N84 I87 S122	N84-W125 WeakPolarHBondContact O-CZ3 2.99Å; I87-W125 HydrophobicContact CD1-CE3 4.41Å; I87-W125 HydrophobicContact CD1-CH2 3.67Å; I87-W125 HydrophobicContact CD1-CZ2 4.21Å; I87-W125 HydrophobicContact CD1-CZ3 3.76Å; I87-W125 HydrophobicContact CG1-CH2 4.31Å; I87-W125 HydrophobicContact CG1-CZ3 4.36Å; S122-W125 WeakPolarHBondContact OG-CZ2 3.24Å; S122-W125 PolarHBondContact OG-NE1 2.81Å; S122-W125 VanDerWaalsContact OG-NE1 3.08Å
126	L	29.5	Very low	40.1	Very low	165 Å²	165	107.1 Å²	107.1	86%	0.864	56%	0.557	S	S	*	*			trans	-96.1	130.6	-179.7	-156.2	88.3	0	0	0	109.2	K128	L126-K128 PolarHBondContact O-N 3Å
127	L	32.4	Very low	39.2	Very low	59 Å²	59	99.2 Å²	99.2	31%	0.309	53%	0.529	S	S	.	.			trans	-69.6	123.8	171	-72	164.8	0	0	0	109	A138 Y164	L127-A138 HydrophobicContact CD2-CB 3.61Å; L127-Y164 HydrophobicContact CD1-CE1 4.46Å
128	K	34.3	Very low	38.5	Very low	146 Å²	146	90.2 Å²	90.2	64%	0.635	49%	0.491	S	S	*	.			trans	-127.1	121.5	167.8	-160.4	172.3	-173.3	178.6	0	108.3	L126	L126-K128 PolarHBondContact O-N 3Å
129	A	34.1	Very low	37.9	Very low	36 Å²	36	85.7 Å²	85.7	30%	0.298	47%	0.471	S	S	.	.			trans	-79.5	138.4	175.7	0	0	0	0	0	110	V136 V161	A129-V136 HydrophobicContact CB-CG1 4.15Å; A129-V136 HydrophobicContact CB-CG2 4.45Å; A129-V161 HydrophobicContact CB-CG1 3.27Å
130	S	35.7	Very low	37.5	Very low	35 Å²	35	81.6 Å²	81.6	25%	0.245	44%	0.442	C	S	.	.			trans	-100.6	133.3	167.8	-169.9	0	0	0	0	108.9	T132 V136	S130-T132 VanDerWaalsContact C-N 3.3Å; S130-T132 PolarHBondContact OG-OG1 3.4Å; S130-V136 WeakPolarHBondContact O-CG2 3.3Å
131	S	36.3	Very low	37.2	Very low	115 Å²	115	73.7 Å²	73.7	80%	0.804	42%	0.415	S	S	*	.	S	Bend	trans	-85.7	3.8	-178.7	56.7	0	0	0	0	113.9
132	T	38.2	Very low	36.7	Very low	108 Å²	108	70.2 Å²	70.2	66%	0.663	40%	0.399	S	S	*	.	S	Bend	trans	-100	1.4	-165.7	51.9	0	0	0	0	115.3	S130	S130-T132 VanDerWaalsContact C-N 3.3Å; S130-T132 PolarHBondContact OG-OG1 3.4Å
133	T	37.2	Very low	36.6	Very low	61 Å²	61	70.7 Å²	70.7	37%	0.374	40%	0.395	S	S	.	.	S	Bend	trans	-142	145.9	175.6	48.7	0	0	0	0	110.2	V135	T133-V135 PolarHBondContact O-N 2.9Å; T133-V135 PolarHBondContact OG1-O 3.49Å
134	D	36.6	Very low	36.7	Very low	112 Å²	112	65.9 Å²	65.9	60%	0.599	38%	0.379	S	S	*	.	S	Bend	trans	-61.7	0.2	178.7	-81.8	-31.6	0	0	0	115.2	R157 S158	D134-R157 VanDerWaalsContact O-CA 3.27Å; D134-R157 WeakPolarHBondContact O-CA 3.22Å; D134-R157 WeakPolarHBondContact O-CG 3.25Å; D134-S158 WeakPolarHBondContact CA-OG 3.37Å; D134-S158 PolarHBondContact O-N 3.01Å; D134-S158 VanDerWaalsContact O-N 3.12Å; D134-S158 PolarHBondContact OD1-OG 2.71Å
135	V	34.7	Very low	36.5	Very low	64 Å²	64	67.9 Å²	67.9	39%	0.388	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	117	-176.6	166.2	0	0	0	0	108.1	T133 I137 I155	T133-V135 PolarHBondContact O-N 2.9Å; T133-V135 PolarHBondContact OG1-O 3.49Å; V135-I137 HydrophobicContact CG1-CG1 4.12Å; V135-I155 HydrophobicContact CB-CG2 4.24Å; V135-I155 HydrophobicContact CG1-CB 4.31Å; V135-I155 HydrophobicContact CG1-CG1 4.11Å; V135-I155 HydrophobicContact CG1-CG2 3.47Å; V135-I155 VanDerWaalsContact CG1-CG2 3.47Å; V135-I155 HydrophobicContact CG2-CG2 4.12Å
136	V	37.2	Very low	36.3	Very low	12 Å²	12	64.8 Å²	64.8	7%	0.073	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.3	168	169.9	0	0	0	0	108.8	A129 S130 I155 L156 V161	A129-V136 HydrophobicContact CB-CG1 4.15Å; A129-V136 HydrophobicContact CB-CG2 4.45Å; S130-V136 WeakPolarHBondContact O-CG2 3.3Å; V136-I155 CarbonylContact O-C 3.53Å; V136-I155 VanDerWaalsContact O-CA 3.25Å; V136-I155 WeakPolarHBondContact O-CA 3.33Å; V136-L156 HydrophobicContact CB-CB 4.45Å; V136-L156 PolarHBondContact N-O 3.17Å; V136-L156 PolarHBondContact O-N 3.03Å; V136-V161 HydrophobicContact CB-CG2 3.89Å; V136-V161 HydrophobicContact CG2-CB 4.38Å; V136-V161 HydrophobicContact CG2-CG1 4.26Å; V136-V161 HydrophobicContact CG2-CG2 3.22Å
137	I	38.3	Very low	36.9	Very low	33 Å²	33	61.9 Å²	61.9	17%	0.169	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	104.5	173.5	-71.6	166.8	0	0	0	108.1	V90 V96 V135 T139 L153 I155	V90-I137 HydrophobicContact CG2-CD1 4.28Å; V96-I137 HydrophobicContact CG1-CD1 4.4Å; V96-I137 HydrophobicContact CG2-CD1 3.85Å; V135-I137 HydrophobicContact CG1-CG1 4.12Å; I137-T139 HydrophobicContact CG2-CG2 3.88Å; I137-L153 HydrophobicContact CB-CD1 4.35Å; I137-L153 HydrophobicContact CG1-CD1 4.39Å; I137-L153 HydrophobicContact CG2-CD1 3.23Å; I137-L153 HydrophobicContact CG2-CG 4.11Å; I137-I155 HydrophobicContact CG1-CG1 4.2Å
138	A	37.1	Very low	37.1	Very low	5 Å²	5	63.9 Å²	63.9	4%	0.041	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.6	166.9	0	0	0	0	0	108.8	L127 L153 V154	L127-A138 HydrophobicContact CD2-CB 3.61Å; A138-L153 CarbonylContact O-C 3.59Å; A138-L153 WeakPolarHBondContact O-CA 3.33Å; A138-V154 HydrophobicContact CB-CB 4.23Å; A138-V154 PolarHBondContact N-O 3.34Å; A138-V154 PolarHBondContact O-N 3.25Å
139	T	38.9	Very low	37.3	Very low	22 Å²	22	60.5 Å²	60.5	14%	0.135	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	117.2	175.5	45.1	0	0	0	0	108.9	H88 I137 L151 S152 L153	H88-T139 WeakPolarHBondContact CD2-CG2 3.33Å; H88-T139 WeakPolarHBondContact NE2-CG2 3.25Å; I137-T139 HydrophobicContact CG2-CG2 3.88Å; T139-L151 HydrophobicContact CG2-CD1 3.99Å; T139-S152 CarbonylContact C-O 3.58Å; T139-S152 WeakPolarHBondContact CA-O 3.27Å; T139-L153 HydrophobicContact CG2-CD1 4.06Å
140	V	39.3	Very low	37.6	Very low	19 Å²	19	60.6 Å²	60.6	12%	0.115	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	112.5	173.8	-166	0	0	0	0	109.1	L151 S152 W215	V140-L151 CarbonylContact O-C 3.53Å; V140-L151 VanDerWaalsContact O-CA 3.3Å; V140-L151 WeakPolarHBondContact O-CA 3.42Å; V140-S152 PolarHBondContact N-O 3.27Å; V140-S152 PolarHBondContact O-N 3.14Å; V140-W215 HydrophobicContact CB-CZ2 4.28Å; V140-W215 HydrophobicContact CG1-CZ2 3.83Å; V140-W215 HydrophobicContact CG2-CZ2 3.69Å
141	S	41.5	Very low	38	Very low	29 Å²	29	61.4 Å²	61.4	20%	0.203	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.1	168.5	174.9	0	0	0	0	108.6	T149	S141-T149 VanDerWaalsContact OG-CG2 3.23Å; S141-T149 WeakPolarHBondContact OG-CG2 3.27Å
142	L	37.8	Very low	38.1	Very low	16 Å²	16	56.3 Å²	56.3	8%	0.084	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.6	170.9	-85.3	143.7	0	0	0	109.9	V150 C214 W215	L142-V150 HydrophobicContact CB-CB 4.31Å; L142-V150 HydrophobicContact CD1-CB 4.13Å; L142-V150 HydrophobicContact CD1-CG1 4.47Å; L142-V150 PolarHBondContact N-O 3.41Å; L142-C214 VanDerWaalsContact CD1-C 3.41Å; L142-C214 HydrophobicContact CD1-CB 3.7Å; L142-C214 WeakPolarHBondContact CD1-O 3.39Å; L142-W215 HydrophobicContact CD2-CB 4.41Å; L142-W215 VanDerWaalsContact CD2-CD1 3.5Å; L142-W215 HydrophobicContact CD2-CG 4.31Å
143	Q	39.2	Very low	38.4	Very low	68 Å²	68	53.5 Å²	53.5	32%	0.318	31%	0.305	S	S	.	.			trans	-103	125.6	162.5	-80.3	170.7	1.3	0	0	108.1	Q121	Q121-Q143 VanDerWaalsContact CD-NE2 3.26Å
144	N	37.7	Very low	38.9	Very low	110 Å²	110	51.3 Å²	51.3	59%	0.588	29%	0.291	S	S	*	.			trans	-170.5	140.5	153	-93.5	-23.4	0	0	0	113.1	A146	N144-A146 PolarHBondContact O-N 2.88Å
145	A	32.6	Very low	39.5	Very low	107 Å²	107	50.5 Å²	50.5	88%	0.884	29%	0.286	S	S	*	.	S	Bend	trans	43.6	-43.6	179.3	0	0	0	0	0	119.2
146	A	33.4	Very low	40	Very low	38 Å²	38	47.9 Å²	47.9	31%	0.314	27%	0.269	S	S	.	.	S	Bend	trans	-102.5	17.7	-176.1	0	0	0	0	0	114.8	N144 F148 P219	N144-A146 PolarHBondContact O-N 2.88Å; A146-F148 HydrophobicContact CB-CD2 4.03Å; A146-F148 HydrophobicContact CB-CE2 4.22Å; A146-F148 WeakPolarHBondContact O-CD2 3.45Å; A146-F148 VanDerWaalsContact O-CE2 3.24Å; A146-F148 WeakPolarHBondContact O-CE2 3.47Å; A146-F148 PolarHBondContact O-N 3.49Å; A146-P219 HydrophobicContact CB-CB 4.2Å; A146-P219 HydrophobicContact CB-CG 3.83Å
