A0A093I8S5_STRCA Loading...

Ectoderm-neural cortex protein 1

AlphaFold DB , UniProt , Accession A0A093I8S5, Species STRCA (Struthio camelus australis), Gene n/a, Length 589 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32	Very low	38.3	Very low	240 Å²	240	162.8 Å²	162.8	100%	1.182	84%	0.841	S	S	*	*				0	127.2	0	-69.8	-178.6	-158.4	0	0	109.1	V3	M1-V3 PolarHBondContact O-N 2.59Å
2	S	34.2	Very low	39.2	Very low	111 Å²	111	170.3 Å²	170.3	78%	0.776	85%	0.85	S	S	*	*			trans	-68.4	104.7	177.5	48.4	0	0	0	0	110.8	S4	S2-S4 VanDerWaalsContact C-N 3.25Å; S2-S4 PolarHBondContact O-N 2.91Å
3	V	32.3	Very low	39.6	Very low	135 Å²	135	164.4 Å²	164.4	82%	0.818	84%	0.844	S	S	*	*			trans	-82.7	78.4	168.9	-172.3	0	0	0	0	108.1	M1	M1-V3 PolarHBondContact O-N 2.59Å
4	S	37.8	Very low	40.1	Very low	102 Å²	102	160.4 Å²	160.4	71%	0.713	84%	0.838	S	S	*	*			trans	-97.6	71.4	164.6	61	0	0	0	0	108.7	S2	S2-S4 VanDerWaalsContact C-N 3.25Å; S2-S4 PolarHBondContact O-N 2.91Å
5	M	41.5	Very low	40.9	Very low	162 Å²	162	159.5 Å²	159.5	80%	0.798	84%	0.842	S	S	*	*			trans	-140.3	81.7	174	-81.8	-80.7	176.2	0	0	108.7
6	H	40.8	Very low	41.5	Very low	184 Å²	184	153.4 Å²	153.4	85%	0.852	83%	0.829	S	S	*	*			trans	-136.7	90.8	151.5	-111.5	43.7	0	0	0	110.1
7	E	35.9	Very low	42.5	Very low	159 Å²	159	151.8 Å²	151.8	74%	0.743	83%	0.833	S	S	*	*			trans	26.7	98.6	143.2	-65.4	-171.6	137.8	0	0	118.7	R9	E7-R9 VanDerWaalsContact C-N 3.34Å; E7-R9 PolarHBondContact O-N 3.03Å; E7-R9 VanDerWaalsContact O-N 3.08Å
8	N	38.8	Very low	43.6	Very low	161 Å²	161	151.2 Å²	151.2	86%	0.861	83%	0.826	S	S	*	*			trans	-72.7	86.1	153.4	-106.2	-32	0	0	0	109.7	K10	N8-K10 PolarHBondContact O-N 3.1Å
9	R	38	Very low	44.9	Very low	226 Å²	226	152 Å²	152	85%	0.853	83%	0.83	S	S	*	*			trans	-90	87.4	167.1	-136.9	176.8	-173	178.8	3.1	109.3	E7	E7-R9 VanDerWaalsContact C-N 3.34Å; E7-R9 PolarHBondContact O-N 3.03Å; E7-R9 VanDerWaalsContact O-N 3.08Å
10	K	50.7	Low	46.6	Very low	198 Å²	198	151.8 Å²	151.8	86%	0.861	83%	0.826	S	S	*	*			trans	-88.4	111.8	165.9	-88.7	-175.8	177.5	175.2	0	109.7	N8	N8-K10 PolarHBondContact O-N 3.1Å
11	S	39	Very low	48.3	Very low	113 Å²	113	153.8 Å²	153.8	79%	0.79	82%	0.823	S	S	*	*			trans	-138.9	125.2	151.5	57.3	0	0	0	0	110.4
12	R	49.7	Very low	50.7	Low	253 Å²	253	149.8 Å²	149.8	96%	0.955	81%	0.806	S	S	*	*			trans	-60.6	142.9	-168.9	-70.4	164.5	155.5	167.9	-8	114.9
13	A	44.8	Very low	53.3	Low	93 Å²	93	151.6 Å²	151.6	77%	0.769	80%	0.8	S	S	*	*				-179.9	155	112.3	0	0	0	0	0	112.2
14	S	45.5	Very low	55.9	Low	109 Å²	109	152.4 Å²	152.4	76%	0.762	80%	0.795	S	S	*	*			trans	74.1	95.9	170.9	67.2	0	0	0	0	120.5
15	T	52.3	Low	58.3	Low	146 Å²	146	152.9 Å²	152.9	90%	0.896	78%	0.784	S	S	*	*			trans	25.9	106	133.4	49.3	0	0	0	0	119.4
16	G	50.9	Low	60.4	Low	62 Å²	62	149.9 Å²	149.9	64%	0.639	78%	0.779	S	S	*	*			trans	155.7	95.2	168.3	0	0	0	0	0	106.8	I18	G16-I18 PolarHBondContact O-N 3.2Å
17	S	57.6	Low	62.7	Low	127 Å²	127	144 Å²	144	89%	0.888	76%	0.758	S	S	*	*			trans	-68.9	82.1	178	-59.2	0	0	0	0	109.1	N19	S17-N19 PolarHBondContact O-N 3.13Å; S17-N19 VanDerWaalsContact O-N 3.12Å
18	I	63.1	Low	65.2	Low	140 Å²	140	143.7 Å²	143.7	72%	0.718	75%	0.751	S	S	*	*			trans	-69.2	108.8	170.8	-56.5	172.7	0	0	0	105.4	G16 I20	G16-I18 PolarHBondContact O-N 3.2Å; I18-I20 VanDerWaalsContact C-N 3.25Å; I18-I20 HydrophobicContact CB-CD1 4.5Å; I18-I20 HydrophobicContact CB-CG1 4.11Å; I18-I20 HydrophobicContact CG2-CD1 4.2Å; I18-I20 HydrophobicContact CG2-CG1 3.54Å; I18-I20 PolarHBondContact O-N 3.27Å
19	N	68.1	Low	67.5	Low	167 Å²	167	138.8 Å²	138.8	89%	0.893	73%	0.733	S	S	*	*			trans	-66.7	88.1	169.9	-104.8	-17	0	0	0	108	S17	S17-N19 PolarHBondContact O-N 3.13Å; S17-N19 VanDerWaalsContact O-N 3.12Å
20	I	78.7	Confident	69.8	Low	148 Å²	148	132.4 Å²	132.4	76%	0.759	72%	0.716	S	S	*	*			trans	-87.2	110.3	176.1	-56.8	174.5	0	0	0	107.5	I18	I18-I20 VanDerWaalsContact C-N 3.25Å; I18-I20 HydrophobicContact CB-CD1 4.5Å; I18-I20 HydrophobicContact CB-CG1 4.11Å; I18-I20 HydrophobicContact CG2-CD1 4.2Å; I18-I20 HydrophobicContact CG2-CG1 3.54Å; I18-I20 PolarHBondContact O-N 3.27Å
21	Y	83.3	Confident	71.6	Confident	193 Å²	193	126.4 Å²	126.4	76%	0.757	70%	0.699	S	S	*	*			trans	-106.8	120.7	170.7	176	-100.6	0	0	0	109.5	F23	Y21-F23 HydrophobicContact CD1-CB 4.32Å; Y21-F23 HydrophobicContact CE1-CB 3.87Å; Y21-F23 HydrophobicContact CE1-CD2 4.23Å
22	L	82.1	Confident	74	Confident	156 Å²	156	123.6 Å²	123.6	82%	0.817	68%	0.677	S	S	*	*			trans	-88.7	109	174.9	-175.4	73.2	0	0	0	109.3
23	F	88.7	Confident	76	Confident	150 Å²	150	114 Å²	114	66%	0.658	64%	0.644	S	S	*	*			trans	-86	121.2	172.6	178.1	-102.7	0	0	0	110.3	Y21 K25	Y21-F23 HydrophobicContact CD1-CB 4.32Å; Y21-F23 HydrophobicContact CE1-CB 3.87Å; Y21-F23 HydrophobicContact CE1-CD2 4.23Å; F23-K25 HydrophobicContact CE1-CB 3.94Å; F23-K25 HydrophobicContact CZ-CB 4.07Å
24	H	86.3	Confident	78.1	Confident	152 Å²	152	114.1 Å²	114.1	70%	0.704	64%	0.636	S	S	*	*			trans	-126.1	110.4	176.7	179	-76.2	0	0	0	110.3
25	K	89.4	Confident	80.3	Confident	111 Å²	111	114.1 Å²	114.1	48%	0.483	62%	0.623	S	S	.	*			trans	-94.5	105.8	174	-176.6	179.8	179.2	-176.2	0	109.8	F23 S27 Y28	F23-K25 HydrophobicContact CE1-CB 3.94Å; F23-K25 HydrophobicContact CZ-CB 4.07Å; K25-S27 VanDerWaalsContact C-N 3.32Å; K25-S27 WeakPolarHBondContact CE-OG 3.28Å; K25-S27 PolarHBondContact O-N 3.27Å; K25-Y28 WeakPolarHBondContact O-CB 3.43Å; K25-Y28 PolarHBondContact O-N 3.5Å
26	S	84.9	Confident	82.2	Confident	100 Å²	100	109.4 Å²	109.4	70%	0.699	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-33.4	-176.8	49.5	0	0	0	0	114.4	Y28	S26-Y28 VanDerWaalsContact C-N 3.3Å; S26-Y28 PolarHBondContact O-N 2.79Å
27	S	88.4	Confident	84.1	Confident	59 Å²	59	107.8 Å²	107.8	41%	0.413	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	0.4	-179.7	59	0	0	0	0	114.9	K25 S31	K25-S27 VanDerWaalsContact C-N 3.32Å; K25-S27 WeakPolarHBondContact CE-OG 3.28Å; K25-S27 PolarHBondContact O-N 3.27Å; S27-S31 WeakPolarHBondContact O-CB 3.21Å; S27-S31 PolarHBondContact O-N 2.93Å; S27-S31 VanDerWaalsContact O-N 3.16Å
28	Y	89.3	Confident	85.7	Confident	153 Å²	153	105.4 Å²	105.4	60%	0.6	55%	0.546	S	S	*	.	H	α-helix	trans	-65.7	-42.8	-178.2	-177.4	-108.5	0	0	0	111.9	K25 S26 S31 V32	K25-Y28 WeakPolarHBondContact O-CB 3.43Å; K25-Y28 PolarHBondContact O-N 3.5Å; S26-Y28 VanDerWaalsContact C-N 3.3Å; S26-Y28 PolarHBondContact O-N 2.79Å; Y28-S31 PolarHBondContact O-N 2.89Å; Y28-V32 HydrophobicContact CD1-CG2 4.23Å; Y28-V32 HydrophobicContact CD2-CG2 4.4Å; Y28-V32 HydrophobicContact CE1-CG2 3.83Å; Y28-V32 HydrophobicContact CE2-CG2 4.01Å; Y28-V32 WeakPolarHBondContact O-CG2 3.48Å; Y28-V32 PolarHBondContact O-N 2.9Å
29	A	86.3	Confident	87.1	Confident	58 Å²	58	100 Å²	100	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-59.8	-48.6	179.2	0	0	0	0	0	112.1	S31 V32 L33	A29-S31 VanDerWaalsContact C-N 3.31Å; A29-S31 PolarHBondContact O-N 3.44Å; A29-V32 PolarHBondContact O-N 2.91Å; A29-V32 VanDerWaalsContact O-N 3.17Å; A29-L33 PolarHBondContact O-N 3.43Å
30	D	86.9	Confident	88.2	Confident	93 Å²	93	93 Å²	93	50%	0.497	48%	0.479	S	S	.	.	H	α-helix	trans	-60.5	-41.1	177.4	-62.2	-15.4	0	0	0	111.9	V32 L33 T34	D30-V32 VanDerWaalsContact C-N 3.33Å; D30-V32 PolarHBondContact O-N 3.4Å; D30-L33 PolarHBondContact O-N 2.91Å; D30-T34 WeakPolarHBondContact O-CB 3.41Å; D30-T34 PolarHBondContact O-N 2.96Å; D30-T34 PolarHBondContact O-OG1 2.63Å
31	S	88.2	Confident	88.7	Confident	71 Å²	71	92 Å²	92	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-65.1	-37.6	178	-175	0	0	0	0	111.9	S27 Y28 A29 H35	S27-S31 WeakPolarHBondContact O-CB 3.21Å; S27-S31 PolarHBondContact O-N 2.93Å; S27-S31 VanDerWaalsContact O-N 3.16Å; Y28-S31 PolarHBondContact O-N 2.89Å; A29-S31 VanDerWaalsContact C-N 3.31Å; A29-S31 PolarHBondContact O-N 3.44Å; S31-H35 WeakPolarHBondContact O-CB 3.14Å; S31-H35 PolarHBondContact O-N 3.35Å; S31-H35 VanDerWaalsContact O-N 3.11Å
32	V	90.6	Very high	89.1	Confident	55 Å²	55	88 Å²	88	33%	0.333	46%	0.46	S	S	.	.	H	α-helix	trans	-68.8	-47.6	177.4	170.5	0	0	0	0	110.5	Y28 A29 D30 T34 H35 L36	Y28-V32 HydrophobicContact CD1-CG2 4.23Å; Y28-V32 HydrophobicContact CD2-CG2 4.4Å; Y28-V32 HydrophobicContact CE1-CG2 3.83Å; Y28-V32 HydrophobicContact CE2-CG2 4.01Å; Y28-V32 WeakPolarHBondContact O-CG2 3.48Å; Y28-V32 PolarHBondContact O-N 2.9Å; A29-V32 PolarHBondContact O-N 2.91Å; A29-V32 VanDerWaalsContact O-N 3.17Å; D30-V32 VanDerWaalsContact C-N 3.33Å; D30-V32 PolarHBondContact O-N 3.4Å; V32-T34 VanDerWaalsContact C-N 3.33Å; V32-T34 PolarHBondContact O-N 3.06Å; V32-H35 PolarHBondContact O-N 2.74Å; V32-H35 VanDerWaalsContact O-N 3.14Å; V32-L36 HydrophobicContact CG1-CD1 3.99Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.48Å; V32-L36 PolarHBondContact O-N 3.35Å
33	L	90.3	Very high	89.4	Confident	51 Å²	51	89.2 Å²	89.2	27%	0.267	45%	0.453	S	S	.	.	H	α-helix	trans	-59.8	-43.5	177.3	-75.8	173.5	0	0	0	111.9	A29 D30 H35 L36 N37 Y106	A29-L33 PolarHBondContact O-N 3.43Å; D30-L33 PolarHBondContact O-N 2.91Å; L33-H35 VanDerWaalsContact C-N 3.3Å; L33-H35 PolarHBondContact O-N 2.88Å; L33-L36 PolarHBondContact O-N 2.9Å; L33-N37 PolarHBondContact O-N 3.45Å; L33-Y106 CarbonylContact C-O 3.58Å
34	T	90.1	Very high	89.3	Confident	96 Å²	96	85.8 Å²	85.8	59%	0.589	44%	0.441	S	S	*	.	H	α-helix	trans	-60	-41.2	175.4	-54.4	0	0	0	0	111.5	D30 V32 N37 L38	D30-T34 WeakPolarHBondContact O-CB 3.41Å; D30-T34 PolarHBondContact O-N 2.96Å; D30-T34 PolarHBondContact O-OG1 2.63Å; V32-T34 VanDerWaalsContact C-N 3.33Å; V32-T34 PolarHBondContact O-N 3.06Å; T34-N37 PolarHBondContact O-N 2.87Å; T34-L38 PolarHBondContact O-N 2.86Å; T34-L38 VanDerWaalsContact O-N 3.12Å
35	H	90.7	Very high	89.4	Confident	109 Å²	109	86.6 Å²	86.6	51%	0.505	44%	0.443	S	S	.	.	H	α-helix	trans	-68.9	-40.7	177.4	-167.5	67.3	0	0	0	112.2	S31 V32 L33 N37 L38 L39	S31-H35 WeakPolarHBondContact O-CB 3.14Å; S31-H35 PolarHBondContact O-N 3.35Å; S31-H35 VanDerWaalsContact O-N 3.11Å; V32-H35 PolarHBondContact O-N 2.74Å; V32-H35 VanDerWaalsContact O-N 3.14Å; L33-H35 VanDerWaalsContact C-N 3.3Å; L33-H35 PolarHBondContact O-N 2.88Å; H35-N37 VanDerWaalsContact C-N 3.28Å; H35-N37 PolarHBondContact O-N 2.65Å; H35-L38 WeakPolarHBondContact O-CB 3.35Å; H35-L38 PolarHBondContact O-N 3.34Å; H35-L38 VanDerWaalsContact O-N 3.17Å; H35-L39 WeakPolarHBondContact O-CG 3.37Å; H35-L39 PolarHBondContact O-N 3.38Å
36	L	91.8	Very high	89.4	Confident	47 Å²	47	83.3 Å²	83.3	25%	0.246	43%	0.432	C	S	.	.	H	α-helix	trans	-61.7	-36.5	174.1	-71.7	170.8	0	0	0	112	V32 L33 L39 R40 V63 Y106	V32-L36 HydrophobicContact CG1-CD1 3.99Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.48Å; V32-L36 PolarHBondContact O-N 3.35Å; L33-L36 PolarHBondContact O-N 2.9Å; L36-L39 HydrophobicContact CD2-CD1 4.43Å; L36-L39 PolarHBondContact O-N 3.15Å; L36-R40 PolarHBondContact O-N 3.16Å; L36-V63 HydrophobicContact CD1-CG2 4.1Å; L36-Y106 HydrophobicContact CB-CD1 4.04Å; L36-Y106 HydrophobicContact CB-CE1 4.12Å
37	N	91.4	Very high	89.6	Confident	27 Å²	27	82.4 Å²	82.4	14%	0.144	42%	0.42	C	S	.	.	H	α-helix	trans	-65.1	-41.1	174	-159.9	19.3	0	0	0	111.9	L33 T34 H35 L39 R40 Q41 Y106	L33-N37 PolarHBondContact O-N 3.45Å; T34-N37 PolarHBondContact O-N 2.87Å; H35-N37 VanDerWaalsContact C-N 3.28Å; H35-N37 PolarHBondContact O-N 2.65Å; N37-L39 VanDerWaalsContact C-N 3.34Å; N37-L39 PolarHBondContact O-N 3.43Å; N37-R40 WeakPolarHBondContact O-CB 3.17Å; N37-R40 PolarHBondContact O-N 3.27Å; N37-R40 PolarHBondContact OD1-NE 3.09Å; N37-R40 VanDerWaalsContact OD1-NE 3.13Å; N37-R40 PolarHBondContact OD1-NH2 3.49Å; N37-Q41 WeakPolarHBondContact O-CG 3.27Å; N37-Q41 PolarHBondContact O-N 3.25Å; N37-Y106 HydrophobicContact CB-CD1 4.36Å; N37-Y106 HydrophobicContact CB-CG 4.37Å
38	L	91.5	Very high	89.6	Confident	77 Å²	77	79.9 Å²	79.9	40%	0.403	40%	0.402	S	S	.	.	H	α-helix	trans	-61.8	-43.3	175.9	-173.5	73.2	0	0	0	111.3	T34 H35 R40 Q41 Q42	T34-L38 PolarHBondContact O-N 2.86Å; T34-L38 VanDerWaalsContact O-N 3.12Å; H35-L38 WeakPolarHBondContact O-CB 3.35Å; H35-L38 PolarHBondContact O-N 3.34Å; H35-L38 VanDerWaalsContact O-N 3.17Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 2.88Å; L38-Q41 PolarHBondContact O-N 2.82Å; L38-Q42 WeakPolarHBondContact O-CG 3.4Å; L38-Q42 PolarHBondContact O-N 2.77Å
39	L	92.3	Very high	89.7	Confident	26 Å²	26	74.7 Å²	74.7	14%	0.136	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-41.2	175.5	-68.3	172.6	0	0	0	111.6	H35 L36 N37 Q42 R43 L44 F45	H35-L39 WeakPolarHBondContact O-CG 3.37Å; H35-L39 PolarHBondContact O-N 3.38Å; L36-L39 HydrophobicContact CD2-CD1 4.43Å; L36-L39 PolarHBondContact O-N 3.15Å; N37-L39 VanDerWaalsContact C-N 3.34Å; N37-L39 PolarHBondContact O-N 3.43Å; L39-Q42 CarbonylContact O-C 3.59Å; L39-Q42 PolarHBondContact O-N 3.19Å; L39-R43 PolarHBondContact O-N 3.38Å; L39-L44 HydrophobicContact CD2-CB 4Å; L39-L44 HydrophobicContact CD2-CD1 4.04Å; L39-L44 PolarHBondContact O-N 2.95Å; L39-F45 HydrophobicContact CD1-CD2 4.37Å; L39-F45 HydrophobicContact CD2-CD2 4.32Å; L39-F45 HydrophobicContact CD2-CE2 4.44Å
40	R	91.5	Very high	89.9	Confident	20 Å²	20	72 Å²	72	8%	0.075	36%	0.362	C	S	.	.	H	α-helix	trans	-59	-48.8	174.2	-174.1	-170.8	65	117	-8	111.7	L36 N37 L38 Q42 R43 P58 D103 Y106	L36-R40 PolarHBondContact O-N 3.16Å; N37-R40 WeakPolarHBondContact O-CB 3.17Å; N37-R40 PolarHBondContact O-N 3.27Å; N37-R40 PolarHBondContact OD1-NE 3.09Å; N37-R40 VanDerWaalsContact OD1-NE 3.13Å; N37-R40 PolarHBondContact OD1-NH2 3.49Å; L38-R40 VanDerWaalsContact C-N 3.33Å; L38-R40 PolarHBondContact O-N 2.88Å; R40-Q42 PolarHBondContact O-N 2.77Å; R40-R43 PolarHBondContact O-N 3.12Å; R40-P58 WeakPolarHBondContact CG-O 3.37Å; R40-D103 IonicContact CZ-OD1 3.99Å; R40-D103 IonicContact NH1-OD1 2.65Å; R40-D103 IonicContact NH2-OD1 3.53Å; R40-D103 PolarHBondContact NH2-OD1 2.83Å; R40-Y106 HydrophobicContact CB-CE1 4.48Å; R40-Y106 VanDerWaalsContact CD-CE2 3.45Å