147	R	43	Very low	40.5	Very low	105 Å²	105	55.5 Å²	55.5	40%	0.396	30%	0.297	S	S	.	.			trans	57.2	13.8	169.9	-61.9	179.7	178.9	-174.7	1.7	117.8	H110 R115 R116	H110-R147 VanDerWaalsContact NE2-CD 3.33Å; H110-R147 WeakPolarHBondContact NE2-CD 3.12Å; R115-R147 PolarHBondContact O-NH2 2.86Å; R116-R147 VanDerWaalsContact C-NH2 3.32Å; R116-R147 PolarHBondContact O-NH1 3.24Å; R116-R147 PolarHBondContact O-NH2 3.41Å
148	F	35.6	Very low	40.6	Very low	100 Å²	100	56 Å²	56	44%	0.439	30%	0.303	S	S	.	.			trans	-88	125.1	172.1	-64	-75.6	0	0	0	110.5	L107 A146 V150	L107-F148 HydrophobicContact CD1-CE1 4Å; L107-F148 HydrophobicContact CD1-CZ 4.19Å; A146-F148 HydrophobicContact CB-CD2 4.03Å; A146-F148 HydrophobicContact CB-CE2 4.22Å; A146-F148 WeakPolarHBondContact O-CD2 3.45Å; A146-F148 VanDerWaalsContact O-CE2 3.24Å; A146-F148 WeakPolarHBondContact O-CE2 3.47Å; A146-F148 PolarHBondContact O-N 3.49Å; F148-V150 PolarHBondContact O-N 3.28Å
149	T	39.8	Very low	40.9	Very low	76 Å²	76	60.3 Å²	60.3	47%	0.466	33%	0.333	S	S	.	.			trans	-84.2	101.6	162.4	-60.7	0	0	0	0	107.8	S141	S141-T149 VanDerWaalsContact OG-CG2 3.23Å; S141-T149 WeakPolarHBondContact OG-CG2 3.27Å
150	V	40	Very low	41.4	Very low	38 Å²	38	60.5 Å²	60.5	23%	0.23	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.7	163.1	-179.6	0	0	0	0	106.2	L142 F148 I228	L142-V150 HydrophobicContact CB-CB 4.31Å; L142-V150 HydrophobicContact CD1-CB 4.13Å; L142-V150 HydrophobicContact CD1-CG1 4.47Å; L142-V150 PolarHBondContact N-O 3.41Å; F148-V150 PolarHBondContact O-N 3.28Å; V150-I228 HydrophobicContact CG1-CD1 4.34Å
151	L	43.2	Very low	41.6	Very low	51 Å²	51	60.7 Å²	60.7	27%	0.267	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	107	173.2	-176.6	81.6	0	0	0	108	I87 H88 T139 V140	I87-L151 HydrophobicContact CG2-CD2 4.43Å; H88-L151 WeakPolarHBondContact CE1-CD2 3.36Å; H88-L151 WeakPolarHBondContact NE2-CD2 3.23Å; T139-L151 HydrophobicContact CG2-CD1 3.99Å; V140-L151 CarbonylContact O-C 3.53Å; V140-L151 VanDerWaalsContact O-CA 3.3Å; V140-L151 WeakPolarHBondContact O-CA 3.42Å
152	S	39.3	Very low	41.5	Very low	8 Å²	8	62.2 Å²	62.2	6%	0.056	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.7	169.6	-61.2	0	0	0	0	109	T139 V140 C214	T139-S152 CarbonylContact C-O 3.58Å; T139-S152 WeakPolarHBondContact CA-O 3.27Å; V140-S152 PolarHBondContact N-O 3.27Å; V140-S152 PolarHBondContact O-N 3.14Å; S152-C214 PolarHBondContact OG-SG 2.92Å; S152-C214 VanDerWaalsContact OG-SG 3.33Å
153	L	44.8	Very low	41.9	Very low	50 Å²	50	66 Å²	66	26%	0.262	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	112.2	169.1	-166.6	91.7	0	0	0	107.5	I137 A138 T139 I155	I137-L153 HydrophobicContact CB-CD1 4.35Å; I137-L153 HydrophobicContact CG1-CD1 4.39Å; I137-L153 HydrophobicContact CG2-CD1 3.23Å; I137-L153 HydrophobicContact CG2-CG 4.11Å; A138-L153 CarbonylContact O-C 3.59Å; A138-L153 WeakPolarHBondContact O-CA 3.33Å; T139-L153 HydrophobicContact CG2-CD1 4.06Å; L153-I155 HydrophobicContact CD2-CD1 3.88Å; L153-I155 HydrophobicContact CD2-CG1 4.03Å; L153-I155 HydrophobicContact CG-CG1 4.41Å
154	V	47	Very low	42	Very low	14 Å²	14	63.8 Å²	63.8	9%	0.085	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	112.1	169.4	-176.5	0	0	0	0	107.5	A138 L156 M211	A138-V154 HydrophobicContact CB-CB 4.23Å; A138-V154 PolarHBondContact N-O 3.34Å; A138-V154 PolarHBondContact O-N 3.25Å; V154-L156 HydrophobicContact CG1-CD2 4.09Å; V154-L156 HydrophobicContact CG1-CG 4.02Å; V154-M211 HydrophobicContact CB-SD 4.4Å; V154-M211 HydrophobicContact CG1-SD 4.44Å; V154-M211 HydrophobicContact CG2-CG 3.69Å; V154-M211 HydrophobicContact CG2-SD 3.72Å
155	I	48.4	Very low	42.1	Very low	96 Å²	96	62.9 Å²	62.9	49%	0.492	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	105.7	172.6	-69.7	167.2	0	0	0	107.3	V135 V136 I137 L153	V135-I155 HydrophobicContact CB-CG2 4.24Å; V135-I155 HydrophobicContact CG1-CB 4.31Å; V135-I155 HydrophobicContact CG1-CG1 4.11Å; V135-I155 HydrophobicContact CG1-CG2 3.47Å; V135-I155 VanDerWaalsContact CG1-CG2 3.47Å; V135-I155 HydrophobicContact CG2-CG2 4.12Å; V136-I155 CarbonylContact O-C 3.53Å; V136-I155 VanDerWaalsContact O-CA 3.25Å; V136-I155 WeakPolarHBondContact O-CA 3.33Å; I137-I155 HydrophobicContact CG1-CG1 4.2Å; L153-I155 HydrophobicContact CD2-CD1 3.88Å; L153-I155 HydrophobicContact CD2-CG1 4.03Å; L153-I155 HydrophobicContact CG-CG1 4.41Å
156	L	46.5	Very low	42.2	Very low	8 Å²	8	61.4 Å²	61.4	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.4	171	-68	173.9	0	0	0	109.4	V136 V154 L160 Y164	V136-L156 HydrophobicContact CB-CB 4.45Å; V136-L156 PolarHBondContact N-O 3.17Å; V136-L156 PolarHBondContact O-N 3.03Å; V154-L156 HydrophobicContact CG1-CD2 4.09Å; V154-L156 HydrophobicContact CG1-CG 4.02Å; L156-L160 HydrophobicContact CB-CB 4.47Å; L156-L160 HydrophobicContact CD2-CD1 4.25Å; L156-Y164 HydrophobicContact CD1-CD1 3.58Å; L156-Y164 HydrophobicContact CD1-CD2 3.63Å; L156-Y164 HydrophobicContact CD1-CE1 4Å; L156-Y164 HydrophobicContact CD1-CE2 4.08Å; L156-Y164 HydrophobicContact CD1-CG 3.38Å
157	R	46.2	Very low	42.3	Very low	173 Å²	173	63.1 Å²	63.1	65%	0.653	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	142.8	170.5	-132.1	176.6	173.5	139.1	-2.9	109.5	D134 S159 L160	D134-R157 VanDerWaalsContact O-CA 3.27Å; D134-R157 WeakPolarHBondContact O-CA 3.22Å; D134-R157 WeakPolarHBondContact O-CG 3.25Å; R157-S159 PolarHBondContact O-N 3.03Å; R157-L160 WeakPolarHBondContact O-CB 3.37Å; R157-L160 PolarHBondContact O-N 3.07Å
158	S	40.9	Very low	42	Very low	42 Å²	42	59.5 Å²	59.5	29%	0.294	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-44.8	-33.5	179.8	39.6	0	0	0	0	114	D134 L160 V161	D134-S158 WeakPolarHBondContact CA-OG 3.37Å; D134-S158 PolarHBondContact O-N 3.01Å; D134-S158 VanDerWaalsContact O-N 3.12Å; D134-S158 PolarHBondContact OD1-OG 2.71Å; S158-L160 VanDerWaalsContact C-N 3.28Å; S158-L160 PolarHBondContact O-N 3.3Å; S158-V161 WeakPolarHBondContact O-CB 3.3Å; S158-V161 VanDerWaalsContact O-CG2 3.27Å; S158-V161 WeakPolarHBondContact O-CG2 3.27Å; S158-V161 PolarHBondContact O-N 2.84Å
159	S	44.7	Very low	41.9	Very low	97 Å²	97	57.5 Å²	57.5	68%	0.678	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-67.1	-17.9	176.4	60.6	0	0	0	0	115.8	R157	R157-S159 PolarHBondContact O-N 3.03Å
160	L	48.6	Very low	41.8	Very low	26 Å²	26	57.2 Å²	57.2	14%	0.136	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-97.3	-3.4	178.7	-67.8	170.6	0	0	0	113	L156 R157 S158 T163 Y164 V200	L156-L160 HydrophobicContact CB-CB 4.47Å; L156-L160 HydrophobicContact CD2-CD1 4.25Å; R157-L160 WeakPolarHBondContact O-CB 3.37Å; R157-L160 PolarHBondContact O-N 3.07Å; S158-L160 VanDerWaalsContact C-N 3.28Å; S158-L160 PolarHBondContact O-N 3.3Å; L160-T163 PolarHBondContact O-OG1 2.96Å; L160-Y164 WeakPolarHBondContact O-CB 3.48Å; L160-Y164 PolarHBondContact O-N 3.48Å; L160-V200 HydrophobicContact CD2-CG1 3.8Å
161	V	44.5	Very low	41.6	Very low	23 Å²	23	57.6 Å²	57.6	14%	0.139	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-40.5	-169.7	176.8	0	0	0	0	112.3	A129 V136 S158 Y164 H165	A129-V161 HydrophobicContact CB-CG1 3.27Å; V136-V161 HydrophobicContact CB-CG2 3.89Å; V136-V161 HydrophobicContact CG2-CB 4.38Å; V136-V161 HydrophobicContact CG2-CG1 4.26Å; V136-V161 HydrophobicContact CG2-CG2 3.22Å; S158-V161 WeakPolarHBondContact O-CB 3.3Å; S158-V161 VanDerWaalsContact O-CG2 3.27Å; S158-V161 WeakPolarHBondContact O-CG2 3.27Å; S158-V161 PolarHBondContact O-N 2.84Å; V161-Y164 PolarHBondContact O-N 2.92Å; V161-H165 WeakPolarHBondContact O-CB 3.25Å; V161-H165 PolarHBondContact O-N 2.89Å