41	Q	89.2	Confident	90	Very high	127 Å²	127	69.6 Å²	69.6	59%	0.593	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-33.3	179.1	-71.2	175.9	-3	0	0	112.4	N37 L38 R43	N37-Q41 WeakPolarHBondContact O-CG 3.27Å; N37-Q41 PolarHBondContact O-N 3.25Å; L38-Q41 PolarHBondContact O-N 2.82Å; Q41-R43 VanDerWaalsContact C-N 3.32Å
42	Q	90.9	Very high	89.9	Confident	110 Å²	110	66.2 Å²	66.2	51%	0.514	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-2.9	175.2	-66.6	178.8	-1.8	0	0	113.9	L38 L39 R40 L44	L38-Q42 WeakPolarHBondContact O-CG 3.4Å; L38-Q42 PolarHBondContact O-N 2.77Å; L39-Q42 CarbonylContact O-C 3.59Å; L39-Q42 PolarHBondContact O-N 3.19Å; R40-Q42 PolarHBondContact O-N 2.77Å; Q42-L44 VanDerWaalsContact C-N 3.25Å; Q42-L44 HydrophobicContact CB-CD1 3.96Å; Q42-L44 HydrophobicContact CB-CG 4.01Å; Q42-L44 PolarHBondContact O-N 3.44Å
43	R	89.3	Confident	89.6	Confident	182 Å²	182	65.3 Å²	65.3	69%	0.687	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	34.3	-175.6	-49.6	-176	-179.1	-176.9	-2.2	113.4	L39 R40 Q41 P58	L39-R43 PolarHBondContact O-N 3.38Å; R40-R43 PolarHBondContact O-N 3.12Å; Q41-R43 VanDerWaalsContact C-N 3.32Å; R43-P58 HydrophobicContact CG-CG 3.97Å
44	L	86.4	Confident	89.2	Confident	77 Å²	77	71.1 Å²	71.1	40%	0.403	36%	0.357	S	S	.	.			trans	-96.7	131.5	177.3	-66.8	173.3	0	0	0	109.6	L39 Q42 T46 H60	L39-L44 HydrophobicContact CD2-CB 4Å; L39-L44 HydrophobicContact CD2-CD1 4.04Å; L39-L44 PolarHBondContact O-N 2.95Å; Q42-L44 VanDerWaalsContact C-N 3.25Å; Q42-L44 HydrophobicContact CB-CD1 3.96Å; Q42-L44 HydrophobicContact CB-CG 4.01Å; Q42-L44 PolarHBondContact O-N 3.44Å; L44-T46 PolarHBondContact O-N 3.36Å; L44-T46 VanDerWaalsContact O-N 3.16Å; L44-H60 PolarHBondContact O-NE2 3.06Å
45	F	88.7	Confident	89.2	Confident	170 Å²	170	71.2 Å²	71.2	75%	0.746	35%	0.347	S	S	*	.	S	Bend	trans	60.7	14.3	179.4	-49.7	-69.2	0	0	0	116.1	L39 H60	L39-F45 HydrophobicContact CD1-CD2 4.37Å; L39-F45 HydrophobicContact CD2-CD2 4.32Å; L39-F45 HydrophobicContact CD2-CE2 4.44Å; F45-H60 PolarHBondContact O-CD2 3.17Å
46	T	88.3	Confident	89.2	Confident	41 Å²	41	69 Å²	69	25%	0.252	34%	0.343	S	S	.	.			trans	-73.1	130.1	173.7	55.4	0	0	0	0	110.3	L44 P58 C59	L44-T46 PolarHBondContact O-N 3.36Å; L44-T46 VanDerWaalsContact O-N 3.16Å; T46-P58 HydrophobicContact CG2-CB 4.09Å; T46-C59 WeakPolarHBondContact CA-O 3.19Å; T46-C59 WeakPolarHBondContact CB-O 3.14Å
47	D	89.4	Confident	89.1	Confident	82 Å²	82	67.2 Å²	67.2	44%	0.439	33%	0.333	S	S	.	.			trans	-118.9	-0.3	-172	59.4	-15.5	0	0	0	113.2	C59 H60 R61	D47-C59 PolarHBondContact N-O 3.11Å; D47-C59 VanDerWaalsContact N-O 3.15Å; D47-H60 WeakPolarHBondContact OD1-CA 3.28Å; D47-R61 WeakPolarHBondContact OD1-CG 3.2Å; D47-R61 PolarHBondContact OD1-N 3.08Å; D47-R61 WeakPolarHBondContact OD2-CB 3.29Å; D47-R61 WeakPolarHBondContact OD2-CD 3.44Å; D47-R61 WeakPolarHBondContact OD2-CG 3.46Å
48	V	89.5	Confident	89.2	Confident	6 Å²	6	67 Å²	67	4%	0.036	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	144.7	174.4	64.3	0	0	0	0	111.5	L50 C59 R61 L64 F75 V87	V48-L50 HydrophobicContact CG2-CD2 4.08Å; V48-C59 HydrophobicContact CG1-CB 3.98Å; V48-C59 PolarHBondContact N-O 3.3Å; V48-C59 PolarHBondContact O-N 3.34Å; V48-R61 HydrophobicContact CB-CG 3.71Å; V48-R61 HydrophobicContact CG1-CG 3.68Å; V48-L64 HydrophobicContact CG1-CD1 4.1Å; V48-F75 HydrophobicContact CG1-CZ 4.43Å; V48-F75 HydrophobicContact CG2-CE1 4.37Å; V48-F75 HydrophobicContact CG2-CZ 4.26Å; V48-V87 HydrophobicContact CG2-CG2 4.16Å
49	L	90.8	Very high	89.2	Confident	44 Å²	44	63.3 Å²	63.3	23%	0.23	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.3	174.3	-169	65.6	0	0	0	109.8	H51 P58 S85 E86 V87	L49-H51 VanDerWaalsContact CD2-NE2 3.27Å; L49-H51 WeakPolarHBondContact CD2-NE2 3.41Å; L49-H51 WeakPolarHBondContact CG-NE2 3.46Å; L49-P58 HydrophobicContact CD1-CB 4.07Å; L49-S85 PolarHBondContact N-O 2.91Å; L49-E86 HydrophobicContact CB-CG 4.31Å; L49-E86 HydrophobicContact CD2-CG 4.44Å; L49-E86 CarbonylContact O-C 3.55Å; L49-E86 WeakPolarHBondContact O-CA 3.36Å; L49-V87 PolarHBondContact O-N 3.23Å
50	L	90.1	Very high	89.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.5	175.6	-54.1	-177.3	0	0	0	109.8	V48 S56 F57 L64 F71 V87 F89 L98 L102	V48-L50 HydrophobicContact CG2-CD2 4.08Å; L50-S56 CarbonylContact O-C 3.58Å; L50-S56 WeakPolarHBondContact O-CA 3.44Å; L50-F57 HydrophobicContact CB-CB 4.45Å; L50-F57 PolarHBondContact N-O 3.36Å; L50-F57 PolarHBondContact O-N 2.9Å; L50-L64 HydrophobicContact CD1-CD1 3.99Å; L50-F71 HydrophobicContact CD1-CE1 4.4Å; L50-F71 HydrophobicContact CD1-CZ 4.12Å; L50-F71 HydrophobicContact CD2-CE1 4.3Å; L50-V87 CarbonylContact C-O 3.59Å; L50-V87 WeakPolarHBondContact CA-O 3.33Å; L50-V87 HydrophobicContact CD2-CB 3.73Å; L50-V87 HydrophobicContact CD2-CG1 4.33Å; L50-V87 HydrophobicContact CD2-CG2 4.17Å; L50-F89 HydrophobicContact CB-CE2 4.31Å; L50-F89 HydrophobicContact CD1-CE2 4.33Å; L50-F89 HydrophobicContact CD2-CE2 4.11Å; L50-F89 HydrophobicContact CG-CE2 4.48Å; L50-L98 HydrophobicContact CB-CD2 4.38Å; L50-L102 HydrophobicContact CD1-CD1 4.46Å; L50-L102 HydrophobicContact CD1-CD2 3.98Å
51	H	88.9	Confident	89.2	Confident	43 Å²	43	65 Å²	65	20%	0.199	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.5	174.6	-58.5	-98.4	0	0	0	111	L49 R55 E86 V87 N88 F89	L49-H51 VanDerWaalsContact CD2-NE2 3.27Å; L49-H51 WeakPolarHBondContact CD2-NE2 3.41Å; L49-H51 WeakPolarHBondContact CG-NE2 3.46Å; H51-R55 WeakPolarHBondContact CA-O 3.4Å; H51-E86 IonicContact NE2-OE2 3.48Å; H51-V87 PolarHBondContact N-O 3.37Å; H51-N88 WeakPolarHBondContact CB-OD1 3.46Å; H51-N88 PolarHBondContact CD2-OD1 3.12Å; H51-F89 PolarHBondContact O-N 3.41Å
52	A	87.1	Confident	89.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	117.1	168.5	0	0	0	0	0	108.4	N54 R55 F57 P95 L98	A52-N54 PolarHBondContact O-N 2.91Å; A52-R55 PolarHBondContact N-O 3.2Å; A52-R55 PolarHBondContact O-N 3.42Å; A52-F57 HydrophobicContact CB-CE2 4.43Å; A52-P95 HydrophobicContact CB-CB 4.4Å; A52-P95 HydrophobicContact CB-CG 4.34Å; A52-P95 WeakPolarHBondContact O-CG 3.39Å; A52-L98 HydrophobicContact CB-CB 4.46Å; A52-L98 HydrophobicContact CB-CD2 3.64Å
53	G	82.8	Confident	89.2	Confident	36 Å²	36	58.2 Å²	58.2	37%	0.371	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	-113.4	-170.6	0	0	0	0	0	111.9	H90	G53-H90 WeakPolarHBondContact CA-O 3.28Å; G53-H90 PolarHBondContact N-O 3.4Å
54	N	83.8	Confident	89.3	Confident	173 Å²	173	49.5 Å²	49.5	93%	0.925	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	1.8	-177.6	-63.3	-12.9	0	0	0	114.1	A52	A52-N54 PolarHBondContact O-N 2.91Å
55	R	88.7	Confident	89.4	Confident	99 Å²	99	47 Å²	47	37%	0.374	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.7	-178.9	-65.5	-177.4	69.9	-164.6	-1.9	110.9	H51 A52 F57 P95 E99	H51-R55 WeakPolarHBondContact CA-O 3.4Å; A52-R55 PolarHBondContact N-O 3.2Å; A52-R55 PolarHBondContact O-N 3.42Å; R55-F57 HydrophobicContact CB-CE2 3.76Å; R55-F57 HydrophobicContact CB-CZ 3.84Å; R55-P95 HydrophobicContact CB-CB 4.14Å; R55-P95 HydrophobicContact CG-CB 4.14Å; R55-E99 IonicContact CZ-OE2 3.7Å; R55-E99 IonicContact NH1-OE2 3.68Å; R55-E99 PolarHBondContact NH1-OE2 3.32Å; R55-E99 IonicContact NH2-OE1 2.8Å; R55-E99 PolarHBondContact NH2-OE1 2.98Å; R55-E99 IonicContact NH2-OE2 2.85Å; R55-E99 PolarHBondContact NH2-OE2 3.46Å
56	S	90.3	Very high	89.5	Confident	61 Å²	61	43.3 Å²	43.3	43%	0.427	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.4	178.7	63.2	0	0	0	0	110.9	L50	L50-S56 CarbonylContact O-C 3.58Å; L50-S56 WeakPolarHBondContact O-CA 3.44Å
57	F	91.3	Very high	89.6	Confident	10 Å²	10	43.6 Å²	43.6	4%	0.044	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	106.2	-173.7	-59	-84.5	0	0	0	110.9	L50 A52 R55 C59 P95 L98 E99 L102	L50-F57 HydrophobicContact CB-CB 4.45Å; L50-F57 PolarHBondContact N-O 3.36Å; L50-F57 PolarHBondContact O-N 2.9Å; A52-F57 HydrophobicContact CB-CE2 4.43Å; R55-F57 HydrophobicContact CB-CE2 3.76Å; R55-F57 HydrophobicContact CB-CZ 3.84Å; F57-C59 PolarHBondContact O-SG 2.99Å; F57-P95 HydrophobicContact CZ-CB 4.47Å; F57-P95 WeakPolarHBondContact CZ-O 3.38Å; F57-L98 HydrophobicContact CD2-CD2 3.89Å; F57-L98 HydrophobicContact CD2-CG 4.47Å; F57-L98 HydrophobicContact CE2-CD2 4.1Å; F57-E99 HydrophobicContact CE1-CB 3.86Å; F57-E99 HydrophobicContact CE1-CG 4.13Å; F57-E99 HydrophobicContact CZ-CB 4.13Å; F57-L102 HydrophobicContact CB-CD1 3.52Å; F57-L102 HydrophobicContact CD1-CD1 4.07Å; F57-L102 HydrophobicContact CD2-CD1 4.43Å; F57-L102 HydrophobicContact CG-CD1 3.77Å
58	P	92.3	Very high	89.7	Confident	23 Å²	23	39.8 Å²	39.8	15%	0.149	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	129.8	176.7	30.4	-32.5	0	0	0	109.8	R40 R43 T46 L49	R40-P58 WeakPolarHBondContact CG-O 3.37Å; R43-P58 HydrophobicContact CG-CG 3.97Å; T46-P58 HydrophobicContact CG2-CB 4.09Å; L49-P58 HydrophobicContact CD1-CB 4.07Å
59	C	92.7	Very high	89.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	173.6	-172.9	-59.7	0	0	0	0	111.9	T46 D47 V48 F57 L64	T46-C59 WeakPolarHBondContact CA-O 3.19Å; T46-C59 WeakPolarHBondContact CB-O 3.14Å; D47-C59 PolarHBondContact N-O 3.11Å; D47-C59 VanDerWaalsContact N-O 3.15Å; V48-C59 HydrophobicContact CG1-CB 3.98Å; V48-C59 PolarHBondContact N-O 3.3Å; V48-C59 PolarHBondContact O-N 3.34Å; F57-C59 PolarHBondContact O-SG 2.99Å; C59-L64 HydrophobicContact CB-CD1 3.8Å; C59-L64 HydrophobicContact CB-CG 4.35Å
60	H	92.5	Very high	89.7	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.074	27%	0.274	C	S	.	.			trans	-107.6	121	174.9	-53.3	87.4	0	0	0	109.8	L44 F45 D47 A62 V63 L64 Y106	L44-H60 PolarHBondContact O-NE2 3.06Å; F45-H60 PolarHBondContact O-CD2 3.17Å; D47-H60 WeakPolarHBondContact OD1-CA 3.28Å; H60-A62 PolarHBondContact O-N 3.48Å; H60-V63 HydrophobicContact CB-CB 4.32Å; H60-V63 HydrophobicContact CB-CG2 3.99Å; H60-V63 PolarHBondContact O-N 3.41Å; H60-V63 VanDerWaalsContact O-N 3.08Å; H60-L64 PolarHBondContact O-N 3.39Å; H60-Y106 VanDerWaalsContact CB-OH 3.3Å; H60-Y106 WeakPolarHBondContact CB-OH 3.41Å; H60-Y106 PolarHBondContact N-OH 3.11Å; H60-Y106 AromaticContact ND1-CE1 3.6Å; H60-Y106 AromaticContact ND1-CZ 3.59Å; H60-Y106 PolarHBondContact ND1-OH 3.04Å
61	R	89.9	Confident	89.6	Confident	65 Å²	65	48.8 Å²	48.8	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-56.3	-40.5	-178.9	-65.7	175.9	81.3	-174.3	11.9	112.1	D47 V48 V63 L64 A65 F75 S82	D47-R61 WeakPolarHBondContact OD1-CG 3.2Å; D47-R61 PolarHBondContact OD1-N 3.08Å; D47-R61 WeakPolarHBondContact OD2-CB 3.29Å; D47-R61 WeakPolarHBondContact OD2-CD 3.44Å; D47-R61 WeakPolarHBondContact OD2-CG 3.46Å; V48-R61 HydrophobicContact CB-CG 3.71Å; V48-R61 HydrophobicContact CG1-CG 3.68Å; R61-V63 VanDerWaalsContact C-N 3.31Å; R61-V63 PolarHBondContact O-N 2.9Å; R61-L64 PolarHBondContact O-N 2.98Å; R61-A65 VanDerWaalsContact O-CB 3.29Å; R61-A65 WeakPolarHBondContact O-CB 3Å; R61-A65 PolarHBondContact O-N 3.25Å; R61-F75 HydrophobicContact CB-CD2 3.79Å; R61-F75 HydrophobicContact CB-CE2 3.8Å; R61-F75 HydrophobicContact CB-CG 4.4Å; R61-F75 HydrophobicContact CB-CZ 4.4Å; R61-F75 HydrophobicContact CG-CD2 4.12Å; R61-F75 HydrophobicContact CG-CE1 4.29Å; R61-F75 HydrophobicContact CG-CE2 3.89Å; R61-F75 HydrophobicContact CG-CG 4.44Å; R61-F75 HydrophobicContact CG-CZ 3.98Å; R61-F75 VanDerWaalsContact NH2-CD1 3.35Å; R61-S82 PolarHBondContact NH1-O 3.03Å; R61-S82 PolarHBondContact NH2-O 3.3Å
62	A	88.9	Confident	89.6	Confident	76 Å²	76	50.3 Å²	50.3	63%	0.628	28%	0.281	S	S	*	.	H	α-helix	trans	-61.5	-37.3	179.4	0	0	0	0	0	113	H60 A66	H60-A62 PolarHBondContact O-N 3.48Å; A62-A66 VanDerWaalsContact O-CB 3.27Å; A62-A66 WeakPolarHBondContact O-CB 3.39Å; A62-A66 PolarHBondContact O-N 3Å; A62-A66 VanDerWaalsContact O-N 3.11Å
63	V	91.4	Very high	89.6	Confident	18 Å²	18	53 Å²	53	11%	0.109	30%	0.303	C	S	.	.	H	α-helix	trans	-73.7	-43.3	178.9	178.3	0	0	0	0	110.4	L36 H60 R61 A66 C67 A105 Y106	L36-V63 HydrophobicContact CD1-CG2 4.1Å; H60-V63 HydrophobicContact CB-CB 4.32Å; H60-V63 HydrophobicContact CB-CG2 3.99Å; H60-V63 PolarHBondContact O-N 3.41Å; H60-V63 VanDerWaalsContact O-N 3.08Å; R61-V63 VanDerWaalsContact C-N 3.31Å; R61-V63 PolarHBondContact O-N 2.9Å; V63-A66 PolarHBondContact O-N 3.08Å; V63-C67 WeakPolarHBondContact O-CB 3.43Å; V63-C67 PolarHBondContact O-N 3.38Å; V63-C67 VanDerWaalsContact O-N 3.11Å; V63-A105 HydrophobicContact CG1-CB 4.47Å; V63-Y106 HydrophobicContact CB-CE1 3.96Å; V63-Y106 HydrophobicContact CG1-CD1 4.07Å; V63-Y106 HydrophobicContact CG1-CD2 4.46Å; V63-Y106 HydrophobicContact CG1-CE1 3.72Å; V63-Y106 HydrophobicContact CG1-CE2 4.1Å; V63-Y106 HydrophobicContact CG1-CG 4.42Å; V63-Y106 HydrophobicContact CG2-CE1 3.77Å
64	L	90.9	Very high	89.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-45.5	178	-66.3	178.7	0	0	0	112.1	V48 L50 C59 H60 R61 A66 C67 S68 F71 F75 L102	V48-L64 HydrophobicContact CG1-CD1 4.1Å; L50-L64 HydrophobicContact CD1-CD1 3.99Å; C59-L64 HydrophobicContact CB-CD1 3.8Å; C59-L64 HydrophobicContact CB-CG 4.35Å; H60-L64 PolarHBondContact O-N 3.39Å; R61-L64 PolarHBondContact O-N 2.98Å; L64-A66 VanDerWaalsContact C-N 3.3Å; L64-A66 PolarHBondContact O-N 2.94Å; L64-C67 PolarHBondContact O-N 3.02Å; L64-S68 PolarHBondContact O-N 3.26Å; L64-F71 HydrophobicContact CB-CB 3.95Å; L64-F71 HydrophobicContact CB-CD2 3.92Å; L64-F71 HydrophobicContact CB-CG 3.89Å; L64-F71 HydrophobicContact CD1-CD1 4.48Å; L64-F71 HydrophobicContact CD1-CE1 4.49Å; L64-F71 HydrophobicContact CD2-CD2 4.33Å; L64-F71 HydrophobicContact CD2-CE2 4.24Å; L64-F75 HydrophobicContact CB-CE2 4.1Å; L64-F75 HydrophobicContact CD1-CE2 4.37Å; L64-F75 HydrophobicContact CD1-CZ 4.42Å; L64-L102 HydrophobicContact CD2-CD2 3.58Å
65	A	90.4	Very high	89.8	Confident	25 Å²	25	45.4 Å²	45.4	21%	0.207	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-32.5	176.3	0	0	0	0	0	112.8	R61 C67 E72 F75	R61-A65 VanDerWaalsContact O-CB 3.29Å; R61-A65 WeakPolarHBondContact O-CB 3Å; R61-A65 PolarHBondContact O-N 3.25Å; A65-C67 VanDerWaalsContact C-N 3.32Å; A65-E72 HydrophobicContact CB-CB 4.16Å; A65-F75 HydrophobicContact CB-CD2 4.33Å
66	A	89.9	Confident	89.5	Confident	91 Å²	91	44.9 Å²	44.9	75%	0.752	26%	0.264	S	S	*	.	H	α-helix	trans	-71.1	-29.8	175.7	0	0	0	0	0	112.7	A62 V63 L64	A62-A66 VanDerWaalsContact O-CB 3.27Å; A62-A66 WeakPolarHBondContact O-CB 3.39Å; A62-A66 PolarHBondContact O-N 3Å; A62-A66 VanDerWaalsContact O-N 3.11Å; V63-A66 PolarHBondContact O-N 3.08Å; L64-A66 VanDerWaalsContact C-N 3.3Å; L64-A66 PolarHBondContact O-N 2.94Å
67	C	89.9	Confident	88.5	Confident	47 Å²	47	44.2 Å²	44.2	32%	0.318	27%	0.267	S	S	.	.	H	α-helix	trans	-94.3	-30.7	-174.6	-165	0	0	0	0	113.4	V63 L64 A65 A105 F129	V63-C67 WeakPolarHBondContact O-CB 3.43Å; V63-C67 PolarHBondContact O-N 3.38Å; V63-C67 VanDerWaalsContact O-N 3.11Å; L64-C67 PolarHBondContact O-N 3.02Å; A65-C67 VanDerWaalsContact C-N 3.32Å; C67-A105 HydrophobicContact CB-CB 4.24Å; C67-F129 HydrophobicContact CB-CE1 4.23Å; C67-F129 WeakPolarHBondContact SG-CE1 3.42Å
68	S	91.7	Very high	87.2	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.014	30%	0.296	C	S	.	.			trans	-134.8	133	-176	146	0	0	0	0	111.9	L64 Y70 F71 E72 L127	L64-S68 PolarHBondContact O-N 3.26Å; S68-Y70 VanDerWaalsContact C-N 3.33Å; S68-Y70 PolarHBondContact OG-N 2.99Å; S68-F71 PolarHBondContact O-N 3.2Å; S68-F71 WeakPolarHBondContact OG-CD2 3.44Å; S68-F71 PolarHBondContact OG-N 2.84Å; S68-E72 PolarHBondContact O-N 3.06Å; S68-L127 WeakPolarHBondContact CB-O 3.39Å; S68-L127 PolarHBondContact OG-O 3.21Å
69	R	89.4	Confident	86.1	Confident	162 Å²	162	50.9 Å²	50.9	61%	0.611	32%	0.316	S	S	*	.	H	α-helix	trans	-69.1	-31.8	179.3	-67.6	-61.8	173	-175.4	-7.7	112.2	E72 A73 E128	R69-E72 WeakPolarHBondContact CD-OE2 3.43Å; R69-E72 IonicContact CZ-OE2 3.58Å; R69-E72 IonicContact NE-OE2 2.84Å; R69-E72 IonicContact NH1-OE1 3.55Å; R69-E72 PolarHBondContact NH1-OE1 3.02Å; R69-E72 IonicContact NH1-OE2 3.63Å; R69-E72 PolarHBondContact NH1-OE2 3.06Å; R69-E72 PolarHBondContact O-N 2.98Å; R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.13Å; R69-E128 HydrophobicContact CB-CB 4.37Å; R69-E128 WeakPolarHBondContact CB-OE2 3.44Å
70	Y	90.2	Very high	84.7	Confident	77 Å²	77	59 Å²	59	30%	0.302	35%	0.352	S	S	.	.	H	α-helix	trans	-57.7	-50.1	171.1	176.4	-96.6	0	0	0	111.8	S68 A73 M74 F89 L127 E128	S68-Y70 VanDerWaalsContact C-N 3.33Å; S68-Y70 PolarHBondContact OG-N 2.99Å; Y70-A73 PolarHBondContact O-N 2.94Å; Y70-M74 HydrophobicContact CD1-CE 4.29Å; Y70-M74 HydrophobicContact CE1-CE 3.3Å; Y70-M74 VanDerWaalsContact CZ-CE 3.43Å; Y70-M74 WeakPolarHBondContact O-CB 3.27Å; Y70-M74 PolarHBondContact O-N 2.59Å; Y70-M74 WeakPolarHBondContact OH-CE 3.45Å; Y70-F89 HydrophobicContact CE1-CE1 4.18Å; Y70-F89 HydrophobicContact CE1-CZ 4.39Å; Y70-L127 WeakPolarHBondContact CB-O 3.12Å; Y70-L127 HydrophobicContact CD1-CD2 3.65Å; Y70-L127 HydrophobicContact CE1-CD2 3.58Å; Y70-L127 HydrophobicContact CG-CD2 4.4Å; Y70-E128 PolarHBondContact N-OE2 2.71Å
71	F	89.3	Confident	83.5	Confident	1 Å²	1	62.7 Å²	62.7	0%	0.004	37%	0.369	C	S	.	.	H	α-helix	trans	-69.5	-36	178.6	-72.8	-60.2	0	0	0	112.6	L50 L64 S68 M74 F75 F89 L127 F129	L50-F71 HydrophobicContact CD1-CE1 4.4Å; L50-F71 HydrophobicContact CD1-CZ 4.12Å; L50-F71 HydrophobicContact CD2-CE1 4.3Å; L64-F71 HydrophobicContact CB-CB 3.95Å; L64-F71 HydrophobicContact CB-CD2 3.92Å; L64-F71 HydrophobicContact CB-CG 3.89Å; L64-F71 HydrophobicContact CD1-CD1 4.48Å; L64-F71 HydrophobicContact CD1-CE1 4.49Å; L64-F71 HydrophobicContact CD2-CD2 4.33Å; L64-F71 HydrophobicContact CD2-CE2 4.24Å; S68-F71 PolarHBondContact O-N 3.2Å; S68-F71 WeakPolarHBondContact OG-CD2 3.44Å; S68-F71 PolarHBondContact OG-N 2.84Å; F71-M74 HydrophobicContact CD1-SD 4.33Å; F71-M74 PolarHBondContact O-N 2.93Å; F71-F75 HydrophobicContact CB-CD2 4.33Å; F71-F75 HydrophobicContact CB-CE2 3.96Å; F71-F75 HydrophobicContact CD1-CE2 4.16Å; F71-F75 AromaticContact CD1-CZ 3.99Å; F71-F75 HydrophobicContact CD1-CZ 3.99Å; F71-F75 HydrophobicContact CG-CE2 4.39Å; F71-F75 WeakPolarHBondContact O-CB 3.27Å; F71-F75 WeakPolarHBondContact O-CD2 3.4Å; F71-F75 VanDerWaalsContact O-CG 3.28Å; F71-F75 WeakPolarHBondContact O-CG 3.3Å; F71-F75 PolarHBondContact O-N 3.11Å; F71-F89 AromaticContact CE1-CZ 3.91Å; F71-F89 HydrophobicContact CE1-CZ 3.91Å; F71-F89 HydrophobicContact CZ-CE2 4.48Å; F71-F89 AromaticContact CZ-CZ 3.99Å; F71-F89 HydrophobicContact CZ-CZ 3.99Å; F71-L127 HydrophobicContact CZ-CD1 4.46Å; F71-L127 HydrophobicContact CZ-CD2 4.24Å; F71-F129 HydrophobicContact CD2-CE2 4.43Å; F71-F129 HydrophobicContact CE2-CE2 4.01Å; F71-F129 HydrophobicContact CE2-CZ 4.3Å
72	E	88.4	Confident	82.6	Confident	74 Å²	74	60.5 Å²	60.5	35%	0.346	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-48.9	172.6	-171.7	-177.2	-157.4	0	0	111.1	A65 S68 R69 F75 S76	A65-E72 HydrophobicContact CB-CB 4.16Å; S68-E72 PolarHBondContact O-N 3.06Å; R69-E72 WeakPolarHBondContact CD-OE2 3.43Å; R69-E72 IonicContact CZ-OE2 3.58Å; R69-E72 IonicContact NE-OE2 2.84Å; R69-E72 IonicContact NH1-OE1 3.55Å; R69-E72 PolarHBondContact NH1-OE1 3.02Å; R69-E72 IonicContact NH1-OE2 3.63Å; R69-E72 PolarHBondContact NH1-OE2 3.06Å; R69-E72 PolarHBondContact O-N 2.98Å; E72-F75 PolarHBondContact O-N 3.31Å; E72-S76 WeakPolarHBondContact O-CB 3.5Å; E72-S76 PolarHBondContact O-N 3.18Å; E72-S76 PolarHBondContact O-OG 3.04Å
73	A	86.9	Confident	81.7	Confident	57 Å²	57	65.2 Å²	65.2	47%	0.471	37%	0.373	S	S	.	.	H	α-helix	trans	-64.2	-43.6	178	0	0	0	0	0	112	R69 Y70 F75 G77	R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.13Å; Y70-A73 PolarHBondContact O-N 2.94Å; A73-F75 VanDerWaalsContact C-N 3.35Å; A73-F75 PolarHBondContact O-N 3.35Å; A73-G77 WeakPolarHBondContact O-CA 3.33Å; A73-G77 PolarHBondContact O-N 3.26Å
74	M	85.8	Confident	81	Confident	21 Å²	21	68.2 Å²	68.2	10%	0.103	39%	0.388	C	S	.	.	H	α-helix	trans	-59.2	-44.1	177.6	-178.9	-175.7	-74.3	0	0	112.1	Y70 F71 E81 V87	Y70-M74 HydrophobicContact CD1-CE 4.29Å; Y70-M74 HydrophobicContact CE1-CE 3.3Å; Y70-M74 VanDerWaalsContact CZ-CE 3.43Å; Y70-M74 WeakPolarHBondContact O-CB 3.27Å; Y70-M74 PolarHBondContact O-N 2.59Å; Y70-M74 WeakPolarHBondContact OH-CE 3.45Å; F71-M74 HydrophobicContact CD1-SD 4.33Å; F71-M74 PolarHBondContact O-N 2.93Å; M74-E81 HydrophobicContact CG-CB 4.05Å; M74-V87 HydrophobicContact CE-CG1 4.09Å; M74-V87 HydrophobicContact SD-CG1 4.01Å; M74-V87 HydrophobicContact SD-CG2 3.98Å
75	F	85.3	Confident	80.5	Confident	28 Å²	28	71.7 Å²	71.7	12%	0.123	41%	0.412	C	S	.	.	H	α-helix	trans	-84.4	-25.7	-176.1	-59.6	-32.1	0	0	0	113.8	V48 R61 L64 A65 F71 E72 A73	V48-F75 HydrophobicContact CG1-CZ 4.43Å; V48-F75 HydrophobicContact CG2-CE1 4.37Å; V48-F75 HydrophobicContact CG2-CZ 4.26Å; R61-F75 HydrophobicContact CB-CD2 3.79Å; R61-F75 HydrophobicContact CB-CE2 3.8Å; R61-F75 HydrophobicContact CB-CG 4.4Å; R61-F75 HydrophobicContact CB-CZ 4.4Å; R61-F75 HydrophobicContact CG-CD2 4.12Å; R61-F75 HydrophobicContact CG-CE1 4.29Å; R61-F75 HydrophobicContact CG-CE2 3.89Å; R61-F75 HydrophobicContact CG-CG 4.44Å; R61-F75 HydrophobicContact CG-CZ 3.98Å; R61-F75 VanDerWaalsContact NH2-CD1 3.35Å; L64-F75 HydrophobicContact CB-CE2 4.1Å; L64-F75 HydrophobicContact CD1-CE2 4.37Å; L64-F75 HydrophobicContact CD1-CZ 4.42Å; A65-F75 HydrophobicContact CB-CD2 4.33Å; F71-F75 HydrophobicContact CB-CD2 4.33Å; F71-F75 HydrophobicContact CB-CE2 3.96Å; F71-F75 HydrophobicContact CD1-CE2 4.16Å; F71-F75 AromaticContact CD1-CZ 3.99Å; F71-F75 HydrophobicContact CD1-CZ 3.99Å; F71-F75 HydrophobicContact CG-CE2 4.39Å; F71-F75 WeakPolarHBondContact O-CB 3.27Å; F71-F75 WeakPolarHBondContact O-CD2 3.4Å; F71-F75 VanDerWaalsContact O-CG 3.28Å; F71-F75 WeakPolarHBondContact O-CG 3.3Å; F71-F75 PolarHBondContact O-N 3.11Å; E72-F75 PolarHBondContact O-N 3.31Å; A73-F75 VanDerWaalsContact C-N 3.35Å; A73-F75 PolarHBondContact O-N 3.35Å
76	S	82.4	Confident	80.2	Confident	89 Å²	89	75 Å²	75	62%	0.622	42%	0.423	S	S	*	.	H	α-helix	trans	-91.8	-22.6	179.1	64	0	0	0	0	114.3	E72 G78	E72-S76 WeakPolarHBondContact O-CB 3.5Å; E72-S76 PolarHBondContact O-N 3.18Å; E72-S76 PolarHBondContact O-OG 3.04Å; S76-G78 VanDerWaalsContact C-N 3.27Å; S76-G78 PolarHBondContact O-N 2.73Å; S76-G78 VanDerWaalsContact O-N 3.1Å
77	G	68.7	Low	80	Confident	47 Å²	47	71.2 Å²	71.2	49%	0.485	39%	0.391	S	S	.	.	S	Bend	trans	-74.3	2.7	-165.7	0	0	0	0	0	117.4	A73 L79	A73-G77 WeakPolarHBondContact O-CA 3.33Å; A73-G77 PolarHBondContact O-N 3.26Å; G77-L79 PolarHBondContact O-N 2.96Å
78	G	64.8	Low	79.8	Confident	64 Å²	64	72.9 Å²	72.9	66%	0.66	40%	0.397	S	S	*	.			trans	63	11.2	179.6	0	0	0	0	0	115.2	S76	S76-G78 VanDerWaalsContact C-N 3.27Å; S76-G78 PolarHBondContact O-N 2.73Å; S76-G78 VanDerWaalsContact O-N 3.1Å
79	L	69.1	Low	79.3	Confident	109 Å²	109	73.4 Å²	73.4	57%	0.571	40%	0.399	S	S	*	.	S	Bend	trans	-74	170	174.7	-68.5	167	0	0	0	111	G77 E81 S82	G77-L79 PolarHBondContact O-N 2.96Å; L79-E81 WeakPolarHBondContact CB-OE2 3.45Å; L79-E81 PolarHBondContact O-N 2.97Å; L79-S82 VanDerWaalsContact O-CB 3.28Å; L79-S82 WeakPolarHBondContact O-CB 3.47Å; L79-S82 PolarHBondContact O-N 3.13Å; L79-S82 PolarHBondContact O-OG 2.93Å
80	K	63.4	Low	78.8	Confident	171 Å²	171	71.9 Å²	71.9	74%	0.743	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-59.1	-35.2	-175.6	-162.8	179.1	178.7	-172.7	0	111.9	S82 Q83 D84	K80-S82 PolarHBondContact O-N 3.39Å; K80-Q83 PolarHBondContact O-N 3.09Å; K80-Q83 VanDerWaalsContact O-N 3.13Å; K80-D84 PolarHBondContact O-N 3.49Å
81	E	67.8	Low	78.1	Confident	92 Å²	92	75.8 Å²	75.8	43%	0.43	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-64.3	-20.6	175.9	-63.3	77.4	-174.3	0	0	113	M74 L79 Q83	M74-E81 HydrophobicContact CG-CB 4.05Å; L79-E81 WeakPolarHBondContact CB-OE2 3.45Å; L79-E81 PolarHBondContact O-N 2.97Å; E81-Q83 VanDerWaalsContact C-N 3.28Å; E81-Q83 PolarHBondContact O-N 3.43Å
82	S	69.4	Low	77.7	Confident	19 Å²	19	79.5 Å²	79.5	13%	0.133	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-73.7	-22.6	175.2	72.7	0	0	0	0	112.8	R61 L79 K80	R61-S82 PolarHBondContact NH1-O 3.03Å; R61-S82 PolarHBondContact NH2-O 3.3Å; L79-S82 VanDerWaalsContact O-CB 3.28Å; L79-S82 WeakPolarHBondContact O-CB 3.47Å; L79-S82 PolarHBondContact O-N 3.13Å; L79-S82 PolarHBondContact O-OG 2.93Å; K80-S82 PolarHBondContact O-N 3.39Å
83	Q	69.9	Low	77.6	Confident	176 Å²	176	76.4 Å²	76.4	82%	0.822	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-14.7	177.2	-61.8	-172	6.8	0	0	112.7	K80 E81	K80-Q83 PolarHBondContact O-N 3.09Å; K80-Q83 VanDerWaalsContact O-N 3.13Å; E81-Q83 VanDerWaalsContact C-N 3.28Å; E81-Q83 PolarHBondContact O-N 3.43Å
84	D	78.4	Confident	77.7	Confident	80 Å²	80	79.8 Å²	79.8	43%	0.428	44%	0.442	S	S	.	.			trans	-79.9	136.7	-178.9	-134.6	-25.4	0	0	0	111	K80 E86	K80-D84 PolarHBondContact O-N 3.49Å; D84-E86 VanDerWaalsContact C-N 3.32Å
85	S	78.8	Confident	77.8	Confident	73 Å²	73	80.4 Å²	80.4	51%	0.51	45%	0.448	S	S	.	.	S	Bend	trans	-84.4	-12.4	176.9	52	0	0	0	0	112.6	L49	L49-S85 PolarHBondContact N-O 2.91Å
86	E	85.6	Confident	78.1	Confident	94 Å²	94	86.1 Å²	86.1	44%	0.439	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.8	-176.3	-60.2	-174.5	171	0	0	110.8	L49 H51 D84	L49-E86 HydrophobicContact CB-CG 4.31Å; L49-E86 HydrophobicContact CD2-CG 4.44Å; L49-E86 CarbonylContact O-C 3.55Å; L49-E86 WeakPolarHBondContact O-CA 3.36Å; H51-E86 IonicContact NE2-OE2 3.48Å; D84-E86 VanDerWaalsContact C-N 3.32Å
87	V	85.8	Confident	78.5	Confident	13 Å²	13	82.3 Å²	82.3	8%	0.079	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.9	176.9	-179.6	0	0	0	0	109.2	V48 L49 L50 H51 M74 F89	V48-V87 HydrophobicContact CG2-CG2 4.16Å; L49-V87 PolarHBondContact O-N 3.23Å; L50-V87 CarbonylContact C-O 3.59Å; L50-V87 WeakPolarHBondContact CA-O 3.33Å; L50-V87 HydrophobicContact CD2-CB 3.73Å; L50-V87 HydrophobicContact CD2-CG1 4.33Å; L50-V87 HydrophobicContact CD2-CG2 4.17Å; H51-V87 PolarHBondContact N-O 3.37Å; M74-V87 HydrophobicContact CE-CG1 4.09Å; M74-V87 HydrophobicContact SD-CG1 4.01Å; M74-V87 HydrophobicContact SD-CG2 3.98Å; V87-F89 HydrophobicContact CG1-CE1 4.46Å; V87-F89 HydrophobicContact CG1-CE2 4.01Å; V87-F89 HydrophobicContact CG1-CZ 3.92Å
88	N	84.4	Confident	79.6	Confident	81 Å²	81	80.1 Å²	80.1	43%	0.433	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	107.9	-171.9	-66.2	-25.1	0	0	0	112.3	H51 H90	H51-N88 WeakPolarHBondContact CB-OD1 3.46Å; H51-N88 PolarHBondContact CD2-OD1 3.12Å; N88-H90 VanDerWaalsContact C-N 3.28Å; N88-H90 PolarHBondContact O-N 3.17Å; N88-H90 PolarHBondContact O-ND1 2.88Å; N88-H90 VanDerWaalsContact O-ND1 3.09Å
89	F	82.4	Confident	80.9	Confident	13 Å²	13	80.1 Å²	80.1	6%	0.057	41%	0.408	C	S	.	.			trans	-83.3	-0.7	174	-63.1	-75	0	0	0	113.6	L50 H51 Y70 F71 V87 N91 S92 I93 L98 L127	L50-F89 HydrophobicContact CB-CE2 4.31Å; L50-F89 HydrophobicContact CD1-CE2 4.33Å; L50-F89 HydrophobicContact CD2-CE2 4.11Å; L50-F89 HydrophobicContact CG-CE2 4.48Å; H51-F89 PolarHBondContact O-N 3.41Å; Y70-F89 HydrophobicContact CE1-CE1 4.18Å; Y70-F89 HydrophobicContact CE1-CZ 4.39Å; F71-F89 AromaticContact CE1-CZ 3.91Å; F71-F89 HydrophobicContact CE1-CZ 3.91Å; F71-F89 HydrophobicContact CZ-CE2 4.48Å; F71-F89 AromaticContact CZ-CZ 3.99Å; F71-F89 HydrophobicContact CZ-CZ 3.99Å; V87-F89 HydrophobicContact CG1-CE1 4.46Å; V87-F89 HydrophobicContact CG1-CE2 4.01Å; V87-F89 HydrophobicContact CG1-CZ 3.92Å; F89-N91 PolarHBondContact O-N 3.11Å; F89-S92 VanDerWaalsContact O-CB 3.27Å; F89-S92 WeakPolarHBondContact O-CB 3.44Å; F89-S92 PolarHBondContact O-N 3.14Å; F89-S92 PolarHBondContact O-OG 3.19Å; F89-I93 HydrophobicContact CB-CD1 4.4Å; F89-I93 HydrophobicContact CD1-CD1 3.93Å; F89-I93 HydrophobicContact CE1-CD1 4.42Å; F89-I93 HydrophobicContact CG-CD1 4.14Å; F89-L98 HydrophobicContact CD2-CD2 4.22Å; F89-L127 HydrophobicContact CE1-CD2 3.66Å; F89-L127 HydrophobicContact CZ-CD2 3.93Å
90	H	78.2	Confident	82.1	Confident	131 Å²	131	76.9 Å²	76.9	61%	0.606	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.3	-121.4	178.3	-63.5	83.7	0	0	0	112	G53 N88	G53-H90 WeakPolarHBondContact CA-O 3.28Å; G53-H90 PolarHBondContact N-O 3.4Å; N88-H90 VanDerWaalsContact C-N 3.28Å; N88-H90 PolarHBondContact O-N 3.17Å; N88-H90 PolarHBondContact O-ND1 2.88Å; N88-H90 VanDerWaalsContact O-ND1 3.09Å