162	G	38.9	Very low	41.4	Very low	60 Å²	60	59.9 Å²	59.9	62%	0.619	35%	0.348	S	S	*	.	H	α-helix	trans	-64.1	-41.5	179.9	0	0	0	0	0	112.5	S166	G162-S166 PolarHBondContact O-N 2.84Å
163	T	45.5	Very low	41.3	Very low	95 Å²	95	67.4 Å²	67.4	58%	0.583	38%	0.383	S	S	*	.	H	α-helix	trans	-71	-40.3	175.6	46.8	0	0	0	0	111.2	L160 W167	L160-T163 PolarHBondContact O-OG1 2.96Å; T163-W167 WeakPolarHBondContact O-CB 3.17Å; T163-W167 PolarHBondContact O-N 2.82Å
164	Y	41.8	Very low	41.3	Very low	22 Å²	22	70.7 Å²	70.7	9%	0.086	40%	0.396	C	S	.	.	H	α-helix	trans	-68.7	-40.5	-179.5	-164.6	-101.9	0	0	0	113.4	L127 L156 L160 V161 W167 C168 F204 M211	L127-Y164 HydrophobicContact CD1-CE1 4.46Å; L156-Y164 HydrophobicContact CD1-CD1 3.58Å; L156-Y164 HydrophobicContact CD1-CD2 3.63Å; L156-Y164 HydrophobicContact CD1-CE1 4Å; L156-Y164 HydrophobicContact CD1-CE2 4.08Å; L156-Y164 HydrophobicContact CD1-CG 3.38Å; L160-Y164 WeakPolarHBondContact O-CB 3.48Å; L160-Y164 PolarHBondContact O-N 3.48Å; V161-Y164 PolarHBondContact O-N 2.92Å; Y164-W167 PolarHBondContact O-N 2.86Å; Y164-C168 WeakPolarHBondContact CE1-SG 3.04Å; Y164-C168 PolarHBondContact O-N 3.35Å; Y164-F204 HydrophobicContact CD2-CE2 4.46Å; Y164-M211 HydrophobicContact CE2-CE 3.79Å; Y164-M211 HydrophobicContact CE2-SD 4.44Å; Y164-M211 WeakPolarHBondContact OH-CE 3.21Å; Y164-M211 PolarHBondContact OH-SD 2.85Å
165	H	40.1	Very low	40.8	Very low	91 Å²	91	73.2 Å²	73.2	42%	0.421	43%	0.425	S	S	.	.	H	α-helix	trans	-65	-47.3	179.7	-169.8	-80.3	0	0	0	112.1	V161 W167 C168 C169	V161-H165 WeakPolarHBondContact O-CB 3.25Å; V161-H165 PolarHBondContact O-N 2.89Å; H165-W167 PolarHBondContact O-N 3.43Å; H165-C168 PolarHBondContact O-N 2.99Å; H165-C169 PolarHBondContact O-N 3.3Å; H165-C169 VanDerWaalsContact O-N 3.1Å; H165-C169 PolarHBondContact O-SG 3.49Å; H165-C169 VanDerWaalsContact O-SG 3.32Å
166	S	34.4	Very low	40.6	Very low	76 Å²	76	77.8 Å²	77.8	53%	0.531	44%	0.444	S	S	.	.	H	α-helix	trans	-57	-38	174.6	177.8	0	0	0	0	111.8	G162 T170	G162-S166 PolarHBondContact O-N 2.84Å; S166-T170 PolarHBondContact O-N 3.1Å; S166-T170 VanDerWaalsContact O-N 3.14Å; S166-T170 PolarHBondContact O-OG1 2.99Å
167	W	34.9	Very low	40.2	Very low	74 Å²	74	82.3 Å²	82.3	28%	0.28	48%	0.477	S	S	.	.	H	α-helix	trans	-76.7	-39.5	-177.7	-137.2	74.2	0	0	0	113.7	T163 Y164 H165 C169 T170 L171 L183 Y208	T163-W167 WeakPolarHBondContact O-CB 3.17Å; T163-W167 PolarHBondContact O-N 2.82Å; Y164-W167 PolarHBondContact O-N 2.86Å; H165-W167 PolarHBondContact O-N 3.43Å; W167-C169 VanDerWaalsContact C-N 3.33Å; W167-C169 PolarHBondContact O-N 3.49Å; W167-T170 WeakPolarHBondContact O-CB 3.48Å; W167-T170 PolarHBondContact O-N 3.32Å; W167-L171 HydrophobicContact CD2-CD1 4.44Å; W167-L171 HydrophobicContact CE3-CD1 3.45Å; W167-L171 VanDerWaalsContact CE3-CD1 3.45Å; W167-L171 HydrophobicContact CE3-CG 4.25Å; W167-L171 HydrophobicContact CZ3-CD1 3.55Å; W167-L171 HydrophobicContact CZ3-CG 4.45Å; W167-L171 PolarHBondContact O-N 3.07Å; W167-L183 HydrophobicContact CH2-CD2 3.66Å; W167-L183 HydrophobicContact CZ2-CD2 3.16Å; W167-L183 HydrophobicContact CZ2-CG 4.45Å; W167-Y208 HydrophobicContact CH2-CE1 4.16Å; W167-Y208 HydrophobicContact CH2-CE2 4.01Å; W167-Y208 AromaticContact CH2-CZ 3.72Å; W167-Y208 HydrophobicContact CZ3-CD2 4.08Å; W167-Y208 HydrophobicContact CZ3-CE1 4.42Å; W167-Y208 AromaticContact CZ3-CE2 3.43Å; W167-Y208 HydrophobicContact CZ3-CE2 3.43Å; W167-Y208 VanDerWaalsContact CZ3-CE2 3.43Å; W167-Y208 AromaticContact CZ3-CZ 3.6Å
168	C	37.3	Very low	39.9	Very low	29 Å²	29	83.7 Å²	83.7	20%	0.196	48%	0.482	C	S	.	.	H	α-helix	trans	-62.6	-38.8	172.4	-81.1	0	0	0	0	111.9	Y164 H165 T170 L171 S172	Y164-C168 WeakPolarHBondContact CE1-SG 3.04Å; Y164-C168 PolarHBondContact O-N 3.35Å; H165-C168 PolarHBondContact O-N 2.99Å; C168-T170 VanDerWaalsContact C-N 3.32Å; C168-T170 PolarHBondContact O-N 3.46Å; C168-L171 PolarHBondContact O-N 2.89Å; C168-S172 WeakPolarHBondContact O-CB 3.14Å; C168-S172 PolarHBondContact O-N 3.1Å
169	C	34	Very low	40	Very low	59 Å²	59	86.6 Å²	86.6	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-61.1	-41.9	172.2	-69.3	0	0	0	0	111.6	H165 W167 S172 Q173	H165-C169 PolarHBondContact O-N 3.3Å; H165-C169 VanDerWaalsContact O-N 3.1Å; H165-C169 PolarHBondContact O-SG 3.49Å; H165-C169 VanDerWaalsContact O-SG 3.32Å; W167-C169 VanDerWaalsContact C-N 3.33Å; W167-C169 PolarHBondContact O-N 3.49Å; C169-S172 PolarHBondContact O-N 2.83Å; C169-Q173 WeakPolarHBondContact O-CG 3.29Å; C169-Q173 PolarHBondContact O-N 2.85Å
170	T	36.2	Very low	40.3	Very low	69 Å²	69	87.6 Å²	87.6	42%	0.423	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-39.1	178.3	-51.9	0	0	0	0	112.3	S166 W167 C168 Q173 H174	S166-T170 PolarHBondContact O-N 3.1Å; S166-T170 VanDerWaalsContact O-N 3.14Å; S166-T170 PolarHBondContact O-OG1 2.99Å; W167-T170 WeakPolarHBondContact O-CB 3.48Å; W167-T170 PolarHBondContact O-N 3.32Å; C168-T170 VanDerWaalsContact C-N 3.32Å; C168-T170 PolarHBondContact O-N 3.46Å; T170-Q173 PolarHBondContact O-N 2.76Å; T170-H174 PolarHBondContact O-N 3.05Å
171	L	35.7	Very low	40.2	Very low	46 Å²	46	94.3 Å²	94.3	24%	0.241	52%	0.522	C	S	.	.	H	α-helix	trans	-71	-35.9	177.5	-81	168.4	0	0	0	113.1	W167 C168 Q173 H174 G175	W167-L171 HydrophobicContact CD2-CD1 4.44Å; W167-L171 HydrophobicContact CE3-CD1 3.45Å; W167-L171 VanDerWaalsContact CE3-CD1 3.45Å; W167-L171 HydrophobicContact CE3-CG 4.25Å; W167-L171 HydrophobicContact CZ3-CD1 3.55Å; W167-L171 HydrophobicContact CZ3-CG 4.45Å; W167-L171 PolarHBondContact O-N 3.07Å; C168-L171 PolarHBondContact O-N 2.89Å; L171-Q173 VanDerWaalsContact C-N 3.25Å; L171-Q173 PolarHBondContact O-N 3.1Å; L171-H174 PolarHBondContact O-N 3.29Å; L171-G175 PolarHBondContact O-N 3.41Å
172	S	39.4	Very low	40.3	Very low	99 Å²	99	102.2 Å²	102.2	69%	0.692	55%	0.549	S	S	*	.	H	α-helix	trans	-61.1	-36.4	173.9	-169.1	0	0	0	0	111.6	C168 C169	C168-S172 WeakPolarHBondContact O-CB 3.14Å; C168-S172 PolarHBondContact O-N 3.1Å; C169-S172 PolarHBondContact O-N 2.83Å
173	Q	37.2	Very low	40.5	Very low	167 Å²	167	102.9 Å²	102.9	78%	0.78	54%	0.538	S	S	*	.	H	α-helix	trans	-75.7	-23.2	176.9	-69.2	179.8	-2.9	0	0	113.6	C169 T170 L171	C169-Q173 WeakPolarHBondContact O-CG 3.29Å; C169-Q173 PolarHBondContact O-N 2.85Å; T170-Q173 PolarHBondContact O-N 2.76Å; L171-Q173 VanDerWaalsContact C-N 3.25Å; L171-Q173 PolarHBondContact O-N 3.1Å
174	H	45.6	Very low	40.7	Very low	118 Å²	118	101.8 Å²	101.8	55%	0.546	53%	0.531	S	S	.	.	H	α-helix	trans	-100.6	-2.6	-176.1	-100.3	-61.4	0	0	0	115.4	T170 L171 Q176	T170-H174 PolarHBondContact O-N 3.05Å; L171-H174 PolarHBondContact O-N 3.29Å; H174-Q176 PolarHBondContact O-N 2.98Å
175	G	36.5	Very low	41	Very low	67 Å²	67	106.7 Å²	106.7	69%	0.691	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	13.8	-170.9	0	0	0	0	0	117.9	L171	L171-G175 PolarHBondContact O-N 3.41Å
176	Q	44.6	Very low	41.5	Very low	192 Å²	192	111.9 Å²	111.9	90%	0.897	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	-10.2	-176.1	-74.5	-121.7	-10.1	0	0	116.7	H174	H174-Q176 PolarHBondContact O-N 2.98Å
177	S	37.6	Very low	41.9	Very low	103 Å²	103	110.9 Å²	110.9	72%	0.72	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.4	9.2	-171.5	59.1	0	0	0	0	120.8
178	R	38.8	Very low	42.3	Very low	202 Å²	202	111.4 Å²	111.4	76%	0.762	57%	0.574	S	S	*	*			trans	-138.9	143.2	179.9	-67.6	-172.1	179.2	179.5	-0	115.1	Q180	R178-Q180 PolarHBondContact O-N 3.34Å
179	P	42.8	Very low	42.9	Very low	104 Å²	104	114 Å²	114	68%	0.675	59%	0.591	S	S	*	*			trans	-66.9	123.8	-179.8	25.4	-32	0	0	0	111.5	K181	P179-K181 PolarHBondContact O-N 2.76Å
180	Q	51.5	Low	43.4	Very low	118 Å²	118	115.9 Å²	115.9	55%	0.551	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-4.1	-177.6	-71.4	-178.7	-30.7	0	0	115.4	R178 R182	R178-Q180 PolarHBondContact O-N 3.34Å; Q180-R182 PolarHBondContact O-N 3.12Å
181	K	46.4	Very low	44	Very low	167 Å²	167	117.9 Å²	117.9	73%	0.726	61%	0.613	S	S	*	*	H	α-helix	trans	-63.8	-35.2	-171.6	-154.8	173.2	-177.9	-178.3	0	113.6	P179 L183	P179-K181 PolarHBondContact O-N 2.76Å; K181-L183 PolarHBondContact O-N 3.02Å; K181-L183 VanDerWaalsContact O-N 3.07Å
182	R	46.3	Very low	44.6	Very low	189 Å²	189	120 Å²	120	71%	0.713	63%	0.628	S	S	*	*	H	α-helix	trans	-66.9	-13.1	-174.1	-66.7	-171	-166.3	-171.9	3.4	115.2	Q180 R186	Q180-R182 PolarHBondContact O-N 3.12Å; R182-R186 WeakPolarHBondContact O-CG 3.44Å
183	L	44.9	Very low	44.7	Very low	73 Å²	73	116.6 Å²	116.6	38%	0.382	60%	0.602	S	S	.	*	H	α-helix	trans	-92.7	-30	-169.2	-125.6	153.3	0	0	0	112.7	W167 K181	W167-L183 HydrophobicContact CH2-CD2 3.66Å; W167-L183 HydrophobicContact CZ2-CD2 3.16Å; W167-L183 HydrophobicContact CZ2-CG 4.45Å; K181-L183 PolarHBondContact O-N 3.02Å; K181-L183 VanDerWaalsContact O-N 3.07Å
184	V	47.7	Very low	45	Very low	73 Å²	73	112.2 Å²	112.2	44%	0.442	59%	0.588	S	S	.	*	H	α-helix	trans	-72.2	-37	172.5	179.3	0	0	0	0	110.8	R186 L187 Y208	V184-R186 PolarHBondContact O-N 2.8Å; V184-L187 PolarHBondContact O-N 3.43Å; V184-Y208 HydrophobicContact CG2-CE1 4.26Å
185	D	49.4	Very low	45.3	Very low	124 Å²	124	116.3 Å²	116.3	66%	0.663	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-19.8	-179.8	-60.7	-24.5	0	0	0	113.2	L187	D185-L187 VanDerWaalsContact C-N 3.31Å; D185-L187 PolarHBondContact O-N 2.85Å
186	R	49.9	Very low	45.9	Very low	201 Å²	201	117.3 Å²	117.3	76%	0.758	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-4.5	178.4	-76.2	-178.6	-179.8	-150.4	-2.1	114.2	R182 V184 T188	R182-R186 WeakPolarHBondContact O-CG 3.44Å; V184-R186 PolarHBondContact O-N 2.8Å; R186-T188 PolarHBondContact O-N 2.97Å
187	L	43.3	Very low	46.3	Very low	55 Å²	55	113.9 Å²	113.9	29%	0.288	58%	0.583	S	S	.	*	S	Bend	trans	-86	114.6	179	-61	173.6	0	0	0	109.3	V184 D185 R205	V184-L187 PolarHBondContact O-N 3.43Å; D185-L187 VanDerWaalsContact C-N 3.31Å; D185-L187 PolarHBondContact O-N 2.85Å; L187-R205 VanDerWaalsContact CB-CZ 3.48Å; L187-R205 HydrophobicContact CD1-CG 3.85Å; L187-R205 PolarHBondContact O-NH2 3.24Å
188	T	43.7	Very low	47	Very low	84 Å²	84	109.6 Å²	109.6	52%	0.515	56%	0.555	S	S	.	*			trans	-45.4	135.5	-176.2	-31	0	0	0	0	112.8	R186 L190 T192 R205	R186-T188 PolarHBondContact O-N 2.97Å; T188-L190 PolarHBondContact O-N 3.35Å; T188-T192 WeakPolarHBondContact CG2-OG1 3.34Å; T188-R205 PolarHBondContact O-NH2 3.13Å
189	P	49.1	Very low	47.9	Very low	83 Å²	83	101.8 Å²	101.8	54%	0.539	53%	0.531	S	S	.	.			trans	-49.7	138	178.7	-28	34.2	0	0	0	112.8	S191 T192	P189-S191 PolarHBondContact O-N 2.9Å; P189-T192 PolarHBondContact O-N 3.07Å; P189-T192 PolarHBondContact O-OG1 3.35Å
190	L	45.6	Very low	48.8	Very low	100 Å²	100	99.7 Å²	99.7	52%	0.524	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-52	-24.7	-178.6	-82	156.5	0	0	0	113.4	T188 T192 V202	T188-L190 PolarHBondContact O-N 3.35Å; L190-T192 PolarHBondContact O-N 3.17Å; L190-V202 HydrophobicContact CD2-CG2 3.48Å; L190-V202 VanDerWaalsContact CD2-CG2 3.48Å
191	S	48.3	Very low	49.3	Very low	110 Å²	110	97.1 Å²	97.1	77%	0.769	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-66.1	-17.8	178.5	53.6	0	0	0	0	115	P189	P189-S191 PolarHBondContact O-N 2.9Å
192	T	47.6	Very low	50.2	Low	90 Å²	90	91.3 Å²	91.3	55%	0.552	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-106	-1.1	-174.3	53.7	0	0	0	0	114.3	T188 P189 L190	T188-T192 WeakPolarHBondContact CG2-OG1 3.34Å; P189-T192 PolarHBondContact O-N 3.07Å; P189-T192 PolarHBondContact O-OG1 3.35Å; L190-T192 PolarHBondContact O-N 3.17Å
193	I	43	Very low	51.4	Low	29 Å²	29	82.9 Å²	82.9	15%	0.149	45%	0.454	C	S	.	.	S	Bend	trans	-94.6	126.2	-174.2	-61.2	165.2	0	0	0	109	K195 K197 L201	I193-K195 PolarHBondContact O-N 2.95Å; I193-K197 HydrophobicContact CG2-CB 3.5Å; I193-L201 HydrophobicContact CD1-CB 4.32Å; I193-L201 HydrophobicContact CD1-CD1 3.61Å; I193-L201 HydrophobicContact CG1-CD1 4.14Å; I193-L201 HydrophobicContact CG2-CD1 3.83Å
194	P	43.1	Very low	52.9	Low	75 Å²	75	81.3 Å²	81.3	49%	0.487	44%	0.444	S	S	.	.			trans	-52.1	136.8	172.3	-23.2	31.2	0	0	0	110.6	S196 K197 G198	P194-S196 PolarHBondContact O-N 3.26Å; P194-K197 HydrophobicContact CG-CD 4.48Å; P194-K197 WeakPolarHBondContact O-CA 3.44Å; P194-K197 PolarHBondContact O-N 3.19Å; P194-G198 PolarHBondContact O-N 3.14Å
195	K	51.2	Low	54.4	Low	203 Å²	203	81.1 Å²	81.1	88%	0.883	44%	0.436	S	S	*	.	H	α-helix	trans	-48.4	-34.4	-174.1	-71	-177.5	177.6	178.7	0	113.8	I193 G198	I193-K195 PolarHBondContact O-N 2.95Å; K195-G198 PolarHBondContact O-N 3.08Å
196	S	50.2	Low	55.9	Low	89 Å²	89	81.9 Å²	81.9	62%	0.622	43%	0.43	S	S	*	.	H	α-helix	trans	-67.4	-32.4	176.4	57.5	0	0	0	0	114.5	P194	P194-S196 PolarHBondContact O-N 3.26Å
197	K	51.4	Low	57.4	Low	120 Å²	120	72.9 Å²	72.9	52%	0.522	40%	0.398	S	S	.	.	H	α-helix	trans	-86.6	-20.4	173.5	-68.6	-178	175.2	177.8	0	112.4	I193 P194 C199 L201	I193-K197 HydrophobicContact CG2-CB 3.5Å; P194-K197 HydrophobicContact CG-CD 4.48Å; P194-K197 WeakPolarHBondContact O-CA 3.44Å; P194-K197 PolarHBondContact O-N 3.19Å; K197-C199 PolarHBondContact O-N 3.41Å; K197-L201 PolarHBondContact O-N 2.83Å
198	G	53.7	Low	59.3	Low	13 Å²	13	70.8 Å²	70.8	13%	0.134	39%	0.386	C	S	.	.	H	α-helix	trans	-57	-48.4	-178.5	0	0	0	0	0	112.4	P194 K195 V200 L201 V202	P194-G198 PolarHBondContact O-N 3.14Å; K195-G198 PolarHBondContact O-N 3.08Å; G198-V200 PolarHBondContact O-N 3.45Å; G198-L201 PolarHBondContact O-N 2.95Å; G198-V202 VanDerWaalsContact O-CB 3.26Å; G198-V202 WeakPolarHBondContact O-CB 3.15Å; G198-V202 WeakPolarHBondContact O-CG2 3.44Å; G198-V202 PolarHBondContact O-N 3.09Å
199	C	56.2	Low	61.4	Low	37 Å²	37	69.8 Å²	69.8	25%	0.25	38%	0.383	C	S	.	.	H	α-helix	trans	-64.1	-40.6	-174.2	-60.3	0	0	0	0	113.3	K197 S203 L242	K197-C199 PolarHBondContact O-N 3.41Å; C199-S203 PolarHBondContact O-N 2.76Å; C199-S203 VanDerWaalsContact O-N 3.15Å; C199-L242 HydrophobicContact CB-CD1 4.25Å
200	V	62.8	Low	63.3	Low	60 Å²	60	66.9 Å²	66.9	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-44.5	179.1	-177.7	0	0	0	0	110.9	L160 G198 F204	L160-V200 HydrophobicContact CD2-CG1 3.8Å; G198-V200 PolarHBondContact O-N 3.45Å; V200-F204 WeakPolarHBondContact O-CB 3.23Å; V200-F204 PolarHBondContact O-N 3.08Å
201	L	60.7	Low	65.2	Low	64 Å²	64	62.2 Å²	62.2	34%	0.335	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-34.7	-179.6	-73.9	167.2	0	0	0	112.5	I193 K197 G198 F204 R205	I193-L201 HydrophobicContact CD1-CB 4.32Å; I193-L201 HydrophobicContact CD1-CD1 3.61Å; I193-L201 HydrophobicContact CG1-CD1 4.14Å; I193-L201 HydrophobicContact CG2-CD1 3.83Å; K197-L201 PolarHBondContact O-N 2.83Å; G198-L201 PolarHBondContact O-N 2.95Å; L201-F204 PolarHBondContact O-N 2.84Å; L201-R205 WeakPolarHBondContact O-CG 3.18Å; L201-R205 PolarHBondContact O-N 3.31Å