91	N	75.4	Confident	83.5	Confident	158 Å²	158	68.8 Å²	68.8	85%	0.845	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	10.4	179.8	-68.7	-11.1	0	0	0	113.2	F89 I93	F89-N91 PolarHBondContact O-N 3.11Å; N91-I93 VanDerWaalsContact C-N 3.33Å
92	S	80.1	Confident	84.6	Confident	79 Å²	79	64.5 Å²	64.5	55%	0.552	34%	0.336	S	S	*	.	S	Bend	trans	-74.6	-25.1	-176.4	-43.9	0	0	0	0	112.7	F89	F89-S92 VanDerWaalsContact O-CB 3.27Å; F89-S92 WeakPolarHBondContact O-CB 3.44Å; F89-S92 PolarHBondContact O-N 3.14Å; F89-S92 PolarHBondContact O-OG 3.19Å
93	I	86.4	Confident	85.7	Confident	10 Å²	10	66.1 Å²	66.1	5%	0.051	34%	0.343	C	S	.	.	S	Bend	trans	-136.7	133.1	-175.8	-54.3	177.6	0	0	0	109.4	F89 N91 V97 L98 A123 M126 L127	F89-I93 HydrophobicContact CB-CD1 4.4Å; F89-I93 HydrophobicContact CD1-CD1 3.93Å; F89-I93 HydrophobicContact CE1-CD1 4.42Å; F89-I93 HydrophobicContact CG-CD1 4.14Å; N91-I93 VanDerWaalsContact C-N 3.33Å; I93-V97 HydrophobicContact CG2-CB 4.43Å; I93-L98 HydrophobicContact CG2-CB 4.08Å; I93-A123 HydrophobicContact CG2-CB 4.12Å; I93-M126 HydrophobicContact CD1-SD 4.07Å; I93-M126 HydrophobicContact CG1-SD 4.11Å; I93-L127 HydrophobicContact CD1-CD1 3.75Å; I93-L127 HydrophobicContact CD1-CD2 4.23Å; I93-L127 HydrophobicContact CD1-CG 4.03Å
94	H	88.8	Confident	86.8	Confident	128 Å²	128	59.7 Å²	59.7	59%	0.593	31%	0.311	S	S	*	.			trans	-64.9	133.7	173.1	-78.6	-72.5	0	0	0	111	E96 V97 L98	H94-E96 PolarHBondContact O-N 3.17Å; H94-E96 VanDerWaalsContact O-N 3.15Å; H94-V97 HydrophobicContact CB-CB 4.38Å; H94-V97 HydrophobicContact CB-CG2 3.96Å; H94-V97 PolarHBondContact O-N 3.48Å; H94-L98 PolarHBondContact O-N 2.96Å; H94-L98 VanDerWaalsContact O-N 3.09Å
95	P	89.2	Confident	87.4	Confident	34 Å²	34	56.2 Å²	56.2	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-31.9	-176	-25.6	33.6	0	0	0	114.4	A52 R55 F57 E99	A52-P95 HydrophobicContact CB-CB 4.4Å; A52-P95 HydrophobicContact CB-CG 4.34Å; A52-P95 WeakPolarHBondContact O-CG 3.39Å; R55-P95 HydrophobicContact CB-CB 4.14Å; R55-P95 HydrophobicContact CG-CB 4.14Å; F57-P95 HydrophobicContact CZ-CB 4.47Å; F57-P95 WeakPolarHBondContact CZ-O 3.38Å; P95-E99 WeakPolarHBondContact O-CB 3.4Å; P95-E99 PolarHBondContact O-N 3.48Å
96	E	90.7	Very high	88	Confident	148 Å²	148	52.8 Å²	52.8	69%	0.692	27%	0.27	S	S	*	.	H	α-helix	trans	-69	-38.6	177.3	-63.7	176.6	-171.5	0	0	111.9	H94 E99 L100	H94-E96 PolarHBondContact O-N 3.17Å; H94-E96 VanDerWaalsContact O-N 3.15Å; E96-E99 PolarHBondContact O-N 2.98Å; E96-L100 WeakPolarHBondContact O-CG 3.47Å; E96-L100 PolarHBondContact O-N 2.96Å
97	V	92.3	Very high	88.2	Confident	9 Å²	9	50.2 Å²	50.2	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-67.8	-44.5	176.8	178.6	0	0	0	0	110.3	I93 H94 E99 L100 L101 L120 A123	I93-V97 HydrophobicContact CG2-CB 4.43Å; H94-V97 HydrophobicContact CB-CB 4.38Å; H94-V97 HydrophobicContact CB-CG2 3.96Å; H94-V97 PolarHBondContact O-N 3.48Å; V97-E99 VanDerWaalsContact C-N 3.28Å; V97-E99 PolarHBondContact O-N 2.99Å; V97-L100 PolarHBondContact O-N 3.38Å; V97-L101 HydrophobicContact CG1-CD1 4.45Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.07Å; V97-L120 HydrophobicContact CG1-CB 4.37Å; V97-L120 HydrophobicContact CG1-CD1 3.8Å; V97-A123 HydrophobicContact CG1-CB 3.63Å
98	L	91.7	Very high	88.3	Confident	1 Å²	1	53 Å²	53	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-40.1	176	-176.3	61.7	0	0	0	111.3	L50 A52 F57 F89 I93 H94 L101 L102 L127	L50-L98 HydrophobicContact CB-CD2 4.38Å; A52-L98 HydrophobicContact CB-CB 4.46Å; A52-L98 HydrophobicContact CB-CD2 3.64Å; F57-L98 HydrophobicContact CD2-CD2 3.89Å; F57-L98 HydrophobicContact CD2-CG 4.47Å; F57-L98 HydrophobicContact CE2-CD2 4.1Å; F89-L98 HydrophobicContact CD2-CD2 4.22Å; I93-L98 HydrophobicContact CG2-CB 4.08Å; H94-L98 PolarHBondContact O-N 2.96Å; H94-L98 VanDerWaalsContact O-N 3.09Å; L98-L101 PolarHBondContact O-N 3.43Å; L98-L102 HydrophobicContact CD1-CG 4.42Å; L98-L102 HydrophobicContact CG-CD1 4.17Å; L98-L102 HydrophobicContact CG-CG 4.43Å; L98-L102 WeakPolarHBondContact O-CB 3.39Å; L98-L102 WeakPolarHBondContact O-CG 3.42Å; L98-L102 PolarHBondContact O-N 3.21Å; L98-L127 HydrophobicContact CD1-CD1 4.17Å
99	E	91.7	Very high	88.6	Confident	63 Å²	63	58.5 Å²	58.5	29%	0.294	30%	0.297	S	S	.	.	H	α-helix	trans	-60.9	-43.7	175.2	-175.6	165.6	-142.2	0	0	112	R55 F57 P95 E96 V97 L101 L102 D103	R55-E99 IonicContact CZ-OE2 3.7Å; R55-E99 IonicContact NH1-OE2 3.68Å; R55-E99 PolarHBondContact NH1-OE2 3.32Å; R55-E99 IonicContact NH2-OE1 2.8Å; R55-E99 PolarHBondContact NH2-OE1 2.98Å; R55-E99 IonicContact NH2-OE2 2.85Å; R55-E99 PolarHBondContact NH2-OE2 3.46Å; F57-E99 HydrophobicContact CE1-CB 3.86Å; F57-E99 HydrophobicContact CE1-CG 4.13Å; F57-E99 HydrophobicContact CZ-CB 4.13Å; P95-E99 WeakPolarHBondContact O-CB 3.4Å; P95-E99 PolarHBondContact O-N 3.48Å; E96-E99 PolarHBondContact O-N 2.98Å; V97-E99 VanDerWaalsContact C-N 3.28Å; V97-E99 PolarHBondContact O-N 2.99Å; E99-L101 PolarHBondContact O-N 3.15Å; E99-L102 PolarHBondContact O-N 2.72Å; E99-D103 WeakPolarHBondContact O-CB 3.46Å; E99-D103 PolarHBondContact O-N 2.74Å
100	L	93.3	Very high	89.1	Confident	42 Å²	42	59.8 Å²	59.8	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-62.8	-40.8	175.4	-70.1	170.8	0	0	0	112.8	E96 V97 D103 Y104 V110	E96-L100 WeakPolarHBondContact O-CG 3.47Å; E96-L100 PolarHBondContact O-N 2.96Å; V97-L100 PolarHBondContact O-N 3.38Å; L100-D103 PolarHBondContact O-N 3.35Å; L100-Y104 WeakPolarHBondContact O-CB 3.48Å; L100-Y104 PolarHBondContact O-N 3.04Å; L100-V110 HydrophobicContact CB-CG2 4.24Å
101	L	92.9	Very high	89.8	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-40.7	175.5	-67.7	177.7	0	0	0	111.7	V97 L98 E99 Y104 A105 L120 A123 L127 F129 I132	V97-L101 HydrophobicContact CG1-CD1 4.45Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.07Å; L98-L101 PolarHBondContact O-N 3.43Å; E99-L101 PolarHBondContact O-N 3.15Å; L101-Y104 WeakPolarHBondContact O-CB 3.35Å; L101-Y104 PolarHBondContact O-N 3.06Å; L101-A105 PolarHBondContact O-N 3.09Å; L101-L120 HydrophobicContact CD2-CD1 3.58Å; L101-L120 HydrophobicContact CG-CD1 3.95Å; L101-A123 HydrophobicContact CD1-CB 3.82Å; L101-L127 HydrophobicContact CD1-CD1 3.79Å; L101-F129 HydrophobicContact CD2-CD2 4.46Å; L101-F129 HydrophobicContact CD2-CG 4.38Å; L101-I132 HydrophobicContact CD2-CD1 3.32Å; L101-I132 HydrophobicContact CD2-CG2 4.1Å
102	L	92	Very high	90.7	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-67	-45.9	175.8	-70	175.8	0	0	0	111	L50 F57 L64 L98 E99 Y104 A105 Y106	L50-L102 HydrophobicContact CD1-CD1 4.46Å; L50-L102 HydrophobicContact CD1-CD2 3.98Å; F57-L102 HydrophobicContact CB-CD1 3.52Å; F57-L102 HydrophobicContact CD1-CD1 4.07Å; F57-L102 HydrophobicContact CD2-CD1 4.43Å; F57-L102 HydrophobicContact CG-CD1 3.77Å; L64-L102 HydrophobicContact CD2-CD2 3.58Å; L98-L102 HydrophobicContact CD1-CG 4.42Å; L98-L102 HydrophobicContact CG-CD1 4.17Å; L98-L102 HydrophobicContact CG-CG 4.43Å; L98-L102 WeakPolarHBondContact O-CB 3.39Å; L98-L102 WeakPolarHBondContact O-CG 3.42Å; L98-L102 PolarHBondContact O-N 3.21Å; E99-L102 PolarHBondContact O-N 2.72Å; L102-Y104 PolarHBondContact O-N 3.04Å; L102-A105 WeakPolarHBondContact O-CB 3.29Å; L102-A105 PolarHBondContact O-N 3.21Å; L102-Y106 VanDerWaalsContact O-CD2 3.28Å; L102-Y106 WeakPolarHBondContact O-CD2 3.45Å; L102-Y106 PolarHBondContact O-N 2.93Å
103	D	91.4	Very high	91.3	Very high	53 Å²	53	53.5 Å²	53.5	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-36.1	176.2	-76.8	-9.7	0	0	0	111.1	R40 E99 L100 Y106 S107	R40-D103 IonicContact CZ-OD1 3.99Å; R40-D103 IonicContact NH1-OD1 2.65Å; R40-D103 IonicContact NH2-OD1 3.53Å; R40-D103 PolarHBondContact NH2-OD1 2.83Å; E99-D103 WeakPolarHBondContact O-CB 3.46Å; E99-D103 PolarHBondContact O-N 2.74Å; L100-D103 PolarHBondContact O-N 3.35Å; D103-Y106 PolarHBondContact O-N 3.18Å; D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.37Å; D103-S107 PolarHBondContact O-OG 2.92Å
104	Y	93.4	Very high	91.4	Very high	40 Å²	40	60 Å²	60	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-47.7	170	175	-91	0	0	0	112.3	L100 L101 L102 Y106 S107 S108 R109 V110 F129 D131 I132	L100-Y104 WeakPolarHBondContact O-CB 3.48Å; L100-Y104 PolarHBondContact O-N 3.04Å; L101-Y104 WeakPolarHBondContact O-CB 3.35Å; L101-Y104 PolarHBondContact O-N 3.06Å; L102-Y104 PolarHBondContact O-N 3.04Å; Y104-Y106 PolarHBondContact O-N 3.38Å; Y104-Y106 VanDerWaalsContact O-N 3.09Å; Y104-S107 PolarHBondContact O-N 2.84Å; Y104-S108 VanDerWaalsContact O-CA 3.32Å; Y104-S108 WeakPolarHBondContact O-CA 3.43Å; Y104-S108 PolarHBondContact O-N 2.97Å; Y104-R109 WeakPolarHBondContact CA-O 3.31Å; Y104-V110 HydrophobicContact CD2-CB 4.15Å; Y104-V110 HydrophobicContact CD2-CG1 4.21Å; Y104-F129 HydrophobicContact CD1-CD1 4.13Å; Y104-F129 HydrophobicContact CD1-CE1 4.29Å; Y104-F129 HydrophobicContact CE1-CD1 4.27Å; Y104-D131 WeakPolarHBondContact OH-CB 3.36Å; Y104-I132 HydrophobicContact CD1-CD1 3.45Å; Y104-I132 VanDerWaalsContact CD1-CD1 3.45Å; Y104-I132 HydrophobicContact CD1-CG1 3.96Å; Y104-I132 HydrophobicContact CD2-CD1 4.13Å; Y104-I132 HydrophobicContact CD2-CG1 4.13Å; Y104-I132 HydrophobicContact CE1-CD1 3.89Å; Y104-I132 HydrophobicContact CE1-CG1 3.92Å; Y104-I132 HydrophobicContact CE2-CG1 4.11Å; Y104-I132 HydrophobicContact CG-CD1 3.56Å; Y104-I132 HydrophobicContact CG-CG1 4.03Å
105	A	91.8	Very high	91.4	Very high	8 Å²	8	62.3 Å²	62.3	7%	0.066	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-28.9	-179.6	0	0	0	0	0	113	V63 C67 L101 L102 F129	V63-A105 HydrophobicContact CG1-CB 4.47Å; C67-A105 HydrophobicContact CB-CB 4.24Å; L101-A105 PolarHBondContact O-N 3.09Å; L102-A105 WeakPolarHBondContact O-CB 3.29Å; L102-A105 PolarHBondContact O-N 3.21Å; A105-F129 HydrophobicContact CB-CE1 4.43Å
106	Y	91.4	Very high	91.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-101.3	-15.5	179.6	-73.7	-83.5	0	0	0	115.1	L33 L36 N37 R40 H60 V63 L102 D103 Y104	L33-Y106 CarbonylContact C-O 3.58Å; L36-Y106 HydrophobicContact CB-CD1 4.04Å; L36-Y106 HydrophobicContact CB-CE1 4.12Å; N37-Y106 HydrophobicContact CB-CD1 4.36Å; N37-Y106 HydrophobicContact CB-CG 4.37Å; R40-Y106 HydrophobicContact CB-CE1 4.48Å; R40-Y106 VanDerWaalsContact CD-CE2 3.45Å; H60-Y106 VanDerWaalsContact CB-OH 3.3Å; H60-Y106 WeakPolarHBondContact CB-OH 3.41Å; H60-Y106 PolarHBondContact N-OH 3.11Å; H60-Y106 AromaticContact ND1-CE1 3.6Å; H60-Y106 AromaticContact ND1-CZ 3.59Å; H60-Y106 PolarHBondContact ND1-OH 3.04Å; V63-Y106 HydrophobicContact CB-CE1 3.96Å; V63-Y106 HydrophobicContact CG1-CD1 4.07Å; V63-Y106 HydrophobicContact CG1-CD2 4.46Å; V63-Y106 HydrophobicContact CG1-CE1 3.72Å; V63-Y106 HydrophobicContact CG1-CE2 4.1Å; V63-Y106 HydrophobicContact CG1-CG 4.42Å; V63-Y106 HydrophobicContact CG2-CE1 3.77Å; L102-Y106 VanDerWaalsContact O-CD2 3.28Å; L102-Y106 WeakPolarHBondContact O-CD2 3.45Å; L102-Y106 PolarHBondContact O-N 2.93Å; D103-Y106 PolarHBondContact O-N 3.18Å; Y104-Y106 PolarHBondContact O-N 3.38Å; Y104-Y106 VanDerWaalsContact O-N 3.09Å
107	S	89.6	Confident	91.5	Very high	41 Å²	41	54.6 Å²	54.6	29%	0.287	27%	0.272	S	S	.	.	H	α-helix	trans	-123.6	-11.8	-175	75.7	0	0	0	0	114.9	D103 Y104 R109	D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.37Å; D103-S107 PolarHBondContact O-OG 2.92Å; Y104-S107 PolarHBondContact O-N 2.84Å; S107-R109 PolarHBondContact O-N 2.99Å; S107-R109 PolarHBondContact OG-N 3.32Å; S107-R109 PolarHBondContact OG-O 2.79Å
108	S	88.1	Confident	91.5	Very high	70 Å²	70	58.4 Å²	58.4	49%	0.49	29%	0.289	S	S	.	.	S	Bend	trans	58.6	17.3	-169.2	69.6	0	0	0	0	114.9	Y104	Y104-S108 VanDerWaalsContact O-CA 3.32Å; Y104-S108 WeakPolarHBondContact O-CA 3.43Å; Y104-S108 PolarHBondContact O-N 2.97Å
109	R	89.8	Confident	91.5	Very high	197 Å²	197	60 Å²	60	74%	0.743	30%	0.3	S	S	*	.			trans	-130	139.9	-175.9	-62.6	177.5	-173.6	-170.1	1.2	110.5	Y104 S107	Y104-R109 WeakPolarHBondContact CA-O 3.31Å; S107-R109 PolarHBondContact O-N 2.99Å; S107-R109 PolarHBondContact OG-N 3.32Å; S107-R109 PolarHBondContact OG-O 2.79Å
110	V	93.9	Very high	91.6	Very high	40 Å²	40	57 Å²	57	24%	0.242	29%	0.286	C	S	.	.			trans	-141	145.7	175.9	65.9	0	0	0	0	109.5	L100 Y104 I112 L120	L100-V110 HydrophobicContact CB-CG2 4.24Å; Y104-V110 HydrophobicContact CD2-CB 4.15Å; Y104-V110 HydrophobicContact CD2-CG1 4.21Å; V110-I112 HydrophobicContact CG1-CD1 4.34Å; V110-I112 HydrophobicContact CG1-CG1 4.17Å; V110-L120 HydrophobicContact CG2-CD2 3.86Å
111	I	92.8	Very high	91.6	Very high	130 Å²	130	55 Å²	55	67%	0.667	28%	0.275	S	S	*	.			trans	-102.1	118.6	176.2	-60.2	174.2	0	0	0	107.6	N116	I111-N116 PolarHBondContact O-ND2 2.99Å
112	I	94	Very high	91.5	Very high	40 Å²	40	59 Å²	59	21%	0.205	29%	0.294	C	S	.	.			trans	-107.2	129	179.2	-52.3	175.6	0	0	0	108.2	V110 N116 A117 L120 A135 F139	V110-I112 HydrophobicContact CG1-CD1 4.34Å; V110-I112 HydrophobicContact CG1-CG1 4.17Å; I112-N116 WeakPolarHBondContact CA-OD1 3.45Å; I112-A117 HydrophobicContact CG2-CB 3.9Å; I112-L120 HydrophobicContact CG1-CD2 4Å; I112-A135 HydrophobicContact CD1-CB 3.89Å; I112-F139 HydrophobicContact CG2-CB 4.03Å; I112-F139 HydrophobicContact CG2-CD1 3.75Å; I112-F139 HydrophobicContact CG2-CD2 4.29Å; I112-F139 HydrophobicContact CG2-CE1 4.28Å; I112-F139 HydrophobicContact CG2-CG 3.76Å
113	N	92.8	Very high	91.5	Very high	66 Å²	66	59.1 Å²	59.1	35%	0.353	30%	0.295	S	S	.	.			trans	-134.6	175.3	177.7	68.5	26.2	0	0	0	110.2	E115 N116 A117	N113-E115 VanDerWaalsContact C-N 3.31Å; N113-E115 PolarHBondContact O-N 2.91Å; N113-E115 PolarHBondContact OD1-N 3.29Å; N113-E115 VanDerWaalsContact OD1-N 3.13Å; N113-N116 PolarHBondContact N-OD1 3.15Å; N113-N116 PolarHBondContact O-OD1 2.97Å; N113-N116 VanDerWaalsContact O-OD1 3.14Å; N113-N116 VanDerWaalsContact OD1-CB 3.28Å; N113-N116 WeakPolarHBondContact OD1-CB 3.22Å; N113-N116 PolarHBondContact OD1-N 3.35Å; N113-N116 PolarHBondContact OD1-ND2 3.3Å; N113-N116 PolarHBondContact OD1-OD1 3.39Å; N113-N116 VanDerWaalsContact OD1-OD1 3.14Å; N113-A117 WeakPolarHBondContact O-CB 3.44Å; N113-A117 PolarHBondContact O-N 3.5Å