202	V	65.4	Low	67.1	Low	45 Å²	45	58.9 Å²	58.9	27%	0.273	31%	0.312	S	S	.	.	H	α-helix	trans	-59.7	-53.4	174.2	167	0	0	0	0	109.9	L190 G198 F204 R205 Y206	L190-V202 HydrophobicContact CD2-CG2 3.48Å; L190-V202 VanDerWaalsContact CD2-CG2 3.48Å; G198-V202 VanDerWaalsContact O-CB 3.26Å; G198-V202 WeakPolarHBondContact O-CB 3.15Å; G198-V202 WeakPolarHBondContact O-CG2 3.44Å; G198-V202 PolarHBondContact O-N 3.09Å; V202-F204 VanDerWaalsContact C-N 3.34Å; V202-F204 PolarHBondContact O-N 2.77Å; V202-R205 PolarHBondContact O-N 3.42Å; V202-Y206 HydrophobicContact CG1-CD2 3.53Å; V202-Y206 HydrophobicContact CG1-CE2 3.46Å; V202-Y206 VanDerWaalsContact CG1-CE2 3.46Å; V202-Y206 WeakPolarHBondContact O-CD2 3.43Å; V202-Y206 PolarHBondContact O-N 3.39Å
203	S	73.2	Confident	69.2	Low	12 Å²	12	55.8 Å²	55.8	8%	0.084	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-37.7	178.9	174.4	0	0	0	0	113.6	C199 R205 Y206 S207 Y239	C199-S203 PolarHBondContact O-N 2.76Å; C199-S203 VanDerWaalsContact O-N 3.15Å; S203-R205 VanDerWaalsContact C-N 3.35Å; S203-R205 PolarHBondContact O-N 3.47Å; S203-Y206 PolarHBondContact O-N 2.96Å; S203-S207 WeakPolarHBondContact O-CB 3.49Å; S203-S207 PolarHBondContact O-N 2.66Å; S203-S207 PolarHBondContact O-OG 2.96Å; S203-Y239 WeakPolarHBondContact CB-OH 3.26Å; S203-Y239 VanDerWaalsContact OG-CE2 3.26Å; S203-Y239 WeakPolarHBondContact OG-CE2 3.32Å; S203-Y239 PolarHBondContact OG-OH 2.8Å
204	F	75.7	Confident	71.4	Confident	40 Å²	40	54.4 Å²	54.4	18%	0.175	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-45.9	174.6	-177.9	-95.7	0	0	0	111.2	Y164 V200 L201 V202 Y206 S207 Y208	Y164-F204 HydrophobicContact CD2-CE2 4.46Å; V200-F204 WeakPolarHBondContact O-CB 3.23Å; V200-F204 PolarHBondContact O-N 3.08Å; L201-F204 PolarHBondContact O-N 2.84Å; V202-F204 VanDerWaalsContact C-N 3.34Å; V202-F204 PolarHBondContact O-N 2.77Å; F204-Y206 PolarHBondContact O-N 2.83Å; F204-S207 PolarHBondContact O-OG 3.28Å; F204-S207 VanDerWaalsContact O-OG 3.1Å; F204-Y208 WeakPolarHBondContact O-CB 3.48Å; F204-Y208 PolarHBondContact O-N 3.49Å
205	R	78.4	Confident	73.6	Confident	69 Å²	69	54.6 Å²	54.6	26%	0.26	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-43.5	176	-75.3	-173.1	-170.1	-164.4	8.9	112.3	L187 T188 L201 V202 S203 S209	L187-R205 VanDerWaalsContact CB-CZ 3.48Å; L187-R205 HydrophobicContact CD1-CG 3.85Å; L187-R205 PolarHBondContact O-NH2 3.24Å; T188-R205 PolarHBondContact O-NH2 3.13Å; L201-R205 WeakPolarHBondContact O-CG 3.18Å; L201-R205 PolarHBondContact O-N 3.31Å; V202-R205 PolarHBondContact O-N 3.42Å; S203-R205 VanDerWaalsContact C-N 3.35Å; S203-R205 PolarHBondContact O-N 3.47Å; R205-S209 VanDerWaalsContact O-CB 3.26Å; R205-S209 WeakPolarHBondContact O-CB 3.33Å; R205-S209 PolarHBondContact O-N 2.76Å; R205-S209 PolarHBondContact O-OG 3.04Å
206	Y	81.9	Confident	75.4	Confident	140 Å²	140	51.3 Å²	51.3	55%	0.549	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-51.9	-180	-82.8	-67.9	0	0	0	111.7	V202 S203 F204 Y208 S209 L210	V202-Y206 HydrophobicContact CG1-CD2 3.53Å; V202-Y206 HydrophobicContact CG1-CE2 3.46Å; V202-Y206 VanDerWaalsContact CG1-CE2 3.46Å; V202-Y206 WeakPolarHBondContact O-CD2 3.43Å; V202-Y206 PolarHBondContact O-N 3.39Å; S203-Y206 PolarHBondContact O-N 2.96Å; F204-Y206 PolarHBondContact O-N 2.83Å; Y206-Y208 PolarHBondContact O-N 3.06Å; Y206-S209 PolarHBondContact O-N 3.06Å; Y206-S209 PolarHBondContact O-OG 2.98Å; Y206-L210 PolarHBondContact O-N 2.76Å
207	S	80.4	Confident	77.1	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.084	27%	0.267	C	S	.	.	H	α-helix	trans	-61.1	-43.1	178	56.5	0	0	0	0	112	S203 F204 L210 M211	S203-S207 WeakPolarHBondContact O-CB 3.49Å; S203-S207 PolarHBondContact O-N 2.66Å; S203-S207 PolarHBondContact O-OG 2.96Å; F204-S207 PolarHBondContact O-OG 3.28Å; F204-S207 VanDerWaalsContact O-OG 3.1Å; S207-L210 PolarHBondContact O-N 3.19Å; S207-M211 WeakPolarHBondContact O-CG 3.1Å; S207-M211 PolarHBondContact O-N 2.73Å
208	Y	84.1	Confident	78.9	Confident	11 Å²	11	51.2 Å²	51.2	4%	0.043	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-43.2	176	-174.4	-114.6	0	0	0	112.6	W167 V184 F204 Y206 L210 M211 L212	W167-Y208 HydrophobicContact CH2-CE1 4.16Å; W167-Y208 HydrophobicContact CH2-CE2 4.01Å; W167-Y208 AromaticContact CH2-CZ 3.72Å; W167-Y208 HydrophobicContact CZ3-CD2 4.08Å; W167-Y208 HydrophobicContact CZ3-CE1 4.42Å; W167-Y208 AromaticContact CZ3-CE2 3.43Å; W167-Y208 HydrophobicContact CZ3-CE2 3.43Å; W167-Y208 VanDerWaalsContact CZ3-CE2 3.43Å; W167-Y208 AromaticContact CZ3-CZ 3.6Å; V184-Y208 HydrophobicContact CG2-CE1 4.26Å; F204-Y208 WeakPolarHBondContact O-CB 3.48Å; F204-Y208 PolarHBondContact O-N 3.49Å; Y206-Y208 PolarHBondContact O-N 3.06Å; Y208-L210 VanDerWaalsContact C-N 3.29Å; Y208-L210 PolarHBondContact O-N 3.18Å; Y208-M211 HydrophobicContact CD2-CE 4.04Å; Y208-M211 PolarHBondContact O-N 3.01Å; Y208-L212 HydrophobicContact CD1-CD1 3.9Å; Y208-L212 HydrophobicContact CD1-CG 4.36Å; Y208-L212 HydrophobicContact CE1-CD1 3.42Å; Y208-L212 VanDerWaalsContact CE1-CD1 3.42Å; Y208-L212 HydrophobicContact CE1-CD2 4.46Å; Y208-L212 HydrophobicContact CE1-CG 3.99Å; Y208-L212 HydrophobicContact CE2-CD2 4.26Å; Y208-L212 HydrophobicContact CE2-CG 4.19Å; Y208-L212 WeakPolarHBondContact O-CG 3.28Å; Y208-L212 PolarHBondContact O-N 2.86Å
209	S	88.1	Confident	80.4	Confident	63 Å²	63	52.4 Å²	52.4	44%	0.441	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-38.1	176.3	79	0	0	0	0	112.2	R205 Y206 L212 A213	R205-S209 VanDerWaalsContact O-CB 3.26Å; R205-S209 WeakPolarHBondContact O-CB 3.33Å; R205-S209 PolarHBondContact O-N 2.76Å; R205-S209 PolarHBondContact O-OG 3.04Å; Y206-S209 PolarHBondContact O-N 3.06Å; Y206-S209 PolarHBondContact O-OG 2.98Å; S209-L212 PolarHBondContact O-N 2.88Å; S209-A213 WeakPolarHBondContact O-CB 3.36Å; S209-A213 PolarHBondContact O-N 2.98Å
210	L	87.9	Confident	82.1	Confident	22 Å²	22	55.5 Å²	55.5	12%	0.115	29%	0.292	C	S	.	.	H	α-helix	trans	-67.7	-43	177.5	-173.4	63.5	0	0	0	111	Y206 S207 Y208 A213 C214 I228 H231 L232	Y206-L210 PolarHBondContact O-N 2.76Å; S207-L210 PolarHBondContact O-N 3.19Å; Y208-L210 VanDerWaalsContact C-N 3.29Å; Y208-L210 PolarHBondContact O-N 3.18Å; L210-A213 PolarHBondContact O-N 3.08Å; L210-C214 PolarHBondContact O-N 3.07Å; L210-C214 PolarHBondContact O-SG 3.25Å; L210-I228 HydrophobicContact CD1-CG1 4.36Å; L210-I228 HydrophobicContact CD2-CG2 4.28Å; L210-H231 HydrophobicContact CD1-CB 4.25Å; L210-H231 HydrophobicContact CD2-CB 4.35Å; L210-L232 HydrophobicContact CD2-CD2 3.75Å; L210-L232 HydrophobicContact CD2-CG 3.99Å
211	M	87	Confident	83.6	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-59.6	-46.7	173.7	-72.6	-172.9	-70.9	0	0	112	V154 Y164 S207 Y208 A213 C214 W215	V154-M211 HydrophobicContact CB-SD 4.4Å; V154-M211 HydrophobicContact CG1-SD 4.44Å; V154-M211 HydrophobicContact CG2-CG 3.69Å; V154-M211 HydrophobicContact CG2-SD 3.72Å; Y164-M211 HydrophobicContact CE2-CE 3.79Å; Y164-M211 HydrophobicContact CE2-SD 4.44Å; Y164-M211 WeakPolarHBondContact OH-CE 3.21Å; Y164-M211 PolarHBondContact OH-SD 2.85Å; S207-M211 WeakPolarHBondContact O-CG 3.1Å; S207-M211 PolarHBondContact O-N 2.73Å; Y208-M211 HydrophobicContact CD2-CE 4.04Å; Y208-M211 PolarHBondContact O-N 3.01Å; M211-A213 VanDerWaalsContact C-N 3.31Å; M211-A213 PolarHBondContact O-N 3.35Å; M211-C214 WeakPolarHBondContact O-CB 3.46Å; M211-C214 PolarHBondContact O-N 3.47Å; M211-W215 HydrophobicContact CB-CE3 4.38Å; M211-W215 HydrophobicContact CB-CH2 4.29Å; M211-W215 HydrophobicContact CB-CZ3 4.2Å; M211-W215 WeakPolarHBondContact O-CB 3.46Å; M211-W215 VanDerWaalsContact O-CG 3.24Å; M211-W215 PolarHBondContact O-N 3.07Å; M211-W215 HydrophobicContact SD-CH2 4.34Å
212	L	88.2	Confident	85.1	Confident	40 Å²	40	52.8 Å²	52.8	21%	0.209	28%	0.277	C	S	.	.	H	α-helix	trans	-60.9	-39.5	175.6	-71.7	-178.9	0	0	0	112.2	Y208 S209 C214 W215 R216	Y208-L212 HydrophobicContact CD1-CD1 3.9Å; Y208-L212 HydrophobicContact CD1-CG 4.36Å; Y208-L212 HydrophobicContact CE1-CD1 3.42Å; Y208-L212 VanDerWaalsContact CE1-CD1 3.42Å; Y208-L212 HydrophobicContact CE1-CD2 4.46Å; Y208-L212 HydrophobicContact CE1-CG 3.99Å; Y208-L212 HydrophobicContact CE2-CD2 4.26Å; Y208-L212 HydrophobicContact CE2-CG 4.19Å; Y208-L212 WeakPolarHBondContact O-CG 3.28Å; Y208-L212 PolarHBondContact O-N 2.86Å; S209-L212 PolarHBondContact O-N 2.88Å; L212-C214 VanDerWaalsContact C-N 3.35Å; L212-W215 HydrophobicContact CD2-CE3 4.19Å; L212-W215 CarbonylContact O-C 3.58Å; L212-W215 PolarHBondContact O-N 2.68Å; L212-W215 VanDerWaalsContact O-N 3.14Å; L212-R216 PolarHBondContact O-N 3.33Å
213	A	90	Very high	86.3	Confident	24 Å²	24	51.7 Å²	51.7	20%	0.198	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-39.6	176.5	0	0	0	0	0	111.9	S209 L210 M211 W215 R216 P223	S209-A213 WeakPolarHBondContact O-CB 3.36Å; S209-A213 PolarHBondContact O-N 2.98Å; L210-A213 PolarHBondContact O-N 3.08Å; M211-A213 VanDerWaalsContact C-N 3.31Å; M211-A213 PolarHBondContact O-N 3.35Å; A213-W215 VanDerWaalsContact C-N 3.31Å; A213-R216 WeakPolarHBondContact O-CG 3.4Å; A213-P223 HydrophobicContact CB-CG 4.23Å; A213-P223 VanDerWaalsContact O-CD 3.26Å; A213-P223 WeakPolarHBondContact O-CD 3.33Å
214	C	89.2	Confident	87.1	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.007	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-37.5	171.6	-66	0	0	0	0	111.1	L142 S152 L210 M211 L212 R216 R222	L142-C214 VanDerWaalsContact CD1-C 3.41Å; L142-C214 HydrophobicContact CD1-CB 3.7Å; L142-C214 WeakPolarHBondContact CD1-O 3.39Å; S152-C214 PolarHBondContact OG-SG 2.92Å; S152-C214 VanDerWaalsContact OG-SG 3.33Å; L210-C214 PolarHBondContact O-N 3.07Å; L210-C214 PolarHBondContact O-SG 3.25Å; M211-C214 WeakPolarHBondContact O-CB 3.46Å; M211-C214 PolarHBondContact O-N 3.47Å; L212-C214 VanDerWaalsContact C-N 3.35Å; C214-R216 VanDerWaalsContact C-N 3.28Å; C214-R216 PolarHBondContact O-N 3.48Å; C214-R222 VanDerWaalsContact O-CD 3.26Å; C214-R222 WeakPolarHBondContact O-CD 3.38Å; C214-R222 WeakPolarHBondContact O-CG 3.42Å
215	W	89.4	Confident	87.6	Confident	78 Å²	78	59.5 Å²	59.5	30%	0.295	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	8.8	-177.5	-66.7	-17.6	0	0	0	116.5	V140 L142 M211 L212 A213 S217	V140-W215 HydrophobicContact CB-CZ2 4.28Å; V140-W215 HydrophobicContact CG1-CZ2 3.83Å; V140-W215 HydrophobicContact CG2-CZ2 3.69Å; L142-W215 HydrophobicContact CD2-CB 4.41Å; L142-W215 VanDerWaalsContact CD2-CD1 3.5Å; L142-W215 HydrophobicContact CD2-CG 4.31Å; M211-W215 HydrophobicContact CB-CE3 4.38Å; M211-W215 HydrophobicContact CB-CH2 4.29Å; M211-W215 HydrophobicContact CB-CZ3 4.2Å; M211-W215 WeakPolarHBondContact O-CB 3.46Å; M211-W215 VanDerWaalsContact O-CG 3.24Å; M211-W215 PolarHBondContact O-N 3.07Å; M211-W215 HydrophobicContact SD-CH2 4.34Å; L212-W215 HydrophobicContact CD2-CE3 4.19Å; L212-W215 CarbonylContact O-C 3.58Å; L212-W215 PolarHBondContact O-N 2.68Å; L212-W215 VanDerWaalsContact O-N 3.14Å; A213-W215 VanDerWaalsContact C-N 3.31Å; W215-S217 PolarHBondContact O-N 2.98Å
216	R	88.8	Confident	88	Confident	134 Å²	134	66 Å²	66	51%	0.506	34%	0.336	S	S	.	.			trans	-60.3	137.9	176.7	-68.2	178.8	175.6	179.2	-6.3	111.3	L212 A213 C214 E218 S221 R222	L212-R216 PolarHBondContact O-N 3.33Å; A213-R216 WeakPolarHBondContact O-CG 3.4Å; C214-R216 VanDerWaalsContact C-N 3.28Å; C214-R216 PolarHBondContact O-N 3.48Å; R216-E218 VanDerWaalsContact C-N 3.34Å; R216-E218 PolarHBondContact O-N 3.15Å; R216-S221 WeakPolarHBondContact CB-OG 3.33Å; R216-S221 VanDerWaalsContact CD-O 3.32Å; R216-S221 WeakPolarHBondContact CD-O 3.37Å; R216-S221 VanDerWaalsContact CD-OG 3.22Å; R216-S221 WeakPolarHBondContact CD-OG 3.48Å; R216-S221 PolarHBondContact NH1-O 2.95Å; R216-R222 HydrophobicContact CB-CG 4.22Å; R216-R222 PolarHBondContact O-NE 2.99Å; R216-R222 PolarHBondContact O-NH2 3.14Å; R216-R222 VanDerWaalsContact O-NH2 3.13Å
217	S	87.3	Confident	88.4	Confident	106 Å²	106	65.6 Å²	65.6	74%	0.741	34%	0.336	S	S	*	.	S	Bend	trans	-57.1	-49.4	-179.8	48.5	0	0	0	0	111.1	W215 P219 R222	W215-S217 PolarHBondContact O-N 2.98Å; S217-P219 WeakPolarHBondContact O-CD 3.31Å; S217-R222 PolarHBondContact O-NH2 2.91Å; S217-R222 VanDerWaalsContact O-NH2 3.09Å
218	E	89.3	Confident	88.7	Confident	102 Å²	102	65.6 Å²	65.6	48%	0.477	34%	0.335	S	S	.	.	S	Bend	trans	-75	113.8	-179.5	179.7	48	-130.8	0	0	111.5	R216 S220 S221	R216-E218 VanDerWaalsContact C-N 3.34Å; R216-E218 PolarHBondContact O-N 3.15Å; E218-S220 VanDerWaalsContact C-N 3.28Å; E218-S220 VanDerWaalsContact CG-OG 3.22Å; E218-S220 WeakPolarHBondContact CG-OG 3.48Å; E218-S220 PolarHBondContact O-N 2.97Å; E218-S220 PolarHBondContact OE1-N 3.43Å; E218-S220 PolarHBondContact OE1-OG 2.93Å; E218-S221 WeakPolarHBondContact O-CB 3.5Å; E218-S221 PolarHBondContact O-N 2.9Å; E218-S221 PolarHBondContact O-OG 3.11Å
219	P	84.9	Confident	88.9	Confident	37 Å²	37	70.9 Å²	70.9	24%	0.24	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-58.5	-36.6	-176.1	-25.8	35.6	0	0	0	113.9	A146 S217 S221 R222	A146-P219 HydrophobicContact CB-CB 4.2Å; A146-P219 HydrophobicContact CB-CG 3.83Å; S217-P219 WeakPolarHBondContact O-CD 3.31Å; P219-S221 PolarHBondContact O-N 3.42Å; P219-R222 WeakPolarHBondContact O-CB 3.27Å; P219-R222 PolarHBondContact O-N 2.99Å
220	S	92.2	Very high	88.9	Confident	102 Å²	102	71.5 Å²	71.5	71%	0.713	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-65.5	-20.1	178.9	60.3	0	0	0	0	113.4	E218	E218-S220 VanDerWaalsContact C-N 3.28Å; E218-S220 VanDerWaalsContact CG-OG 3.22Å; E218-S220 WeakPolarHBondContact CG-OG 3.48Å; E218-S220 PolarHBondContact O-N 2.97Å; E218-S220 PolarHBondContact OE1-N 3.43Å; E218-S220 PolarHBondContact OE1-OG 2.93Å
221	S	93	Very high	88.8	Confident	39 Å²	39	75.6 Å²	75.6	27%	0.273	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-88.9	-8.6	179.1	76.4	0	0	0	0	114.1	R216 E218 P219	R216-S221 WeakPolarHBondContact CB-OG 3.33Å; R216-S221 VanDerWaalsContact CD-O 3.32Å; R216-S221 WeakPolarHBondContact CD-O 3.37Å; R216-S221 VanDerWaalsContact CD-OG 3.22Å; R216-S221 WeakPolarHBondContact CD-OG 3.48Å; R216-S221 PolarHBondContact NH1-O 2.95Å; E218-S221 WeakPolarHBondContact O-CB 3.5Å; E218-S221 PolarHBondContact O-N 2.9Å; E218-S221 PolarHBondContact O-OG 3.11Å; P219-S221 PolarHBondContact O-N 3.42Å
222	R	92.5	Very high	88.8	Confident	29 Å²	29	78.1 Å²	78.1	11%	0.109	39%	0.391	C	S	.	.	S	Bend	trans	-77	145.2	179.5	-59.6	177.2	-170.5	162.4	9.1	110.1	C214 R216 S217 P219	C214-R222 VanDerWaalsContact O-CD 3.26Å; C214-R222 WeakPolarHBondContact O-CD 3.38Å; C214-R222 WeakPolarHBondContact O-CG 3.42Å; R216-R222 HydrophobicContact CB-CG 4.22Å; R216-R222 PolarHBondContact O-NE 2.99Å; R216-R222 PolarHBondContact O-NH2 3.14Å; R216-R222 VanDerWaalsContact O-NH2 3.13Å; S217-R222 PolarHBondContact O-NH2 2.91Å; S217-R222 VanDerWaalsContact O-NH2 3.09Å; P219-R222 WeakPolarHBondContact O-CB 3.27Å; P219-R222 PolarHBondContact O-N 2.99Å