114	E	87.7	Confident	91.5	Very high	146 Å²	146	56.6 Å²	56.6	68%	0.682	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.4	-177	-66.1	177.9	-176.6	0	0	113.5	F139	E114-F139 HydrophobicContact CG-CE1 4.34Å; E114-F139 HydrophobicContact CG-CZ 4.3Å
115	E	88.5	Confident	91.4	Very high	178 Å²	178	56.8 Å²	56.8	83%	0.832	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-31	-178.1	-62.8	-179.4	171.2	0	0	112.7	N113	N113-E115 VanDerWaalsContact C-N 3.31Å; N113-E115 PolarHBondContact O-N 2.91Å; N113-E115 PolarHBondContact OD1-N 3.29Å; N113-E115 VanDerWaalsContact OD1-N 3.13Å
116	N	91.6	Very high	91.4	Very high	20 Å²	20	60.9 Å²	60.9	11%	0.107	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-17.7	-174.3	77.2	11.5	0	0	0	113.6	I111 I112 N113 E118 S119 L120	I111-N116 PolarHBondContact O-ND2 2.99Å; I112-N116 WeakPolarHBondContact CA-OD1 3.45Å; N113-N116 PolarHBondContact N-OD1 3.15Å; N113-N116 PolarHBondContact O-OD1 2.97Å; N113-N116 VanDerWaalsContact O-OD1 3.14Å; N113-N116 VanDerWaalsContact OD1-CB 3.28Å; N113-N116 WeakPolarHBondContact OD1-CB 3.22Å; N113-N116 PolarHBondContact OD1-N 3.35Å; N113-N116 PolarHBondContact OD1-ND2 3.3Å; N113-N116 PolarHBondContact OD1-OD1 3.39Å; N113-N116 VanDerWaalsContact OD1-OD1 3.14Å; N116-E118 VanDerWaalsContact C-N 3.33Å; N116-E118 PolarHBondContact O-N 3.45Å; N116-S119 PolarHBondContact O-N 3.29Å; N116-L120 WeakPolarHBondContact O-CB 3.44Å; N116-L120 PolarHBondContact O-N 2.89Å
117	A	91.9	Very high	91.4	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-40.6	-171.9	0	0	0	0	0	113	I112 N113 L121 F139 L140	I112-A117 HydrophobicContact CG2-CB 3.9Å; N113-A117 WeakPolarHBondContact O-CB 3.44Å; N113-A117 PolarHBondContact O-N 3.5Å; A117-L121 WeakPolarHBondContact O-CB 3.44Å; A117-L121 PolarHBondContact O-N 3.19Å; A117-F139 HydrophobicContact CB-CD1 3.77Å; A117-F139 HydrophobicContact CB-CE1 4.08Å; A117-L140 HydrophobicContact CB-CD2 3.7Å; A117-L140 HydrophobicContact CB-CG 4.12Å
118	E	91.5	Very high	91.5	Very high	88 Å²	88	63 Å²	63	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-65.2	-56.9	178.4	-62	-178.4	-165.8	0	0	110.8	N116 L120 L121 E122 L140 M152 L155	N116-E118 VanDerWaalsContact C-N 3.33Å; N116-E118 PolarHBondContact O-N 3.45Å; E118-L120 VanDerWaalsContact C-N 3.26Å; E118-L120 PolarHBondContact O-N 2.77Å; E118-L121 WeakPolarHBondContact O-CB 3.43Å; E118-L121 PolarHBondContact O-N 2.8Å; E118-L121 VanDerWaalsContact O-N 3.11Å; E118-E122 WeakPolarHBondContact O-CG 3.48Å; E118-E122 PolarHBondContact O-N 3.25Å; E118-L140 HydrophobicContact CG-CD2 4.49Å; E118-M152 HydrophobicContact CG-CE 3.96Å; E118-M152 WeakPolarHBondContact OE1-CE 3.39Å; E118-L155 HydrophobicContact CB-CD2 4.18Å; E118-L155 HydrophobicContact CG-CD2 4Å
119	S	92.1	Very high	91.7	Very high	34 Å²	34	59.9 Å²	59.9	24%	0.238	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-30.4	-179.7	-52.2	0	0	0	0	113.3	N116 A123	N116-S119 PolarHBondContact O-N 3.29Å; S119-A123 VanDerWaalsContact O-CB 3.29Å; S119-A123 WeakPolarHBondContact O-CB 3.15Å; S119-A123 PolarHBondContact O-N 3.16Å
120	L	93.4	Very high	91.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-73.9	-34.4	176.1	-170.4	66.9	0	0	0	111.7	V97 L101 V110 I112 N116 E118 G124 I132 C136	V97-L120 HydrophobicContact CG1-CB 4.37Å; V97-L120 HydrophobicContact CG1-CD1 3.8Å; L101-L120 HydrophobicContact CD2-CD1 3.58Å; L101-L120 HydrophobicContact CG-CD1 3.95Å; V110-L120 HydrophobicContact CG2-CD2 3.86Å; I112-L120 HydrophobicContact CG1-CD2 4Å; N116-L120 WeakPolarHBondContact O-CB 3.44Å; N116-L120 PolarHBondContact O-N 2.89Å; E118-L120 VanDerWaalsContact C-N 3.26Å; E118-L120 PolarHBondContact O-N 2.77Å; L120-G124 WeakPolarHBondContact O-CA 3.35Å; L120-G124 PolarHBondContact O-N 3.27Å; L120-I132 HydrophobicContact CD1-CG2 4.03Å; L120-I132 HydrophobicContact CD2-CG2 3.92Å; L120-I132 HydrophobicContact CG-CG2 3.69Å; L120-C136 WeakPolarHBondContact CD2-SG 3.07Å; L120-C136 VanDerWaalsContact CG-SG 3.59Å
121	L	92.9	Very high	91.6	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-49.2	170	-174.1	79.4	0	0	0	110.5	A117 E118 G124 D125 R133 C136 A137 L140 L155	A117-L121 WeakPolarHBondContact O-CB 3.44Å; A117-L121 PolarHBondContact O-N 3.19Å; E118-L121 WeakPolarHBondContact O-CB 3.43Å; E118-L121 PolarHBondContact O-N 2.8Å; E118-L121 VanDerWaalsContact O-N 3.11Å; L121-G124 PolarHBondContact O-N 2.63Å; L121-D125 WeakPolarHBondContact O-CB 3.35Å; L121-D125 PolarHBondContact O-N 3.32Å; L121-R133 HydrophobicContact CD1-CB 4.38Å; L121-R133 HydrophobicContact CD1-CG 3.52Å; L121-R133 WeakPolarHBondContact CD1-O 3.32Å; L121-R133 HydrophobicContact CG-CG 4.32Å; L121-C136 HydrophobicContact CB-CB 3.98Å; L121-C136 HydrophobicContact CD1-CB 3.85Å; L121-A137 HydrophobicContact CD1-CB 4.11Å; L121-L140 HydrophobicContact CD2-CD1 4.06Å; L121-L155 HydrophobicContact CD2-CD1 4.44Å; L121-L155 HydrophobicContact CD2-CD2 3.73Å; L121-L155 HydrophobicContact CD2-CG 3.86Å
122	E	91.3	Very high	91.6	Very high	85 Å²	85	51.9 Å²	51.9	40%	0.397	26%	0.257	S	S	.	.	H	α-helix	trans	-58.2	-50.8	179	-66.6	179.8	173.2	0	0	111.6	E118 D125 M126 L155 H159	E118-E122 WeakPolarHBondContact O-CG 3.48Å; E118-E122 PolarHBondContact O-N 3.25Å; E122-D125 PolarHBondContact O-N 3.19Å; E122-M126 WeakPolarHBondContact O-CB 3.47Å; E122-M126 PolarHBondContact O-N 2.86Å; E122-L155 HydrophobicContact CG-CD1 3.93Å; E122-H159 WeakPolarHBondContact CG-NE2 3.27Å
123	A	91.8	Very high	91.5	Very high	5 Å²	5	52 Å²	52	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-70.1	-35.6	-179.6	0	0	0	0	0	112.3	I93 V97 L101 S119 L127	I93-A123 HydrophobicContact CG2-CB 4.12Å; V97-A123 HydrophobicContact CG1-CB 3.63Å; L101-A123 HydrophobicContact CD1-CB 3.82Å; S119-A123 VanDerWaalsContact O-CB 3.29Å; S119-A123 WeakPolarHBondContact O-CB 3.15Å; S119-A123 PolarHBondContact O-N 3.16Å; A123-L127 WeakPolarHBondContact O-CB 3.44Å; A123-L127 PolarHBondContact O-N 2.97Å
124	G	92.2	Very high	91.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.7	-39	176.1	0	0	0	0	0	112.2	L120 L121 E128 F129	L120-G124 WeakPolarHBondContact O-CA 3.35Å; L120-G124 PolarHBondContact O-N 3.27Å; L121-G124 PolarHBondContact O-N 2.63Å; G124-E128 CarbonylContact O-C 3.53Å; G124-E128 WeakPolarHBondContact O-CA 3.47Å; G124-E128 PolarHBondContact O-N 2.9Å; G124-E128 VanDerWaalsContact O-N 3.13Å; G124-F129 PolarHBondContact O-N 2.7Å
125	D	91.3	Very high	91.6	Very high	45 Å²	45	47.9 Å²	47.9	24%	0.241	24%	0.243	C	C	.	.	H	α-helix	trans	-70.8	-48.5	174.1	-167.5	53	0	0	0	111.6	L121 E122 L127 E128 R133 H159	L121-D125 WeakPolarHBondContact O-CB 3.35Å; L121-D125 PolarHBondContact O-N 3.32Å; E122-D125 PolarHBondContact O-N 3.19Å; D125-L127 PolarHBondContact O-N 3.37Å; D125-E128 PolarHBondContact O-N 3.37Å; D125-R133 HydrophobicContact CB-CG 4.26Å; D125-R133 VanDerWaalsContact OD1-CD 3.31Å; D125-R133 WeakPolarHBondContact OD1-CD 3.15Å; D125-R133 IonicContact OD1-NH1 2.73Å; D125-R133 PolarHBondContact OD1-NH1 3.49Å; D125-H159 IonicContact OD2-CG 3.43Å; D125-H159 IonicContact OD2-ND1 3.74Å; D125-H159 PolarHBondContact OD2-ND1 3.3Å
126	M	90.4	Very high	91.9	Very high	93 Å²	93	39.4 Å²	39.4	46%	0.458	20%	0.203	S	C	.	.	H	α-helix	trans	-57.8	-43.5	179.3	-177.1	-172.4	-60.9	0	0	113.1	I93 E122 E128	I93-M126 HydrophobicContact CD1-SD 4.07Å; I93-M126 HydrophobicContact CG1-SD 4.11Å; E122-M126 WeakPolarHBondContact O-CB 3.47Å; E122-M126 PolarHBondContact O-N 2.86Å; M126-E128 VanDerWaalsContact C-N 3.32Å
127	L	91	Very high	91.9	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	9.4	179.7	-61.6	177.9	0	0	0	112.6	S68 Y70 F71 F89 I93 L98 L101 A123 D125 F129	S68-L127 WeakPolarHBondContact CB-O 3.39Å; S68-L127 PolarHBondContact OG-O 3.21Å; Y70-L127 WeakPolarHBondContact CB-O 3.12Å; Y70-L127 HydrophobicContact CD1-CD2 3.65Å; Y70-L127 HydrophobicContact CE1-CD2 3.58Å; Y70-L127 HydrophobicContact CG-CD2 4.4Å; F71-L127 HydrophobicContact CZ-CD1 4.46Å; F71-L127 HydrophobicContact CZ-CD2 4.24Å; F89-L127 HydrophobicContact CE1-CD2 3.66Å; F89-L127 HydrophobicContact CZ-CD2 3.93Å; I93-L127 HydrophobicContact CD1-CD1 3.75Å; I93-L127 HydrophobicContact CD1-CD2 4.23Å; I93-L127 HydrophobicContact CD1-CG 4.03Å; L98-L127 HydrophobicContact CD1-CD1 4.17Å; L101-L127 HydrophobicContact CD1-CD1 3.79Å; A123-L127 WeakPolarHBondContact O-CB 3.44Å; A123-L127 PolarHBondContact O-N 2.97Å; D125-L127 PolarHBondContact O-N 3.37Å; L127-F129 VanDerWaalsContact C-N 3.3Å; L127-F129 HydrophobicContact CB-CD2 3.7Å; L127-F129 HydrophobicContact CB-CE2 3.83Å; L127-F129 HydrophobicContact CD1-CE2 4.41Å; L127-F129 PolarHBondContact O-N 3.12Å
128	E	92.5	Very high	91.9	Very high	84 Å²	84	43.6 Å²	43.6	39%	0.393	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	32.7	177.8	-57.7	-176.3	169.9	0	0	115.4	R69 Y70 G124 D125 M126 Q130	R69-E128 HydrophobicContact CB-CB 4.37Å; R69-E128 WeakPolarHBondContact CB-OE2 3.44Å; Y70-E128 PolarHBondContact N-OE2 2.71Å; G124-E128 CarbonylContact O-C 3.53Å; G124-E128 WeakPolarHBondContact O-CA 3.47Å; G124-E128 PolarHBondContact O-N 2.9Å; G124-E128 VanDerWaalsContact O-N 3.13Å; D125-E128 PolarHBondContact O-N 3.37Å; M126-E128 VanDerWaalsContact C-N 3.32Å; E128-Q130 VanDerWaalsContact C-N 3.32Å; E128-Q130 PolarHBondContact O-N 3.28Å; E128-Q130 VanDerWaalsContact O-N 3.11Å
129	F	92.1	Very high	92	Very high	6 Å²	6	42 Å²	42	3%	0.026	22%	0.215	C	C	.	.			trans	-80	76.6	165.8	-72.7	-99	0	0	0	110.7	C67 F71 L101 Y104 A105 G124 L127 D131 I132 R133	C67-F129 HydrophobicContact CB-CE1 4.23Å; C67-F129 WeakPolarHBondContact SG-CE1 3.42Å; F71-F129 HydrophobicContact CD2-CE2 4.43Å; F71-F129 HydrophobicContact CE2-CE2 4.01Å; F71-F129 HydrophobicContact CE2-CZ 4.3Å; L101-F129 HydrophobicContact CD2-CD2 4.46Å; L101-F129 HydrophobicContact CD2-CG 4.38Å; Y104-F129 HydrophobicContact CD1-CD1 4.13Å; Y104-F129 HydrophobicContact CD1-CE1 4.29Å; Y104-F129 HydrophobicContact CE1-CD1 4.27Å; A105-F129 HydrophobicContact CB-CE1 4.43Å; G124-F129 PolarHBondContact O-N 2.7Å; L127-F129 VanDerWaalsContact C-N 3.3Å; L127-F129 HydrophobicContact CB-CD2 3.7Å; L127-F129 HydrophobicContact CB-CE2 3.83Å; L127-F129 HydrophobicContact CD1-CE2 4.41Å; L127-F129 PolarHBondContact O-N 3.12Å; F129-D131 VanDerWaalsContact C-N 3.33Å; F129-D131 PolarHBondContact O-N 3.21Å; F129-I132 HydrophobicContact CB-CB 4.13Å; F129-I132 HydrophobicContact CB-CD1 3.89Å; F129-I132 HydrophobicContact CB-CG1 4.17Å; F129-I132 HydrophobicContact CD1-CD1 3.75Å; F129-I132 HydrophobicContact CG-CD1 4.04Å; F129-I132 PolarHBondContact O-N 2.99Å; F129-I132 VanDerWaalsContact O-N 3.15Å; F129-R133 PolarHBondContact O-N 3.35Å
130	Q	90.4	Very high	92	Very high	82 Å²	82	40.9 Å²	40.9	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-56.7	-42.9	-174.5	-56.9	-67.1	-60.3	0	0	112.9	E128 I132 R133 D134	E128-Q130 VanDerWaalsContact C-N 3.32Å; E128-Q130 PolarHBondContact O-N 3.28Å; E128-Q130 VanDerWaalsContact O-N 3.11Å; Q130-I132 VanDerWaalsContact C-N 3.3Å; Q130-I132 PolarHBondContact O-N 3.39Å; Q130-R133 PolarHBondContact O-N 3.37Å; Q130-D134 WeakPolarHBondContact O-CB 3.4Å; Q130-D134 PolarHBondContact O-N 3.02Å
131	D	91.5	Very high	91.8	Very high	116 Å²	116	42.5 Å²	42.5	62%	0.62	22%	0.215	S	C	*	.	H	α-helix	trans	-63	-36	-179.3	-66.1	-41.7	0	0	0	112.4	Y104 F129 A135	Y104-D131 WeakPolarHBondContact OH-CB 3.36Å; F129-D131 VanDerWaalsContact C-N 3.33Å; F129-D131 PolarHBondContact O-N 3.21Å; D131-A135 WeakPolarHBondContact O-CB 3.33Å; D131-A135 PolarHBondContact O-N 3.29Å; D131-A135 VanDerWaalsContact O-N 3.12Å
132	I	92.4	Very high	91.7	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-75.6	-43.4	178.2	-59.5	177.1	0	0	0	109.9	L101 Y104 L120 F129 Q130 D134 A135 C136	L101-I132 HydrophobicContact CD2-CD1 3.32Å; L101-I132 HydrophobicContact CD2-CG2 4.1Å; Y104-I132 HydrophobicContact CD1-CD1 3.45Å; Y104-I132 VanDerWaalsContact CD1-CD1 3.45Å; Y104-I132 HydrophobicContact CD1-CG1 3.96Å; Y104-I132 HydrophobicContact CD2-CD1 4.13Å; Y104-I132 HydrophobicContact CD2-CG1 4.13Å; Y104-I132 HydrophobicContact CE1-CD1 3.89Å; Y104-I132 HydrophobicContact CE1-CG1 3.92Å; Y104-I132 HydrophobicContact CE2-CG1 4.11Å; Y104-I132 HydrophobicContact CG-CD1 3.56Å; Y104-I132 HydrophobicContact CG-CG1 4.03Å; L120-I132 HydrophobicContact CD1-CG2 4.03Å; L120-I132 HydrophobicContact CD2-CG2 3.92Å; L120-I132 HydrophobicContact CG-CG2 3.69Å; F129-I132 HydrophobicContact CB-CB 4.13Å; F129-I132 HydrophobicContact CB-CD1 3.89Å; F129-I132 HydrophobicContact CB-CG1 4.17Å; F129-I132 HydrophobicContact CD1-CD1 3.75Å; F129-I132 HydrophobicContact CG-CD1 4.04Å; F129-I132 PolarHBondContact O-N 2.99Å; F129-I132 VanDerWaalsContact O-N 3.15Å; Q130-I132 VanDerWaalsContact C-N 3.3Å; Q130-I132 PolarHBondContact O-N 3.39Å; I132-D134 VanDerWaalsContact C-N 3.3Å; I132-D134 PolarHBondContact O-N 2.87Å; I132-A135 PolarHBondContact O-N 2.99Å; I132-C136 WeakPolarHBondContact O-CB 3.48Å; I132-C136 PolarHBondContact O-N 3.4Å; I132-C136 PolarHBondContact O-SG 3.02Å
133	R	91.5	Very high	91.6	Very high	41 Å²	41	48.3 Å²	48.3	16%	0.155	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-48.7	176.1	-173.8	-163	65.6	-151.8	-9.4	110.5	L121 D125 F129 Q130 A135 C136 A137	L121-R133 HydrophobicContact CD1-CB 4.38Å; L121-R133 HydrophobicContact CD1-CG 3.52Å; L121-R133 WeakPolarHBondContact CD1-O 3.32Å; L121-R133 HydrophobicContact CG-CG 4.32Å; D125-R133 HydrophobicContact CB-CG 4.26Å; D125-R133 VanDerWaalsContact OD1-CD 3.31Å; D125-R133 WeakPolarHBondContact OD1-CD 3.15Å; D125-R133 IonicContact OD1-NH1 2.73Å; D125-R133 PolarHBondContact OD1-NH1 3.49Å; F129-R133 PolarHBondContact O-N 3.35Å; Q130-R133 PolarHBondContact O-N 3.37Å; R133-A135 VanDerWaalsContact C-N 3.35Å; R133-A135 PolarHBondContact O-N 3.26Å; R133-C136 PolarHBondContact O-N 3.02Å; R133-A137 WeakPolarHBondContact O-CB 3.38Å; R133-A137 PolarHBondContact O-N 3.13Å