223	P	90.8	Very high	88.8	Confident	21 Å²	21	77.8 Å²	77.8	14%	0.136	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-65.1	142.9	175.8	28.3	-33.8	0	0	0	110.6	A213 K227 I228	A213-P223 HydrophobicContact CB-CG 4.23Å; A213-P223 VanDerWaalsContact O-CD 3.26Å; A213-P223 WeakPolarHBondContact O-CD 3.33Å; P223-K227 HydrophobicContact CB-CB 4.02Å; P223-I228 HydrophobicContact CB-CG1 3.95Å; P223-I228 HydrophobicContact CG-CD1 4.1Å; P223-I228 HydrophobicContact CG-CG1 3.74Å
224	S	89.9	Confident	88.6	Confident	63 Å²	63	79.1 Å²	79.1	44%	0.441	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-68	158.7	169.4	65.8	0	0	0	0	110.4	R226 K227 I228	S224-R226 PolarHBondContact O-N 3.47Å; S224-K227 WeakPolarHBondContact O-CB 3.43Å; S224-K227 PolarHBondContact O-N 2.91Å; S224-K227 PolarHBondContact OG-N 3.47Å; S224-I228 WeakPolarHBondContact O-CG1 3.42Å; S224-I228 PolarHBondContact O-N 3.04Å
225	F	85.7	Confident	88.3	Confident	154 Å²	154	80.5 Å²	80.5	68%	0.675	41%	0.408	S	S	*	.	H	α-helix	trans	-53.7	-38.3	175.6	-174.6	-96.7	0	0	0	112.2	K227 I228 F229	F225-K227 PolarHBondContact O-N 3.06Å; F225-I228 PolarHBondContact O-N 2.92Å; F225-F229 WeakPolarHBondContact O-CB 3.47Å; F225-F229 PolarHBondContact O-N 2.89Å
226	R	87.4	Confident	87.9	Confident	206 Å²	206	81.9 Å²	81.9	78%	0.777	42%	0.42	S	S	*	.	H	α-helix	trans	-58.7	-43.2	174.4	-173.2	176.8	179.9	-175.8	0.3	112.5	S224 V230	S224-R226 PolarHBondContact O-N 3.47Å; R226-V230 VanDerWaalsContact O-CG2 3.3Å; R226-V230 WeakPolarHBondContact O-CG2 3.43Å; R226-V230 PolarHBondContact O-N 3.37Å
227	K	89.6	Confident	87.7	Confident	130 Å²	130	81.7 Å²	81.7	57%	0.565	43%	0.425	S	S	*	.	H	α-helix	trans	-66.6	-44.1	176.2	-73.9	-176.9	177.2	-177.3	0	111.4	P223 S224 F225 F229 V230 H231	P223-K227 HydrophobicContact CB-CB 4.02Å; S224-K227 WeakPolarHBondContact O-CB 3.43Å; S224-K227 PolarHBondContact O-N 2.91Å; S224-K227 PolarHBondContact OG-N 3.47Å; F225-K227 PolarHBondContact O-N 3.06Å; K227-F229 VanDerWaalsContact C-N 3.33Å; K227-F229 PolarHBondContact O-N 2.83Å; K227-V230 PolarHBondContact O-N 3.24Å; K227-H231 PolarHBondContact O-CD2 2.92Å; K227-H231 PolarHBondContact O-N 2.87Å
228	I	88.4	Confident	87.2	Confident	12 Å²	12	81 Å²	81	6%	0.062	41%	0.412	C	S	.	.	H	α-helix	trans	-58	-48.1	176.2	-63.1	171	0	0	0	110	V150 L210 P223 S224 F225 V230 H231 L232	V150-I228 HydrophobicContact CG1-CD1 4.34Å; L210-I228 HydrophobicContact CD1-CG1 4.36Å; L210-I228 HydrophobicContact CD2-CG2 4.28Å; P223-I228 HydrophobicContact CB-CG1 3.95Å; P223-I228 HydrophobicContact CG-CD1 4.1Å; P223-I228 HydrophobicContact CG-CG1 3.74Å; S224-I228 WeakPolarHBondContact O-CG1 3.42Å; S224-I228 PolarHBondContact O-N 3.04Å; F225-I228 PolarHBondContact O-N 2.92Å; I228-V230 PolarHBondContact O-N 3.2Å; I228-H231 PolarHBondContact O-N 2.86Å; I228-L232 HydrophobicContact CG2-CD1 3.85Å; I228-L232 HydrophobicContact CG2-CG 4.3Å; I228-L232 WeakPolarHBondContact O-CG 3.44Å; I228-L232 PolarHBondContact O-N 3.37Å
229	F	86.7	Confident	86.4	Confident	122 Å²	122	80.1 Å²	80.1	54%	0.535	41%	0.405	S	S	.	.	H	α-helix	trans	-57.9	-49.6	179	-177.3	-94.8	0	0	0	111.6	F225 K227 H231 L232 S233	F225-F229 WeakPolarHBondContact O-CB 3.47Å; F225-F229 PolarHBondContact O-N 2.89Å; K227-F229 VanDerWaalsContact C-N 3.33Å; K227-F229 PolarHBondContact O-N 2.83Å; F229-H231 VanDerWaalsContact C-N 3.33Å; F229-H231 PolarHBondContact O-N 3.37Å; F229-L232 PolarHBondContact O-N 3.3Å; F229-S233 WeakPolarHBondContact O-CB 3.08Å; F229-S233 PolarHBondContact O-N 2.64Å; F229-S233 PolarHBondContact O-OG 3.38Å; F229-S233 VanDerWaalsContact O-OG 3.12Å
230	V	88.4	Confident	86	Confident	77 Å²	77	82.4 Å²	82.4	47%	0.467	42%	0.422	S	S	.	.	H	α-helix	trans	-56.7	-46.2	176.6	170.8	0	0	0	0	111.4	R226 K227 I228 L232 S233 S234	R226-V230 VanDerWaalsContact O-CG2 3.3Å; R226-V230 WeakPolarHBondContact O-CG2 3.43Å; R226-V230 PolarHBondContact O-N 3.37Å; K227-V230 PolarHBondContact O-N 3.24Å; I228-V230 PolarHBondContact O-N 3.2Å; V230-L232 PolarHBondContact O-N 2.93Å; V230-S233 PolarHBondContact O-N 2.83Å; V230-S234 PolarHBondContact O-N 3.01Å; V230-S234 PolarHBondContact O-OG 3.32Å; V230-S234 VanDerWaalsContact O-OG 3.12Å
231	H	86.9	Confident	85	Confident	107 Å²	107	81.9 Å²	81.9	50%	0.495	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-41.1	178.1	-74.9	-58.8	0	0	0	113.2	L210 K227 I228 F229 L235	L210-H231 HydrophobicContact CD1-CB 4.25Å; L210-H231 HydrophobicContact CD2-CB 4.35Å; K227-H231 PolarHBondContact O-CD2 2.92Å; K227-H231 PolarHBondContact O-N 2.87Å; I228-H231 PolarHBondContact O-N 2.86Å; F229-H231 VanDerWaalsContact C-N 3.33Å; F229-H231 PolarHBondContact O-N 3.37Å; H231-L235 WeakPolarHBondContact O-CB 3.47Å; H231-L235 PolarHBondContact O-N 2.97Å
232	L	86.4	Confident	83.7	Confident	57 Å²	57	83.4 Å²	83.4	30%	0.298	42%	0.423	S	S	.	.	H	α-helix	trans	-68.3	-41.9	177.6	-69.8	176	0	0	0	111.5	L210 I228 F229 V230 L235 L236	L210-L232 HydrophobicContact CD2-CD2 3.75Å; L210-L232 HydrophobicContact CD2-CG 3.99Å; I228-L232 HydrophobicContact CG2-CD1 3.85Å; I228-L232 HydrophobicContact CG2-CG 4.3Å; I228-L232 WeakPolarHBondContact O-CG 3.44Å; I228-L232 PolarHBondContact O-N 3.37Å; F229-L232 PolarHBondContact O-N 3.3Å; V230-L232 PolarHBondContact O-N 2.93Å; L232-L235 PolarHBondContact O-N 2.86Å; L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.36Å
233	S	87.2	Confident	81.8	Confident	33 Å²	33	86.4 Å²	86.4	23%	0.231	45%	0.449	C	S	.	.	H	α-helix	trans	-59.7	-48.6	175.1	-66.1	0	0	0	0	111.5	F229 V230 L235 L236 E237	F229-S233 WeakPolarHBondContact O-CB 3.08Å; F229-S233 PolarHBondContact O-N 2.64Å; F229-S233 PolarHBondContact O-OG 3.38Å; F229-S233 VanDerWaalsContact O-OG 3.12Å; V230-S233 PolarHBondContact O-N 2.83Å; S233-L235 VanDerWaalsContact C-N 3.29Å; S233-L235 PolarHBondContact O-N 3.26Å; S233-L236 PolarHBondContact O-N 3.16Å; S233-L236 VanDerWaalsContact O-N 3.14Å; S233-E237 WeakPolarHBondContact O-CG 3.45Å; S233-E237 PolarHBondContact O-N 3.46Å
234	S	86.4	Confident	79.7	Confident	52 Å²	52	93 Å²	93	36%	0.364	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-37.1	177	-58.8	0	0	0	0	112.5	V230 E237 L238	V230-S234 PolarHBondContact O-N 3.01Å; V230-S234 PolarHBondContact O-OG 3.32Å; V230-S234 VanDerWaalsContact O-OG 3.12Å; S234-E237 PolarHBondContact O-N 3.23Å; S234-L238 VanDerWaalsContact O-CG 3.25Å; S234-L238 WeakPolarHBondContact O-CG 3.33Å; S234-L238 PolarHBondContact O-N 3.48Å
235	L	82.9	Confident	77.4	Confident	30 Å²	30	95.2 Å²	95.2	16%	0.157	49%	0.491	C	S	.	.	H	α-helix	trans	-65	-42.7	175.1	179.3	147.1	0	0	0	111.2	H231 L232 S233 L238 Y239	H231-L235 WeakPolarHBondContact O-CB 3.47Å; H231-L235 PolarHBondContact O-N 2.97Å; L232-L235 PolarHBondContact O-N 2.86Å; S233-L235 VanDerWaalsContact C-N 3.29Å; S233-L235 PolarHBondContact O-N 3.26Å; L235-L238 PolarHBondContact O-N 3.02Å; L235-Y239 HydrophobicContact CD2-CD2 3.65Å; L235-Y239 HydrophobicContact CD2-CE2 3.58Å; L235-Y239 HydrophobicContact CG-CD2 4.09Å; L235-Y239 HydrophobicContact CG-CE2 3.97Å; L235-Y239 WeakPolarHBondContact O-CD2 3.34Å; L235-Y239 PolarHBondContact O-N 2.88Å; L235-Y239 VanDerWaalsContact O-N 3.08Å
236	L	82.2	Confident	75.3	Confident	106 Å²	106	95.2 Å²	95.2	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-64.7	-42	175.6	-71.1	167.4	0	0	0	112	L232 S233 L238 Y239 S240	L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.36Å; S233-L236 PolarHBondContact O-N 3.16Å; S233-L236 VanDerWaalsContact O-N 3.14Å; L236-L238 PolarHBondContact O-N 2.77Å; L236-Y239 WeakPolarHBondContact O-CB 2.87Å; L236-Y239 PolarHBondContact O-N 3.04Å; L236-S240 PolarHBondContact O-N 2.97Å; L236-S240 PolarHBondContact O-OG 2.76Å; L236-S240 VanDerWaalsContact O-OG 3.09Å
237	E	83.3	Confident	72.7	Confident	131 Å²	131	91.6 Å²	91.6	61%	0.612	49%	0.487	S	S	*	.	H	α-helix	trans	-60.2	-44.7	175.4	-74.7	169.5	-175.1	0	0	111.8	S233 S234 Y239 S240 S241	S233-E237 WeakPolarHBondContact O-CG 3.45Å; S233-E237 PolarHBondContact O-N 3.46Å; S234-E237 PolarHBondContact O-N 3.23Å; E237-Y239 VanDerWaalsContact C-N 3.29Å; E237-Y239 PolarHBondContact O-N 2.88Å; E237-S240 PolarHBondContact O-N 2.89Å; E237-S241 PolarHBondContact O-N 3.34Å
238	L	77.8	Confident	70.1	Confident	91 Å²	91	92.3 Å²	92.3	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-57.7	-44.1	174.1	-74.1	167.9	0	0	0	111	S234 L235 L236 S241 L242	S234-L238 VanDerWaalsContact O-CG 3.25Å; S234-L238 WeakPolarHBondContact O-CG 3.33Å; S234-L238 PolarHBondContact O-N 3.48Å; L235-L238 PolarHBondContact O-N 3.02Å; L236-L238 PolarHBondContact O-N 2.77Å; L238-S241 PolarHBondContact O-N 3.13Å; L238-S241 PolarHBondContact O-OG 2.93Å; L238-L242 WeakPolarHBondContact O-CD1 3.41Å; L238-L242 VanDerWaalsContact O-CG 3.28Å; L238-L242 WeakPolarHBondContact O-CG 3.38Å; L238-L242 PolarHBondContact O-N 3.28Å
239	Y	72.1	Confident	67.5	Low	83 Å²	83	100.5 Å²	100.5	33%	0.325	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-42.1	177.3	-87.6	-66	0	0	0	113.8	S203 L235 L236 E237 S241 L242	S203-Y239 WeakPolarHBondContact CB-OH 3.26Å; S203-Y239 VanDerWaalsContact OG-CE2 3.26Å; S203-Y239 WeakPolarHBondContact OG-CE2 3.32Å; S203-Y239 PolarHBondContact OG-OH 2.8Å; L235-Y239 HydrophobicContact CD2-CD2 3.65Å; L235-Y239 HydrophobicContact CD2-CE2 3.58Å; L235-Y239 HydrophobicContact CG-CD2 4.09Å; L235-Y239 HydrophobicContact CG-CE2 3.97Å; L235-Y239 WeakPolarHBondContact O-CD2 3.34Å; L235-Y239 PolarHBondContact O-N 2.88Å; L235-Y239 VanDerWaalsContact O-N 3.08Å; L236-Y239 WeakPolarHBondContact O-CB 2.87Å; L236-Y239 PolarHBondContact O-N 3.04Å; E237-Y239 VanDerWaalsContact C-N 3.29Å; E237-Y239 PolarHBondContact O-N 2.88Å; Y239-S241 VanDerWaalsContact C-N 3.28Å; Y239-S241 PolarHBondContact O-N 2.83Å; Y239-L242 PolarHBondContact O-N 3.22Å
240	S	75.6	Confident	65	Low	85 Å²	85	104.7 Å²	104.7	59%	0.594	54%	0.54	S	S	*	.	H	α-helix	trans	-64.9	-33.8	176.5	-61.6	0	0	0	0	111.7	L236 E237 L242 S243	L236-S240 PolarHBondContact O-N 2.97Å; L236-S240 PolarHBondContact O-OG 2.76Å; L236-S240 VanDerWaalsContact O-OG 3.09Å; E237-S240 PolarHBondContact O-N 2.89Å; S240-L242 VanDerWaalsContact C-N 3.27Å; S240-L242 PolarHBondContact O-N 2.81Å; S240-S243 PolarHBondContact O-OG 3.44Å
241	S	72.6	Confident	62.3	Low	92 Å²	92	106.8 Å²	106.8	64%	0.643	56%	0.559	S	S	*	*	H	α-helix	trans	-70.8	-22.8	175.5	74.7	0	0	0	0	113.6	E237 L238 Y239	E237-S241 PolarHBondContact O-N 3.34Å; L238-S241 PolarHBondContact O-N 3.13Å; L238-S241 PolarHBondContact O-OG 2.93Å; Y239-S241 VanDerWaalsContact C-N 3.28Å; Y239-S241 PolarHBondContact O-N 2.83Å
242	L	65.7	Low	59.8	Low	70 Å²	70	110.5 Å²	110.5	37%	0.366	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	-4.1	-177.4	-73.7	164.1	0	0	0	113.3	C199 L238 Y239 S240 Q244 F246	C199-L242 HydrophobicContact CB-CD1 4.25Å; L238-L242 WeakPolarHBondContact O-CD1 3.41Å; L238-L242 VanDerWaalsContact O-CG 3.28Å; L238-L242 WeakPolarHBondContact O-CG 3.38Å; L238-L242 PolarHBondContact O-N 3.28Å; Y239-L242 PolarHBondContact O-N 3.22Å; S240-L242 VanDerWaalsContact C-N 3.27Å; S240-L242 PolarHBondContact O-N 2.81Å; L242-Q244 PolarHBondContact O-N 3.04Å; L242-F246 VanDerWaalsContact O-CE2 3.22Å; L242-F246 WeakPolarHBondContact O-CE2 3.34Å
243	S	51.6	Low	57.3	Low	92 Å²	92	113.7 Å²	113.7	64%	0.643	60%	0.595	S	S	*	*			trans	-77.1	66.1	-179.9	68.7	0	0	0	0	112.3	S240	S240-S243 PolarHBondContact O-OG 3.44Å
244	Q	46.9	Very low	54.6	Low	160 Å²	160	119.7 Å²	119.7	75%	0.748	62%	0.624	S	S	*	*	S	Bend	trans	-73.2	150.4	137.5	-78.4	-169.1	-13.6	0	0	107.6	L242 F246	L242-Q244 PolarHBondContact O-N 3.04Å; Q244-F246 WeakPolarHBondContact O-CD2 3.37Å; Q244-F246 PolarHBondContact O-N 2.71Å
245	P	42.2	Very low	52	Low	110 Å²	110	123.2 Å²	123.2	71%	0.714	65%	0.645	S	S	*	*			trans	-64.3	105.8	-177.2	26.9	-31.7	0	0	0	108	D247	P245-D247 PolarHBondContact O-N 3.23Å
246	F	41.9	Very low	49.5	Very low	154 Å²	154	129.6 Å²	129.6	68%	0.675	68%	0.678	S	S	*	*			trans	-74	61.9	159	-59.1	-77.8	0	0	0	107.7	L242 Q244	L242-F246 VanDerWaalsContact O-CE2 3.22Å; L242-F246 WeakPolarHBondContact O-CE2 3.34Å; Q244-F246 WeakPolarHBondContact O-CD2 3.37Å; Q244-F246 PolarHBondContact O-N 2.71Å
247	D	33.1	Very low	47	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	69%	0.69	S	S	*	*			trans	-71.7	141.2	154.1	-89.9	-40.2	0	0	0	106.8	P245	P245-D247 PolarHBondContact O-N 3.23Å
248	I	34.4	Very low	44.5	Very low	146 Å²	146	130.7 Å²	130.7	75%	0.749	69%	0.691	S	S	*	*	S	Bend	trans	84.9	121.3	172.5	-37.5	158.6	0	0	0	114.4
249	Y	33.3	Very low	42.2	Very low	184 Å²	184	135 Å²	135	72%	0.722	71%	0.706	S	S	*	*			trans	116	31.8	161.8	-75.5	-82.3	0	0	0	122.1
250	Y	33.7	Very low	40.2	Very low	209 Å²	209	136.9 Å²	136.9	82%	0.82	73%	0.726	S	S	*	*	S	Bend	trans	-125.4	26.5	161.1	-84.1	-80	0	0	0	116.1
251	S	33.1	Very low	38.2	Very low	122 Å²	122	138.9 Å²	138.9	85%	0.853	73%	0.734	S	S	*	*	S	Bend	trans	-101.9	13.2	172.1	-157.8	0	0	0	0	114.5
252	K	34.1	Very low	36.3	Very low	184 Å²	184	142.1 Å²	142.1	80%	0.8	74%	0.741	S	S	*	*	S	Bend	trans	-133.3	8.9	-172.6	-74.1	-165.8	176.7	-176.8	0	117.7
253	V	33.7	Very low	34.9	Very low	124 Å²	124	147.9 Å²	147.9	75%	0.752	77%	0.766	S	S	*	*	S	Bend	trans	-139.5	52.2	-177	-153.3	0	0	0	0	113.2
254	L	30.5	Very low	34.7	Very low	160 Å²	160	153.2 Å²	153.2	84%	0.838	80%	0.795	S	S	*	*	S	Bend	trans	-139	127.3	151.3	-74.8	175.9	0	0	0	106.9	L256	L254-L256 PolarHBondContact O-N 2.92Å; L254-L256 VanDerWaalsContact O-N 3.07Å
255	P	32.2	Very low	34.1	Very low	126 Å²	126	152.9 Å²	152.9	82%	0.818	80%	0.797	S	S	*	*			trans	-63.6	115.2	170.8	16.6	-13.7	0	0	0	107.9	Q257	P255-Q257 PolarHBondContact O-N 3.5Å
256	L	30.3	Very low	33.7	Very low	163 Å²	163	155.1 Å²	155.1	85%	0.853	80%	0.802	S	S	*	*			trans	-51.3	103.1	161.9	-85.8	147.4	0	0	0	108.1	L254 S258	L254-L256 PolarHBondContact O-N 2.92Å; L254-L256 VanDerWaalsContact O-N 3.07Å; L256-S258 VanDerWaalsContact C-N 3.27Å; L256-S258 PolarHBondContact O-N 3.18Å
257	Q	30	Very low	33.3	Very low	170 Å²	170	155.2 Å²	155.2	79%	0.794	81%	0.809	S	S	*	*			trans	-77.9	92	148.2	-82.5	-172.4	-31.6	0	0	106.2	P255	P255-Q257 PolarHBondContact O-N 3.5Å
258	S	31	Very low	33.3	Very low	91 Å²	91	156.7 Å²	156.7	64%	0.636	82%	0.816	S	S	*	*			trans	-68.4	122.8	169	49.5	0	0	0	0	109.5	L256	L256-S258 VanDerWaalsContact C-N 3.27Å; L256-S258 PolarHBondContact O-N 3.18Å
259	F	29.2	Very low	33.2	Very low	182 Å²	182	157.4 Å²	157.4	80%	0.798	82%	0.82	S	S	*	*			trans	-90.9	117.9	158.3	-62.4	-82.5	0	0	0	107.4
260	V	29.5	Very low	33.2	Very low	121 Å²	121	155.6 Å²	155.6	73%	0.733	83%	0.827	S	S	*	*			trans	-79.8	113.8	165.9	175.6	0	0	0	0	106.3	M262	V260-M262 HydrophobicContact CG1-CG 3.89Å
261	V	33.9	Very low	33.2	Very low	127 Å²	127	151.8 Å²	151.8	77%	0.77	83%	0.827	S	S	*	*			trans	-95.8	111.1	161.3	178.8	0	0	0	0	105.6
262	M	31.4	Very low	33.2	Very low	161 Å²	161	154.1 Å²	154.1	79%	0.793	83%	0.825	S	S	*	*			trans	-81.4	117.5	165.3	-64	-141.7	-59.3	0	0	107.4	V260	V260-M262 HydrophobicContact CG1-CG 3.89Å
263	E	36.9	Very low	33.1	Very low	190 Å²	190	151.6 Å²	151.6	89%	0.888	83%	0.827	S	S	*	*			trans	-74.8	124.2	159.7	-79	-180	156.3	0	0	108
264	T	48.7	Very low	33	Very low	204 Å²	204	154.1 Å²	154.1	100%	1.252	83%	0.834	S	S	*	*			trans	-112.1	0	151.7	48.8	0	0	0	0	107.5

Retrieved 264 of 264 residues in 132.1 ms (Link to these results)

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