134	D	91.5	Very high	91.4	Very high	89 Å²	89	49.2 Å²	49.2	48%	0.476	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-38.2	-179.2	-65.5	-3.9	0	0	0	111.5	Q130 I132 A137 E138	Q130-D134 WeakPolarHBondContact O-CB 3.4Å; Q130-D134 PolarHBondContact O-N 3.02Å; I132-D134 VanDerWaalsContact C-N 3.3Å; I132-D134 PolarHBondContact O-N 2.87Å; D134-A137 PolarHBondContact O-N 2.97Å; D134-E138 PolarHBondContact O-N 3.42Å
135	A	92.9	Very high	91.2	Very high	38 Å²	38	54.7 Å²	54.7	31%	0.314	27%	0.271	S	S	.	.	H	α-helix	trans	-66.6	-39.3	174.6	0	0	0	0	0	113.1	I112 D131 I132 R133 E138 F139	I112-A135 HydrophobicContact CD1-CB 3.89Å; D131-A135 WeakPolarHBondContact O-CB 3.33Å; D131-A135 PolarHBondContact O-N 3.29Å; D131-A135 VanDerWaalsContact O-N 3.12Å; I132-A135 PolarHBondContact O-N 2.99Å; R133-A135 VanDerWaalsContact C-N 3.35Å; R133-A135 PolarHBondContact O-N 3.26Å; A135-E138 PolarHBondContact O-N 3.27Å; A135-F139 PolarHBondContact O-N 2.85Å
136	C	93.4	Very high	90.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-43.3	175.1	-64.2	0	0	0	0	110.7	L120 L121 I132 R133 E138 F139 L140	L120-C136 WeakPolarHBondContact CD2-SG 3.07Å; L120-C136 VanDerWaalsContact CG-SG 3.59Å; L121-C136 HydrophobicContact CB-CB 3.98Å; L121-C136 HydrophobicContact CD1-CB 3.85Å; I132-C136 WeakPolarHBondContact O-CB 3.48Å; I132-C136 PolarHBondContact O-N 3.4Å; I132-C136 PolarHBondContact O-SG 3.02Å; R133-C136 PolarHBondContact O-N 3.02Å; C136-E138 VanDerWaalsContact C-N 3.35Å; C136-E138 PolarHBondContact O-N 2.83Å; C136-F139 WeakPolarHBondContact O-CB 3.48Å; C136-F139 PolarHBondContact O-N 3.41Å; C136-L140 WeakPolarHBondContact O-CG 3.18Å; C136-L140 PolarHBondContact O-N 3.11Å
137	A	91.7	Very high	90.6	Very high	10 Å²	10	55.4 Å²	55.4	8%	0.083	28%	0.283	C	S	.	.	H	α-helix	trans	-58.9	-45.7	175.1	0	0	0	0	0	111.2	L121 R133 D134 F139 L140 E141	L121-A137 HydrophobicContact CD1-CB 4.11Å; R133-A137 WeakPolarHBondContact O-CB 3.38Å; R133-A137 PolarHBondContact O-N 3.13Å; D134-A137 PolarHBondContact O-N 2.97Å; A137-F139 VanDerWaalsContact C-N 3.31Å; A137-F139 PolarHBondContact O-N 3.44Å; A137-L140 PolarHBondContact O-N 3.12Å; A137-E141 WeakPolarHBondContact O-CB 3.34Å; A137-E141 VanDerWaalsContact O-CG 3.25Å; A137-E141 WeakPolarHBondContact O-CG 3.37Å; A137-E141 PolarHBondContact O-N 3.24Å
138	E	91.9	Very high	90.4	Very high	97 Å²	97	57.9 Å²	57.9	45%	0.453	30%	0.296	S	S	.	.	H	α-helix	trans	-63	-36	176.7	-165.3	-170.6	154.9	0	0	112.6	D134 A135 C136 K142	D134-E138 PolarHBondContact O-N 3.42Å; A135-E138 PolarHBondContact O-N 3.27Å; C136-E138 VanDerWaalsContact C-N 3.35Å; C136-E138 PolarHBondContact O-N 2.83Å; E138-K142 WeakPolarHBondContact O-CG 3.41Å; E138-K142 PolarHBondContact O-N 3.14Å; E138-K142 WeakPolarHBondContact OE1-CE 3.48Å; E138-K142 IonicContact OE1-NZ 3.12Å; E138-K142 PolarHBondContact OE1-NZ 3.12Å
139	F	93.4	Very high	90.2	Very high	54 Å²	54	53.9 Å²	53.9	24%	0.237	28%	0.278	C	S	.	.	H	α-helix	trans	-67	-44.6	175.2	-179.5	-94.7	0	0	0	111.9	I112 E114 A117 A135 C136 A137 E141 K142 N143	I112-F139 HydrophobicContact CG2-CB 4.03Å; I112-F139 HydrophobicContact CG2-CD1 3.75Å; I112-F139 HydrophobicContact CG2-CD2 4.29Å; I112-F139 HydrophobicContact CG2-CE1 4.28Å; I112-F139 HydrophobicContact CG2-CG 3.76Å; E114-F139 HydrophobicContact CG-CE1 4.34Å; E114-F139 HydrophobicContact CG-CZ 4.3Å; A117-F139 HydrophobicContact CB-CD1 3.77Å; A117-F139 HydrophobicContact CB-CE1 4.08Å; A135-F139 PolarHBondContact O-N 2.85Å; C136-F139 WeakPolarHBondContact O-CB 3.48Å; C136-F139 PolarHBondContact O-N 3.41Å; A137-F139 VanDerWaalsContact C-N 3.31Å; A137-F139 PolarHBondContact O-N 3.44Å; F139-E141 VanDerWaalsContact C-N 3.34Å; F139-K142 PolarHBondContact O-N 3.27Å; F139-N143 WeakPolarHBondContact CE1-ND2 3.47Å; F139-N143 WeakPolarHBondContact CE2-ND2 3.49Å; F139-N143 WeakPolarHBondContact CZ-ND2 3.2Å; F139-N143 PolarHBondContact O-N 2.97Å; F139-N143 PolarHBondContact O-ND2 3.22Å
140	L	91.9	Very high	90	Very high	11 Å²	11	53.9 Å²	53.9	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-36.4	177.2	-68.1	173.5	0	0	0	111.9	A117 E118 L121 C136 A137 K142 N143 L144 M152 L155 L164	A117-L140 HydrophobicContact CB-CD2 3.7Å; A117-L140 HydrophobicContact CB-CG 4.12Å; E118-L140 HydrophobicContact CG-CD2 4.49Å; L121-L140 HydrophobicContact CD2-CD1 4.06Å; C136-L140 WeakPolarHBondContact O-CG 3.18Å; C136-L140 PolarHBondContact O-N 3.11Å; A137-L140 PolarHBondContact O-N 3.12Å; L140-K142 VanDerWaalsContact C-N 3.27Å; L140-K142 PolarHBondContact O-N 3.05Å; L140-N143 CarbonylContact O-C 3.47Å; L140-N143 PolarHBondContact O-N 3.31Å; L140-L144 PolarHBondContact O-N 3.47Å; L140-M152 HydrophobicContact CB-SD 4.23Å; L140-M152 HydrophobicContact CD1-SD 4.18Å; L140-M152 HydrophobicContact CD2-CE 4.07Å; L140-M152 HydrophobicContact CD2-SD 3.86Å; L140-M152 HydrophobicContact CG-SD 4.31Å; L140-L155 HydrophobicContact CD1-CD2 3.91Å; L140-L164 HydrophobicContact CB-CD1 4.3Å; L140-L164 HydrophobicContact CB-CD2 4.05Å; L140-L164 HydrophobicContact CD1-CD2 4.22Å
141	E	90.9	Very high	89.9	Confident	35 Å²	35	51.7 Å²	51.7	16%	0.164	28%	0.278	C	S	.	.	H	α-helix	trans	-58.7	-38.1	173.6	-76.3	176.2	-168.5	0	0	112.3	A137 F139 K163 L164 L167	A137-E141 WeakPolarHBondContact O-CB 3.34Å; A137-E141 VanDerWaalsContact O-CG 3.25Å; A137-E141 WeakPolarHBondContact O-CG 3.37Å; A137-E141 PolarHBondContact O-N 3.24Å; F139-E141 VanDerWaalsContact C-N 3.34Å; E141-K163 WeakPolarHBondContact OE1-CB 3.28Å; E141-K163 VanDerWaalsContact OE1-CD 3.29Å; E141-K163 WeakPolarHBondContact OE1-CD 3.29Å; E141-K163 VanDerWaalsContact OE1-CG 3.27Å; E141-K163 WeakPolarHBondContact OE1-CG 3.45Å; E141-K163 IonicContact OE1-NZ 3.26Å; E141-K163 VanDerWaalsContact OE2-CE 3.27Å; E141-K163 WeakPolarHBondContact OE2-CE 3.47Å; E141-K163 IonicContact OE2-NZ 3.24Å; E141-K163 PolarHBondContact OE2-NZ 3.41Å; E141-L164 HydrophobicContact CB-CD1 4.49Å; E141-L164 HydrophobicContact CG-CB 4.11Å; E141-L164 HydrophobicContact CG-CD1 3.83Å; E141-L167 HydrophobicContact CB-CD1 4.35Å; E141-L167 HydrophobicContact CG-CD1 4.04Å
142	K	88.8	Confident	89.8	Confident	145 Å²	145	46.4 Å²	46.4	63%	0.63	25%	0.249	S	C	*	.	H	α-helix	trans	-75.8	-25.9	179.6	-71.6	172.4	-172.7	162.4	0	113	E138 F139 L140	E138-K142 WeakPolarHBondContact O-CG 3.41Å; E138-K142 PolarHBondContact O-N 3.14Å; E138-K142 WeakPolarHBondContact OE1-CE 3.48Å; E138-K142 IonicContact OE1-NZ 3.12Å; E138-K142 PolarHBondContact OE1-NZ 3.12Å; F139-K142 PolarHBondContact O-N 3.27Å; L140-K142 VanDerWaalsContact C-N 3.27Å; L140-K142 PolarHBondContact O-N 3.05Å
143	N	89.2	Confident	89.7	Confident	61 Å²	61	46.5 Å²	46.5	33%	0.326	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	22.8	-177.5	-63.8	-57.3	0	0	0	113.1	F139 L140 H145 N148	F139-N143 WeakPolarHBondContact CE1-ND2 3.47Å; F139-N143 WeakPolarHBondContact CE2-ND2 3.49Å; F139-N143 WeakPolarHBondContact CZ-ND2 3.2Å; F139-N143 PolarHBondContact O-N 2.97Å; F139-N143 PolarHBondContact O-ND2 3.22Å; L140-N143 CarbonylContact O-C 3.47Å; L140-N143 PolarHBondContact O-N 3.31Å; N143-H145 PolarHBondContact O-N 3.24Å; N143-N148 PolarHBondContact O-ND2 3.12Å; N143-N148 VanDerWaalsContact O-ND2 3.16Å
144	L	88.9	Confident	89.6	Confident	24 Å²	24	47.7 Å²	47.7	13%	0.126	26%	0.259	C	S	.	.			trans	-71.5	127	177.5	-172.2	68.9	0	0	0	110.9	L140 C149 M152 L167 M171	L140-L144 PolarHBondContact O-N 3.47Å; L144-C149 HydrophobicContact CD1-CB 4.43Å; L144-M152 HydrophobicContact CD1-CB 3.83Å; L144-M152 HydrophobicContact CD1-CG 3.87Å; L144-L167 HydrophobicContact CD2-CB 4.07Å; L144-M171 HydrophobicContact CB-CE 4.19Å; L144-M171 HydrophobicContact CD2-CB 4.26Å; L144-M171 HydrophobicContact CD2-CE 3.6Å; L144-M171 HydrophobicContact CD2-SD 4.03Å; L144-M171 HydrophobicContact CG-CE 3.66Å; L144-M171 HydrophobicContact CG-SD 3.74Å
145	H	87.1	Confident	89.5	Confident	116 Å²	116	44.1 Å²	44.1	54%	0.537	24%	0.24	S	C	.	.			trans	-134.1	152.3	-175.9	-136	-91.1	0	0	0	111	N143 T147 N148 C149	N143-H145 PolarHBondContact O-N 3.24Å; H145-T147 PolarHBondContact O-N 3.39Å; H145-N148 WeakPolarHBondContact CA-OD1 3.33Å; H145-N148 PolarHBondContact N-OD1 3.23Å; H145-N148 PolarHBondContact O-N 3.36Å; H145-N148 VanDerWaalsContact O-N 3.1Å; H145-N148 PolarHBondContact O-OD1 3.2Å; H145-C149 WeakPolarHBondContact O-CB 3.18Å; H145-C149 PolarHBondContact O-N 3.46Å
146	P	84.2	Confident	89.4	Confident	42 Å²	42	42.4 Å²	42.4	27%	0.273	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.7	-179.3	-29.2	37.1	0	0	0	115	C149 M171 N175	P146-C149 PolarHBondContact O-SG 3.5Å; P146-M171 HydrophobicContact CG-SD 4.24Å; P146-N175 HydrophobicContact CB-CB 4.22Å
147	T	85.1	Confident	89.2	Confident	111 Å²	111	46.8 Å²	46.8	68%	0.681	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-32.3	178	48.6	0	0	0	0	113.3	H145	H145-T147 PolarHBondContact O-N 3.39Å
148	N	86.6	Confident	89	Confident	52 Å²	52	49.5 Å²	49.5	28%	0.278	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-6	-179.1	69.6	7.2	0	0	0	113.1	N143 H145 L150 G151 M152	N143-N148 PolarHBondContact O-ND2 3.12Å; N143-N148 VanDerWaalsContact O-ND2 3.16Å; H145-N148 WeakPolarHBondContact CA-OD1 3.33Å; H145-N148 PolarHBondContact N-OD1 3.23Å; H145-N148 PolarHBondContact O-N 3.36Å; H145-N148 VanDerWaalsContact O-N 3.1Å; H145-N148 PolarHBondContact O-OD1 3.2Å; N148-L150 VanDerWaalsContact C-N 3.29Å; N148-L150 PolarHBondContact O-N 3.32Å; N148-G151 PolarHBondContact O-N 3.23Å; N148-G151 VanDerWaalsContact O-N 3.1Å; N148-M152 HydrophobicContact CB-CG 4.49Å; N148-M152 WeakPolarHBondContact O-CG 3.35Å; N148-M152 PolarHBondContact O-N 3.33Å
149	C	88.8	Confident	88.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-57.5	-35.6	-170.8	66.7	0	0	0	0	114.6	L144 H145 P146 L153 M171 I179	L144-C149 HydrophobicContact CD1-CB 4.43Å; H145-C149 WeakPolarHBondContact O-CB 3.18Å; H145-C149 PolarHBondContact O-N 3.46Å; P146-C149 PolarHBondContact O-SG 3.5Å; C149-L153 VanDerWaalsContact O-CB 3.29Å; C149-L153 WeakPolarHBondContact O-CB 3.5Å; C149-L153 PolarHBondContact O-N 3.42Å; C149-M171 HydrophobicContact CB-CB 4.49Å; C149-M171 HydrophobicContact CB-CG 4.33Å; C149-M171 HydrophobicContact CB-SD 4.25Å; C149-I179 WeakPolarHBondContact SG-CD1 3.48Å
150	L	88.1	Confident	88.5	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.282	C	S	.	.	H	α-helix	trans	-69.6	-42.8	177.3	-74.7	-174.1	0	0	0	112.2	N148 L153 L154 I179 D184 F185 L188	N148-L150 VanDerWaalsContact C-N 3.29Å; N148-L150 PolarHBondContact O-N 3.32Å; L150-L153 WeakPolarHBondContact O-CB 3.48Å; L150-L153 PolarHBondContact O-N 3.37Å; L150-L154 WeakPolarHBondContact O-CG 3.16Å; L150-L154 PolarHBondContact O-N 3.4Å; L150-I179 HydrophobicContact CD1-CG2 3.38Å; L150-I179 HydrophobicContact CD2-CG2 3.82Å; L150-I179 HydrophobicContact CG-CG2 3.61Å; L150-D184 HydrophobicContact CB-CB 4.36Å; L150-D184 HydrophobicContact CD1-CB 3.86Å; L150-F185 HydrophobicContact CD1-CB 3.95Å; L150-L188 HydrophobicContact CD1-CD1 4.15Å; L150-L188 HydrophobicContact CD1-CG 4.49Å; L150-L188 HydrophobicContact CD2-CD1 3.9Å; L150-L188 HydrophobicContact CD2-CD2 4.29Å
151	G	88.1	Confident	88.3	Confident	37 Å²	37	51.9 Å²	51.9	38%	0.381	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-46.8	175	0	0	0	0	0	111	N148 L153 L154 L155	N148-G151 PolarHBondContact O-N 3.23Å; N148-G151 VanDerWaalsContact O-N 3.1Å; G151-L153 VanDerWaalsContact C-N 3.28Å; G151-L153 PolarHBondContact O-N 3.11Å; G151-L154 PolarHBondContact O-N 3.13Å; G151-L155 WeakPolarHBondContact O-CB 3.34Å; G151-L155 PolarHBondContact O-N 3.47Å
152	M	90.2	Very high	88.1	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-35.1	176.2	-63.7	-61.3	135.4	0	0	112.7	E118 L140 L144 N148 L155 S156	E118-M152 HydrophobicContact CG-CE 3.96Å; E118-M152 WeakPolarHBondContact OE1-CE 3.39Å; L140-M152 HydrophobicContact CB-SD 4.23Å; L140-M152 HydrophobicContact CD1-SD 4.18Å; L140-M152 HydrophobicContact CD2-CE 4.07Å; L140-M152 HydrophobicContact CD2-SD 3.86Å; L140-M152 HydrophobicContact CG-SD 4.31Å; L144-M152 HydrophobicContact CD1-CB 3.83Å; L144-M152 HydrophobicContact CD1-CG 3.87Å; N148-M152 HydrophobicContact CB-CG 4.49Å; N148-M152 WeakPolarHBondContact O-CG 3.35Å; N148-M152 PolarHBondContact O-N 3.33Å; M152-L155 HydrophobicContact SD-CD2 4.41Å; M152-S156 WeakPolarHBondContact O-CB 3.37Å; M152-S156 PolarHBondContact O-N 2.86Å; M152-S156 PolarHBondContact O-OG 2.76Å
153	L	89.8	Confident	88	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-45.7	175.4	-173.3	70.3	0	0	0	111.7	C149 L150 G151 S156 D157 Y165 W169 M192	C149-L153 VanDerWaalsContact O-CB 3.29Å; C149-L153 WeakPolarHBondContact O-CB 3.5Å; C149-L153 PolarHBondContact O-N 3.42Å; L150-L153 WeakPolarHBondContact O-CB 3.48Å; L150-L153 PolarHBondContact O-N 3.37Å; G151-L153 VanDerWaalsContact C-N 3.28Å; G151-L153 PolarHBondContact O-N 3.11Å; L153-S156 WeakPolarHBondContact CA-OG 3.36Å; L153-S156 PolarHBondContact O-OG 3.3Å; L153-D157 WeakPolarHBondContact O-CB 3.45Å; L153-D157 PolarHBondContact O-N 3.39Å; L153-Y165 HydrophobicContact CD1-CD2 3.59Å; L153-Y165 HydrophobicContact CD1-CE2 3.5Å; L153-Y165 HydrophobicContact CD1-CG 4.19Å; L153-Y165 HydrophobicContact CG-CD2 4.43Å; L153-Y165 HydrophobicContact CG-CE2 4.16Å; L153-W169 HydrophobicContact CD1-CB 4.09Å; L153-W169 HydrophobicContact CD1-CE3 3.96Å; L153-W169 HydrophobicContact CD2-CE3 3.86Å; L153-W169 HydrophobicContact CD2-CZ3 4.15Å; L153-M192 HydrophobicContact CD1-CE 4.25Å; L153-M192 HydrophobicContact CD2-CE 3.4Å; L153-M192 HydrophobicContact CG-CE 3.59Å
154	L	89.6	Confident	88	Confident	65 Å²	65	51.3 Å²	51.3	34%	0.34	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-43.3	176.9	-68	175.8	0	0	0	111.9	L150 G151 D157 A158 L188 P189	L150-L154 WeakPolarHBondContact O-CG 3.16Å; L150-L154 PolarHBondContact O-N 3.4Å; G151-L154 PolarHBondContact O-N 3.13Å; L154-D157 PolarHBondContact O-N 3.1Å; L154-A158 WeakPolarHBondContact O-CB 3.15Å; L154-A158 PolarHBondContact O-N 3.48Å; L154-L188 HydrophobicContact CD1-CD2 3.99Å; L154-L188 HydrophobicContact CD2-CD2 3.94Å; L154-L188 HydrophobicContact CG-CD2 4.04Å; L154-P189 HydrophobicContact CD2-CG 4.08Å
155	L	89.3	Confident	88.1	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.079	29%	0.289	C	S	.	.	H	α-helix	trans	-62.3	-44.9	178.1	-175.5	71.3	0	0	0	111.2	E118 L121 E122 L140 G151 M152 D157 A158 H159	E118-L155 HydrophobicContact CB-CD2 4.18Å; E118-L155 HydrophobicContact CG-CD2 4Å; L121-L155 HydrophobicContact CD2-CD1 4.44Å; L121-L155 HydrophobicContact CD2-CD2 3.73Å; L121-L155 HydrophobicContact CD2-CG 3.86Å; E122-L155 HydrophobicContact CG-CD1 3.93Å; L140-L155 HydrophobicContact CD1-CD2 3.91Å; G151-L155 WeakPolarHBondContact O-CB 3.34Å; G151-L155 PolarHBondContact O-N 3.47Å; M152-L155 HydrophobicContact SD-CD2 4.41Å; L155-D157 PolarHBondContact O-N 2.93Å; L155-A158 PolarHBondContact O-N 3.22Å; L155-H159 PolarHBondContact O-CD2 2.92Å; L155-H159 VanDerWaalsContact O-CD2 3.29Å; L155-H159 PolarHBondContact O-N 3.44Å
156	S	90.9	Very high	88.1	Confident	1 Å²	1	52 Å²	52	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-68.8	-32	179.3	57.8	0	0	0	0	113.5	M152 L153 Q160 C161 Y165	M152-S156 WeakPolarHBondContact O-CB 3.37Å; M152-S156 PolarHBondContact O-N 2.86Å; M152-S156 PolarHBondContact O-OG 2.76Å; L153-S156 WeakPolarHBondContact CA-OG 3.36Å; L153-S156 PolarHBondContact O-OG 3.3Å; S156-Q160 CarbonylContact O-C 3.51Å; S156-Q160 WeakPolarHBondContact O-CA 3.45Å; S156-Q160 PolarHBondContact O-N 3.29Å; S156-C161 PolarHBondContact O-N 2.79Å; S156-Y165 VanDerWaalsContact OG-CA 3.29Å; S156-Y165 WeakPolarHBondContact OG-CA 3.36Å; S156-Y165 WeakPolarHBondContact OG-CB 3.46Å
157	D	89.3	Confident	88.2	Confident	92 Å²	92	52.6 Å²	52.6	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-45.8	171.6	-172.5	59.4	0	0	0	111.2	L153 L154 L155 H159 Q160 Y165	L153-D157 WeakPolarHBondContact O-CB 3.45Å; L153-D157 PolarHBondContact O-N 3.39Å; L154-D157 PolarHBondContact O-N 3.1Å; L155-D157 PolarHBondContact O-N 2.93Å; D157-H159 PolarHBondContact O-N 3.04Å; D157-Q160 PolarHBondContact O-N 3.49Å; D157-Y165 HydrophobicContact CB-CD2 4.17Å; D157-Y165 HydrophobicContact CB-CE2 4.13Å
158	A	88	Confident	88.5	Confident	68 Å²	68	47.3 Å²	47.3	56%	0.562	26%	0.256	S	S	*	.	H	α-helix	trans	-61.4	-40.1	179	0	0	0	0	0	113.1	L154 L155	L154-A158 WeakPolarHBondContact O-CB 3.15Å; L154-A158 PolarHBondContact O-N 3.48Å; L155-A158 PolarHBondContact O-N 3.22Å
159	H	87.4	Confident	88.6	Confident	31 Å²	31	46.4 Å²	46.4	14%	0.144	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	15.4	-178.2	-63.5	-65.7	0	0	0	114.2	E122 D125 L155 D157 C161	E122-H159 WeakPolarHBondContact CG-NE2 3.27Å; D125-H159 IonicContact OD2-CG 3.43Å; D125-H159 IonicContact OD2-ND1 3.74Å; D125-H159 PolarHBondContact OD2-ND1 3.3Å; L155-H159 PolarHBondContact O-CD2 2.92Å; L155-H159 VanDerWaalsContact O-CD2 3.29Å; L155-H159 PolarHBondContact O-N 3.44Å; D157-H159 PolarHBondContact O-N 3.04Å; H159-C161 PolarHBondContact O-N 3.23Å
160	Q	86.1	Confident	88.5	Confident	167 Å²	167	52.5 Å²	52.5	78%	0.78	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	32.1	175.6	-57	-177.7	-4.8	0	0	114.4	S156 D157 T162	S156-Q160 CarbonylContact O-C 3.51Å; S156-Q160 WeakPolarHBondContact O-CA 3.45Å; S156-Q160 PolarHBondContact O-N 3.29Å; D157-Q160 PolarHBondContact O-N 3.49Å; Q160-T162 PolarHBondContact O-N 2.73Å
161	C	87.2	Confident	88.4	Confident	14 Å²	14	54.4 Å²	54.4	10%	0.095	28%	0.281	C	S	.	.			trans	-81.2	82.9	178.3	-70.6	0	0	0	0	110	S156 H159 K163 L164 Y165	S156-C161 PolarHBondContact O-N 2.79Å; H159-C161 PolarHBondContact O-N 3.23Å; C161-K163 PolarHBondContact O-N 2.93Å; C161-L164 HydrophobicContact CB-CB 4.14Å; C161-L164 PolarHBondContact O-N 2.91Å; C161-Y165 WeakPolarHBondContact O-CB 3.49Å; C161-Y165 PolarHBondContact O-N 2.86Å
162	T	87.6	Confident	88.4	Confident	105 Å²	105	52.7 Å²	52.7	64%	0.644	26%	0.263	S	S	*	.	H	α-helix	trans	-56.1	-43.9	-171.6	55.2	0	0	0	0	114.1	Q160 Y165 E166	Q160-T162 PolarHBondContact O-N 2.73Å; T162-Y165 WeakPolarHBondContact O-CB 3.34Å; T162-Y165 PolarHBondContact O-N 2.88Å; T162-E166 WeakPolarHBondContact O-CG 3.49Å; T162-E166 PolarHBondContact O-N 3Å
163	K	86.4	Confident	88.1	Confident	122 Å²	122	52.7 Å²	52.7	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-69	-45.1	-177.7	-171.6	179	171.5	-137.4	0	112.4	E141 C161 Y165 E166 L167	E141-K163 WeakPolarHBondContact OE1-CB 3.28Å; E141-K163 VanDerWaalsContact OE1-CD 3.29Å; E141-K163 WeakPolarHBondContact OE1-CD 3.29Å; E141-K163 VanDerWaalsContact OE1-CG 3.27Å; E141-K163 WeakPolarHBondContact OE1-CG 3.45Å; E141-K163 IonicContact OE1-NZ 3.26Å; E141-K163 VanDerWaalsContact OE2-CE 3.27Å; E141-K163 WeakPolarHBondContact OE2-CE 3.47Å; E141-K163 IonicContact OE2-NZ 3.24Å; E141-K163 PolarHBondContact OE2-NZ 3.41Å; C161-K163 PolarHBondContact O-N 2.93Å; K163-Y165 VanDerWaalsContact C-N 3.3Å; K163-Y165 PolarHBondContact O-N 3.04Å; K163-E166 PolarHBondContact O-N 3.06Å; K163-L167 WeakPolarHBondContact O-CG 3.46Å; K163-L167 PolarHBondContact O-N 3.5Å
164	L	89.9	Confident	87.8	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-38.7	174.4	180	60.5	0	0	0	111.3	L140 E141 C161 L167 S168	L140-L164 HydrophobicContact CB-CD1 4.3Å; L140-L164 HydrophobicContact CB-CD2 4.05Å; L140-L164 HydrophobicContact CD1-CD2 4.22Å; E141-L164 HydrophobicContact CB-CD1 4.49Å; E141-L164 HydrophobicContact CG-CB 4.11Å; E141-L164 HydrophobicContact CG-CD1 3.83Å; C161-L164 HydrophobicContact CB-CB 4.14Å; C161-L164 PolarHBondContact O-N 2.91Å; L164-L167 PolarHBondContact O-N 3.42Å; L164-S168 VanDerWaalsContact O-CB 3.25Å; L164-S168 WeakPolarHBondContact O-CB 3.29Å; L164-S168 PolarHBondContact O-N 2.92Å; L164-S168 PolarHBondContact O-OG 2.89Å
165	Y	90.4	Very high	87.5	Confident	45 Å²	45	54.2 Å²	54.2	18%	0.176	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-49.7	176.2	-179.1	-87.8	0	0	0	111.5	L153 S156 D157 C161 T162 K163 L167 S168 W169 M192	L153-Y165 HydrophobicContact CD1-CD2 3.59Å; L153-Y165 HydrophobicContact CD1-CE2 3.5Å; L153-Y165 HydrophobicContact CD1-CG 4.19Å; L153-Y165 HydrophobicContact CG-CD2 4.43Å; L153-Y165 HydrophobicContact CG-CE2 4.16Å; S156-Y165 VanDerWaalsContact OG-CA 3.29Å; S156-Y165 WeakPolarHBondContact OG-CA 3.36Å; S156-Y165 WeakPolarHBondContact OG-CB 3.46Å; D157-Y165 HydrophobicContact CB-CD2 4.17Å; D157-Y165 HydrophobicContact CB-CE2 4.13Å; C161-Y165 WeakPolarHBondContact O-CB 3.49Å; C161-Y165 PolarHBondContact O-N 2.86Å; T162-Y165 WeakPolarHBondContact O-CB 3.34Å; T162-Y165 PolarHBondContact O-N 2.88Å; K163-Y165 VanDerWaalsContact C-N 3.3Å; K163-Y165 PolarHBondContact O-N 3.04Å; Y165-L167 VanDerWaalsContact C-N 3.3Å; Y165-L167 PolarHBondContact O-N 3.2Å; Y165-S168 PolarHBondContact O-N 3.34Å; Y165-W169 HydrophobicContact CE1-CB 4.5Å; Y165-W169 WeakPolarHBondContact O-CB 3.22Å; Y165-W169 PolarHBondContact O-N 3.33Å; Y165-M192 HydrophobicContact CE2-CE 3.95Å
166	E	88.3	Confident	87.4	Confident	110 Å²	110	53.5 Å²	53.5	51%	0.514	27%	0.272	S	S	.	.	H	α-helix	trans	-61.9	-35.7	179.7	-75.8	-177.6	-173.2	0	0	113.4	T162 K163 R170	T162-E166 WeakPolarHBondContact O-CG 3.49Å; T162-E166 PolarHBondContact O-N 3Å; K163-E166 PolarHBondContact O-N 3.06Å; E166-R170 WeakPolarHBondContact O-CG 2.98Å; E166-R170 PolarHBondContact O-N 2.67Å; E166-R170 PolarHBondContact O-NE 3.39Å; E166-R170 VanDerWaalsContact O-NE 3.09Å; E166-R170 IonicContact OE2-NH2 2.95Å
167	L	86.2	Confident	87	Confident	54 Å²	54	59.2 Å²	59.2	28%	0.283	30%	0.299	S	S	.	.	H	α-helix	trans	-73.2	-46.3	177.1	-70.9	172.5	0	0	0	111.2	E141 L144 K163 L164 Y165 W169 R170 M171	E141-L167 HydrophobicContact CB-CD1 4.35Å; E141-L167 HydrophobicContact CG-CD1 4.04Å; L144-L167 HydrophobicContact CD2-CB 4.07Å; K163-L167 WeakPolarHBondContact O-CG 3.46Å; K163-L167 PolarHBondContact O-N 3.5Å; L164-L167 PolarHBondContact O-N 3.42Å; Y165-L167 VanDerWaalsContact C-N 3.3Å; Y165-L167 PolarHBondContact O-N 3.2Å; L167-W169 VanDerWaalsContact C-N 3.32Å; L167-W169 PolarHBondContact O-N 2.77Å; L167-R170 PolarHBondContact O-N 2.75Å; L167-M171 PolarHBondContact O-N 3.28Å
168	S	90.4	Very high	86.8	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.1	-44	175.6	-58.5	0	0	0	0	111.1	L164 Y165 M171 C172	L164-S168 VanDerWaalsContact O-CB 3.25Å; L164-S168 WeakPolarHBondContact O-CB 3.29Å; L164-S168 PolarHBondContact O-N 2.92Å; L164-S168 PolarHBondContact O-OG 2.89Å; Y165-S168 PolarHBondContact O-N 3.34Å; S168-M171 PolarHBondContact O-N 2.75Å; S168-C172 PolarHBondContact O-N 3.4Å; S168-C172 PolarHBondContact O-SG 3.3Å
169	W	89.8	Confident	86.7	Confident	34 Å²	34	54.9 Å²	54.9	13%	0.129	27%	0.271	C	S	.	.	H	α-helix	trans	-60.4	-48.4	177.4	-174.5	-100.6	0	0	0	112.2	L153 Y165 L167 M171 C172 L173 M192 Q195 L196	L153-W169 HydrophobicContact CD1-CB 4.09Å; L153-W169 HydrophobicContact CD1-CE3 3.96Å; L153-W169 HydrophobicContact CD2-CE3 3.86Å; L153-W169 HydrophobicContact CD2-CZ3 4.15Å; Y165-W169 HydrophobicContact CE1-CB 4.5Å; Y165-W169 WeakPolarHBondContact O-CB 3.22Å; Y165-W169 PolarHBondContact O-N 3.33Å; L167-W169 VanDerWaalsContact C-N 3.32Å; L167-W169 PolarHBondContact O-N 2.77Å; W169-M171 VanDerWaalsContact C-N 3.29Å; W169-M171 PolarHBondContact O-N 3.12Å; W169-C172 WeakPolarHBondContact O-CB 3.25Å; W169-C172 PolarHBondContact O-N 2.92Å; W169-L173 WeakPolarHBondContact O-CG 3.43Å; W169-L173 PolarHBondContact O-N 3.35Å; W169-M192 HydrophobicContact CE3-CE 4.47Å; W169-M192 HydrophobicContact CZ3-CE 4.06Å; W169-Q195 HydrophobicContact CH2-CB 3.93Å; W169-Q195 HydrophobicContact CH2-CG 3.56Å; W169-Q195 HydrophobicContact CZ2-CG 3.94Å; W169-Q195 HydrophobicContact CZ3-CG 4.45Å; W169-L196 HydrophobicContact CH2-CB 4.05Å; W169-L196 HydrophobicContact CH2-CD1 4.02Å; W169-L196 HydrophobicContact CZ2-CD1 4.35Å; W169-L196 HydrophobicContact CZ3-CD1 4.18Å
170	R	85.4	Confident	86.5	Confident	129 Å²	129	54 Å²	54	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-37.4	176.6	-79.9	-178.2	-85.4	170.6	-14.7	112.5	E166 L167 L173 S174	E166-R170 WeakPolarHBondContact O-CG 2.98Å; E166-R170 PolarHBondContact O-N 2.67Å; E166-R170 PolarHBondContact O-NE 3.39Å; E166-R170 VanDerWaalsContact O-NE 3.09Å; E166-R170 IonicContact OE2-NH2 2.95Å; L167-R170 PolarHBondContact O-N 2.75Å; R170-L173 PolarHBondContact O-N 2.88Å; R170-S174 PolarHBondContact O-N 3.27Å; R170-S174 PolarHBondContact O-OG 2.6Å; R170-S174 VanDerWaalsContact O-OG 3.12Å
171	M	86.1	Confident	86.3	Confident	45 Å²	45	53.6 Å²	53.6	22%	0.222	26%	0.264	C	S	.	.	H	α-helix	trans	-69	-37.1	175.8	-168.5	172.3	-67.7	0	0	112	L144 P146 C149 L167 S168 W169 S174 N175	L144-M171 HydrophobicContact CB-CE 4.19Å; L144-M171 HydrophobicContact CD2-CB 4.26Å; L144-M171 HydrophobicContact CD2-CE 3.6Å; L144-M171 HydrophobicContact CD2-SD 4.03Å; L144-M171 HydrophobicContact CG-CE 3.66Å; L144-M171 HydrophobicContact CG-SD 3.74Å; P146-M171 HydrophobicContact CG-SD 4.24Å; C149-M171 HydrophobicContact CB-CB 4.49Å; C149-M171 HydrophobicContact CB-CG 4.33Å; C149-M171 HydrophobicContact CB-SD 4.25Å; L167-M171 PolarHBondContact O-N 3.28Å; S168-M171 PolarHBondContact O-N 2.75Å; W169-M171 VanDerWaalsContact C-N 3.29Å; W169-M171 PolarHBondContact O-N 3.12Å; M171-S174 PolarHBondContact O-N 3.38Å; M171-S174 PolarHBondContact O-OG 3.4Å; M171-S174 VanDerWaalsContact O-OG 3.08Å; M171-N175 PolarHBondContact O-N 2.98Å; M171-N175 PolarHBondContact O-ND2 3.47Å; M171-N175 VanDerWaalsContact O-ND2 3.08Å
172	C	87.4	Confident	86.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-43.2	174.8	-68.6	0	0	0	0	111.8	S168 W169 S174 F176 I179 L196	S168-C172 PolarHBondContact O-N 3.4Å; S168-C172 PolarHBondContact O-SG 3.3Å; W169-C172 WeakPolarHBondContact O-CB 3.25Å; W169-C172 PolarHBondContact O-N 2.92Å; C172-S174 PolarHBondContact O-N 3.46Å; C172-F176 PolarHBondContact O-N 3.19Å; C172-I179 HydrophobicContact CB-CD1 4.22Å; C172-L196 HydrophobicContact CB-CD1 4.17Å
173	L	85.3	Confident	86	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-37.5	179.8	-67.7	174.1	0	0	0	113	W169 R170 L196 S199 E201 L202 E203	W169-L173 WeakPolarHBondContact O-CG 3.43Å; W169-L173 PolarHBondContact O-N 3.35Å; R170-L173 PolarHBondContact O-N 2.88Å; L173-L196 HydrophobicContact CD2-CD1 3.86Å; L173-S199 WeakPolarHBondContact CD2-OG 3.32Å; L173-E201 HydrophobicContact CD1-CB 3.79Å; L173-L202 HydrophobicContact CD2-CB 4.23Å; L173-L202 HydrophobicContact CD2-CD1 3.74Å; L173-E203 WeakPolarHBondContact O-CB 3.43Å; L173-E203 PolarHBondContact O-N 2.97Å
174	S	82.3	Confident	85.9	Confident	48 Å²	48	54.6 Å²	54.6	34%	0.336	27%	0.268	S	S	.	.	H	α-helix	trans	-77.6	-29.6	179.3	52.8	0	0	0	0	113.8	R170 M171 C172 E203	R170-S174 PolarHBondContact O-N 3.27Å; R170-S174 PolarHBondContact O-OG 2.6Å; R170-S174 VanDerWaalsContact O-OG 3.12Å; M171-S174 PolarHBondContact O-N 3.38Å; M171-S174 PolarHBondContact O-OG 3.4Å; M171-S174 VanDerWaalsContact O-OG 3.08Å; C172-S174 PolarHBondContact O-N 3.46Å; S174-E203 WeakPolarHBondContact CA-OE2 3.46Å; S174-E203 WeakPolarHBondContact CB-OE2 3.42Å
175	N	84.6	Confident	85.8	Confident	52 Å²	52	54.5 Å²	54.5	28%	0.278	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	23.5	-177	-63	-81.2	0	0	0	113.7	P146 M171 Q177 S178 I179	P146-N175 HydrophobicContact CB-CB 4.22Å; M171-N175 PolarHBondContact O-N 2.98Å; M171-N175 PolarHBondContact O-ND2 3.47Å; M171-N175 VanDerWaalsContact O-ND2 3.08Å; N175-Q177 PolarHBondContact O-N 3.14Å; N175-S178 PolarHBondContact O-N 2.88Å; N175-S178 VanDerWaalsContact O-N 3.08Å; N175-S178 PolarHBondContact O-OG 2.9Å; N175-I179 HydrophobicContact CB-CD1 4.01Å; N175-I179 HydrophobicContact CB-CG1 4.47Å; N175-I179 WeakPolarHBondContact O-CD1 3.33Å; N175-I179 WeakPolarHBondContact O-CG1 3.25Å; N175-I179 PolarHBondContact O-N 3.18Å
176	F	86.1	Confident	85.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.4	-32.6	-175.2	-177	-99.5	0	0	0	113.8	C172 S178 I179 S180 F185 L196 L197 L202 T204 V210	C172-F176 PolarHBondContact O-N 3.19Å; F176-S178 VanDerWaalsContact C-N 3.34Å; F176-S178 PolarHBondContact O-N 3.45Å; F176-I179 PolarHBondContact O-N 3.05Å; F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.44Å; F176-S180 PolarHBondContact O-N 3.14Å; F176-S180 PolarHBondContact O-OG 2.81Å; F176-F185 HydrophobicContact CE2-CE2 4.17Å; F176-F185 HydrophobicContact CE2-CZ 4.46Å; F176-L196 HydrophobicContact CD2-CD2 3.9Å; F176-L196 HydrophobicContact CD2-CG 4.42Å; F176-L196 HydrophobicContact CE2-CD2 3.78Å; F176-L196 HydrophobicContact CE2-CG 4.4Å; F176-L197 HydrophobicContact CE2-CD2 4.03Å; F176-L197 HydrophobicContact CZ-CD2 3.69Å; F176-L202 HydrophobicContact CB-CD1 3.72Å; F176-L202 HydrophobicContact CB-CG 4.23Å; F176-L202 HydrophobicContact CD1-CD1 4.35Å; F176-L202 HydrophobicContact CD1-CD2 4.1Å; F176-L202 HydrophobicContact CD1-CG 4.38Å; F176-L202 HydrophobicContact CD2-CD1 3.58Å; F176-L202 HydrophobicContact CD2-CD2 4.42Å; F176-L202 HydrophobicContact CD2-CG 4.43Å; F176-L202 HydrophobicContact CE1-CD2 4.18Å; F176-L202 HydrophobicContact CE2-CD1 4.25Å; F176-L202 HydrophobicContact CG-CD1 3.61Å; F176-L202 HydrophobicContact CG-CD2 4.19Å; F176-L202 HydrophobicContact CG-CG 4.09Å; F176-L202 HydrophobicContact CZ-CD2 4.38Å; F176-T204 HydrophobicContact CB-CG2 4.22Å; F176-T204 HydrophobicContact CD1-CG2 3.28Å; F176-T204 HydrophobicContact CE1-CG2 3.96Å; F176-T204 HydrophobicContact CG-CG2 4.08Å; F176-V210 HydrophobicContact CE1-CG2 4.15Å
177	Q	83.5	Confident	85.6	Confident	122 Å²	122	54.6 Å²	54.6	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-64.2	-33	180	-175.4	174.8	2.9	0	0	113.8	N175 S180 L209	N175-Q177 PolarHBondContact O-N 3.14Å; Q177-S180 PolarHBondContact O-OG 3.42Å; Q177-L209 HydrophobicContact CG-CD1 4.09Å
178	S	83.8	Confident	85.6	Confident	65 Å²	65	52.2 Å²	52.2	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-83.2	-38.2	174.1	53.9	0	0	0	0	111.3	N175 F176 K181	N175-S178 PolarHBondContact O-N 2.88Å; N175-S178 VanDerWaalsContact O-N 3.08Å; N175-S178 PolarHBondContact O-OG 2.9Å; F176-S178 VanDerWaalsContact C-N 3.34Å; F176-S178 PolarHBondContact O-N 3.45Å; S178-K181 PolarHBondContact O-N 2.97Å
179	I	85.8	Confident	85.5	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-68.1	-40.5	-176.3	-64.9	166.1	0	0	0	111.9	C149 L150 C172 N175 F176 K181 S182 F185	C149-I179 WeakPolarHBondContact SG-CD1 3.48Å; L150-I179 HydrophobicContact CD1-CG2 3.38Å; L150-I179 HydrophobicContact CD2-CG2 3.82Å; L150-I179 HydrophobicContact CG-CG2 3.61Å; C172-I179 HydrophobicContact CB-CD1 4.22Å; N175-I179 HydrophobicContact CB-CD1 4.01Å; N175-I179 HydrophobicContact CB-CG1 4.47Å; N175-I179 WeakPolarHBondContact O-CD1 3.33Å; N175-I179 WeakPolarHBondContact O-CG1 3.25Å; N175-I179 PolarHBondContact O-N 3.18Å; F176-I179 PolarHBondContact O-N 3.05Å; I179-K181 PolarHBondContact O-N 3.04Å; I179-S182 PolarHBondContact O-N 2.97Å; I179-S182 PolarHBondContact O-OG 3.47Å; I179-F185 HydrophobicContact CG2-CD2 4.31Å; I179-F185 WeakPolarHBondContact O-CB 3.5Å
180	S	83.6	Confident	85.4	Confident	11 Å²	11	57 Å²	57	8%	0.077	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-22.1	177	44.1	0	0	0	0	114.5	F176 Q177 S213	F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.44Å; F176-S180 PolarHBondContact O-N 3.14Å; F176-S180 PolarHBondContact O-OG 2.81Å; Q177-S180 PolarHBondContact O-OG 3.42Å; S180-S213 WeakPolarHBondContact CB-OG 3.46Å
181	K	82.8	Confident	85.5	Confident	159 Å²	159	55.6 Å²	55.6	69%	0.691	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.5	179.5	-61.2	-178.7	-179.1	-178.9	0	113.4	S178 I179	S178-K181 PolarHBondContact O-N 2.97Å; I179-K181 PolarHBondContact O-N 3.04Å
182	S	85.6	Confident	85.5	Confident	35 Å²	35	54 Å²	54	25%	0.245	28%	0.281	C	S	.	.	S	Bend	trans	-78.4	152.1	-179.4	71.8	0	0	0	0	111.2	I179 D184 F185	I179-S182 PolarHBondContact O-N 2.97Å; I179-S182 PolarHBondContact O-OG 3.47Å; S182-D184 PolarHBondContact O-N 3.19Å; S182-F185 PolarHBondContact O-N 3.44Å
183	E	83.1	Confident	85.5	Confident	148 Å²	148	54 Å²	54	69%	0.692	28%	0.281	S	S	*	.	H	α-helix	trans	-66.8	-29.9	174.9	-65.2	-172.5	174.6	0	0	111.7	F185 L186 Q187	E183-F185 PolarHBondContact O-N 3.1Å; E183-L186 WeakPolarHBondContact O-CB 3.18Å; E183-L186 PolarHBondContact O-N 3.15Å; E183-Q187 PolarHBondContact O-N 3.39Å
184	D	84.7	Confident	85.7	Confident	79 Å²	79	55 Å²	55	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-36.1	177.2	-55.4	-28.8	0	0	0	111.8	L150 S182 L186 Q187 L188	L150-D184 HydrophobicContact CB-CB 4.36Å; L150-D184 HydrophobicContact CD1-CB 3.86Å; S182-D184 PolarHBondContact O-N 3.19Å; D184-L186 VanDerWaalsContact C-N 3.3Å; D184-L186 PolarHBondContact O-N 3.07Å; D184-Q187 PolarHBondContact O-N 2.88Å; D184-L188 PolarHBondContact O-N 3.43Å
185	F	87.1	Confident	85.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.4	-37.5	176	-178.7	-98.5	0	0	0	112	L150 F176 I179 S182 E183 Q187 L188 V193 L196 W217	L150-F185 HydrophobicContact CD1-CB 3.95Å; F176-F185 HydrophobicContact CE2-CE2 4.17Å; F176-F185 HydrophobicContact CE2-CZ 4.46Å; I179-F185 HydrophobicContact CG2-CD2 4.31Å; I179-F185 WeakPolarHBondContact O-CB 3.5Å; S182-F185 PolarHBondContact O-N 3.44Å; E183-F185 PolarHBondContact O-N 3.1Å; F185-Q187 PolarHBondContact O-N 3.46Å; F185-L188 HydrophobicContact CD2-CD1 3.54Å; F185-L188 HydrophobicContact CE2-CD1 3.96Å; F185-L188 HydrophobicContact CG-CD1 4.31Å; F185-L188 WeakPolarHBondContact O-CB 3.46Å; F185-L188 PolarHBondContact O-N 3.21Å; F185-V193 HydrophobicContact CZ-CG1 4.24Å; F185-L196 HydrophobicContact CE2-CD2 3.91Å; F185-W217 HydrophobicContact CE1-CB 4.26Å
186	L	86.2	Confident	86	Confident	35 Å²	35	54.6 Å²	54.6	18%	0.183	28%	0.278	C	S	.	.	H	α-helix	trans	-68.6	-22	179	-58.2	175.8	0	0	0	112.4	E183 D184 N216 W217 Y220 R225	E183-L186 WeakPolarHBondContact O-CB 3.18Å; E183-L186 PolarHBondContact O-N 3.15Å; D184-L186 VanDerWaalsContact C-N 3.3Å; D184-L186 PolarHBondContact O-N 3.07Å; L186-N216 HydrophobicContact CD2-CB 4.23Å; L186-W217 HydrophobicContact CD2-CB 4.47Å; L186-Y220 HydrophobicContact CB-CD1 4.45Å; L186-Y220 HydrophobicContact CB-CD2 3.97Å; L186-Y220 HydrophobicContact CB-CE2 4.39Å; L186-Y220 HydrophobicContact CB-CG 4Å; L186-Y220 HydrophobicContact CD1-CD2 3.88Å; L186-Y220 HydrophobicContact CD1-CE2 4.44Å; L186-Y220 HydrophobicContact CG-CD2 4.49Å; L186-R225 VanDerWaalsContact O-CZ 3.29Å; L186-R225 PolarHBondContact O-NH1 3.01Å; L186-R225 PolarHBondContact O-NH2 3.15Å
187	Q	87	Confident	86	Confident	121 Å²	121	54.6 Å²	54.6	57%	0.565	28%	0.278	S	S	*	.	H	α-helix	trans	-88	-9.4	178.9	-61.7	-174.8	16.3	0	0	113.6	E183 D184 F185	E183-Q187 PolarHBondContact O-N 3.39Å; D184-Q187 PolarHBondContact O-N 2.88Å; F185-Q187 PolarHBondContact O-N 3.46Å
188	L	87.4	Confident	86.1	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.026	27%	0.271	C	S	.	.	S	Bend	trans	-61	146.2	-177.3	-69.6	174.8	0	0	0	113.4	L150 L154 D184 F185 V193 W217	L150-L188 HydrophobicContact CD1-CD1 4.15Å; L150-L188 HydrophobicContact CD1-CG 4.49Å; L150-L188 HydrophobicContact CD2-CD1 3.9Å; L150-L188 HydrophobicContact CD2-CD2 4.29Å; L154-L188 HydrophobicContact CD1-CD2 3.99Å; L154-L188 HydrophobicContact CD2-CD2 3.94Å; L154-L188 HydrophobicContact CG-CD2 4.04Å; D184-L188 PolarHBondContact O-N 3.43Å; F185-L188 HydrophobicContact CD2-CD1 3.54Å; F185-L188 HydrophobicContact CE2-CD1 3.96Å; F185-L188 HydrophobicContact CG-CD1 4.31Å; F185-L188 WeakPolarHBondContact O-CB 3.46Å; F185-L188 PolarHBondContact O-N 3.21Å; L188-V193 HydrophobicContact CB-CG2 3.64Å; L188-V193 HydrophobicContact CD1-CG2 4.24Å; L188-W217 PolarHBondContact O-NE1 3.2Å
189	P	88.8	Confident	86	Confident	61 Å²	61	49.5 Å²	49.5	40%	0.396	26%	0.256	S	S	.	.			trans	-69	153	172.7	30.2	-33.8	0	0	0	111	L154 D191 M192 V193	L154-P189 HydrophobicContact CD2-CG 4.08Å; P189-D191 VanDerWaalsContact C-N 3.27Å; P189-D191 PolarHBondContact O-N 3.26Å; P189-M192 HydrophobicContact CG-CB 4Å; P189-M192 HydrophobicContact CG-CG 3.69Å; P189-M192 PolarHBondContact O-N 3.35Å; P189-V193 PolarHBondContact O-N 2.91Å
190	K	87.1	Confident	85.4	Confident	73 Å²	73	52.3 Å²	52.3	32%	0.317	27%	0.269	S	S	.	.	H	α-helix	trans	-55.3	-41.4	-174.1	75.9	177.7	-172.6	162.1	0	112.9	M192 V193 V194 W217 Y228	K190-M192 VanDerWaalsContact C-N 3.32Å; K190-M192 PolarHBondContact O-N 3.04Å; K190-V193 PolarHBondContact O-N 3.16Å; K190-V194 WeakPolarHBondContact O-CG2 3.27Å; K190-V194 PolarHBondContact O-N 2.67Å; K190-W217 HydrophobicContact CB-CH2 3.8Å; K190-W217 HydrophobicContact CB-CZ2 4.23Å; K190-Y228 HydrophobicContact CD-CD1 4.02Å; K190-Y228 HydrophobicContact CD-CD2 4.47Å; K190-Y228 HydrophobicContact CD-CE1 3.67Å; K190-Y228 HydrophobicContact CD-CE2 4.18Å; K190-Y228 HydrophobicContact CD-CG 4.42Å
191	D	86.6	Confident	85	Confident	100 Å²	100	55.5 Å²	55.5	54%	0.535	28%	0.283	S	S	.	.	H	α-helix	trans	-68.1	-39.6	-170.3	-61.2	-47.4	0	0	0	109.9	P189 V194 Q195	P189-D191 VanDerWaalsContact C-N 3.27Å; P189-D191 PolarHBondContact O-N 3.26Å; D191-V194 PolarHBondContact O-N 2.93Å; D191-Q195 VanDerWaalsContact O-CB 3.27Å; D191-Q195 WeakPolarHBondContact O-CB 3.38Å; D191-Q195 PolarHBondContact O-N 3.02Å
192	M	86	Confident	84.7	Confident	12 Å²	12	48 Å²	48	6%	0.059	25%	0.25	C	C	.	.	H	α-helix	trans	-66.8	-40.3	175.2	-66.6	-61	-76.4	0	0	112.2	L153 Y165 W169 P189 K190 Q195 L196	L153-M192 HydrophobicContact CD1-CE 4.25Å; L153-M192 HydrophobicContact CD2-CE 3.4Å; L153-M192 HydrophobicContact CG-CE 3.59Å; Y165-M192 HydrophobicContact CE2-CE 3.95Å; W169-M192 HydrophobicContact CE3-CE 4.47Å; W169-M192 HydrophobicContact CZ3-CE 4.06Å; P189-M192 HydrophobicContact CG-CB 4Å; P189-M192 HydrophobicContact CG-CG 3.69Å; P189-M192 PolarHBondContact O-N 3.35Å; K190-M192 VanDerWaalsContact C-N 3.32Å; K190-M192 PolarHBondContact O-N 3.04Å; M192-Q195 PolarHBondContact O-N 3.32Å; M192-L196 VanDerWaalsContact O-CB 3.28Å; M192-L196 WeakPolarHBondContact O-CB 3.28Å; M192-L196 PolarHBondContact O-N 2.6Å
193	V	88.8	Confident	84	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-47.1	176.9	177.5	0	0	0	0	110.7	F185 L188 P189 K190 Q195 L196 L197 W217 L232	F185-V193 HydrophobicContact CZ-CG1 4.24Å; L188-V193 HydrophobicContact CB-CG2 3.64Å; L188-V193 HydrophobicContact CD1-CG2 4.24Å; P189-V193 PolarHBondContact O-N 2.91Å; K190-V193 PolarHBondContact O-N 3.16Å; V193-Q195 VanDerWaalsContact C-N 3.31Å; V193-Q195 PolarHBondContact O-N 2.84Å; V193-L196 PolarHBondContact O-N 3.32Å; V193-L197 HydrophobicContact CG1-CD1 3.71Å; V193-L197 HydrophobicContact CG1-CG 4.13Å; V193-L197 WeakPolarHBondContact O-CB 3.32Å; V193-L197 VanDerWaalsContact O-CG 3.27Å; V193-L197 WeakPolarHBondContact O-CG 3.41Å; V193-L197 PolarHBondContact O-N 3.41Å; V193-W217 HydrophobicContact CG2-CD2 4.43Å; V193-W217 HydrophobicContact CG2-CG 4.48Å; V193-W217 HydrophobicContact CG2-CZ2 4.4Å; V193-L232 HydrophobicContact CG1-CD2 3.81Å
194	V	88.3	Confident	83.4	Confident	26 Å²	26	45 Å²	45	16%	0.158	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-43.1	176.9	171.6	0	0	0	0	110.5	K190 D191 L196 S198 E231 L232 T235	K190-V194 WeakPolarHBondContact O-CG2 3.27Å; K190-V194 PolarHBondContact O-N 2.67Å; D191-V194 PolarHBondContact O-N 2.93Å; V194-L196 PolarHBondContact O-N 3.03Å; V194-S198 WeakPolarHBondContact O-CB 3.29Å; V194-S198 PolarHBondContact O-N 3.11Å; V194-S198 PolarHBondContact O-OG 2.79Å; V194-E231 HydrophobicContact CG1-CG 4.48Å; V194-E231 HydrophobicContact CG2-CG 4.25Å; V194-L232 HydrophobicContact CG2-CD2 3.81Å; V194-T235 HydrophobicContact CG1-CG2 3.99Å
195	Q	86.9	Confident	82.3	Confident	87 Å²	87	45.3 Å²	45.3	41%	0.407	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-40	177.2	-168.5	178.4	-18.2	0	0	112.2	W169 D191 M192 V193 S198 S199	W169-Q195 HydrophobicContact CH2-CB 3.93Å; W169-Q195 HydrophobicContact CH2-CG 3.56Å; W169-Q195 HydrophobicContact CZ2-CG 3.94Å; W169-Q195 HydrophobicContact CZ3-CG 4.45Å; D191-Q195 VanDerWaalsContact O-CB 3.27Å; D191-Q195 WeakPolarHBondContact O-CB 3.38Å; D191-Q195 PolarHBondContact O-N 3.02Å; M192-Q195 PolarHBondContact O-N 3.32Å; V193-Q195 VanDerWaalsContact C-N 3.31Å; V193-Q195 PolarHBondContact O-N 2.84Å; Q195-S198 WeakPolarHBondContact CA-OG 3.4Å; Q195-S198 PolarHBondContact O-OG 3.27Å; Q195-S198 VanDerWaalsContact O-OG 3.1Å; Q195-S199 PolarHBondContact O-N 3.42Å
196	L	86.9	Confident	81.5	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	24%	0.243	C	C	.	.	H	α-helix	trans	-69.6	-47	-179.9	-170.9	73.6	0	0	0	111.1	W169 C172 L173 F176 F185 M192 V193 V194 S199 L202	W169-L196 HydrophobicContact CH2-CB 4.05Å; W169-L196 HydrophobicContact CH2-CD1 4.02Å; W169-L196 HydrophobicContact CZ2-CD1 4.35Å; W169-L196 HydrophobicContact CZ3-CD1 4.18Å; C172-L196 HydrophobicContact CB-CD1 4.17Å; L173-L196 HydrophobicContact CD2-CD1 3.86Å; F176-L196 HydrophobicContact CD2-CD2 3.9Å; F176-L196 HydrophobicContact CD2-CG 4.42Å; F176-L196 HydrophobicContact CE2-CD2 3.78Å; F176-L196 HydrophobicContact CE2-CG 4.4Å; F185-L196 HydrophobicContact CE2-CD2 3.91Å; M192-L196 VanDerWaalsContact O-CB 3.28Å; M192-L196 WeakPolarHBondContact O-CB 3.28Å; M192-L196 PolarHBondContact O-N 2.6Å; V193-L196 PolarHBondContact O-N 3.32Å; V194-L196 PolarHBondContact O-N 3.03Å; L196-S199 WeakPolarHBondContact O-CB 2.88Å; L196-S199 PolarHBondContact O-N 3.28Å; L196-L202 HydrophobicContact CD1-CD1 4.44Å; L196-L202 HydrophobicContact CG-CD1 4.33Å
197	L	86	Confident	81.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-71	-30.6	-179.2	-60.7	178.6	0	0	0	112.4	F176 V193 S199 V210 A214 L232 T235 R291	F176-L197 HydrophobicContact CE2-CD2 4.03Å; F176-L197 HydrophobicContact CZ-CD2 3.69Å; V193-L197 HydrophobicContact CG1-CD1 3.71Å; V193-L197 HydrophobicContact CG1-CG 4.13Å; V193-L197 WeakPolarHBondContact O-CB 3.32Å; V193-L197 VanDerWaalsContact O-CG 3.27Å; V193-L197 WeakPolarHBondContact O-CG 3.41Å; V193-L197 PolarHBondContact O-N 3.41Å; L197-S199 VanDerWaalsContact C-N 3.33Å; L197-V210 HydrophobicContact CD2-CG1 3.66Å; L197-A214 HydrophobicContact CD1-CB 3.99Å; L197-L232 HydrophobicContact CD1-CD2 3.94Å; L197-T235 WeakPolarHBondContact CB-OG1 3.23Å; L197-R291 VanDerWaalsContact O-CZ 3.31Å; L197-R291 PolarHBondContact O-NH1 3.16Å; L197-R291 PolarHBondContact O-NH2 3.4Å
198	S	85.1	Confident	81.1	Confident	59 Å²	59	44.3 Å²	44.3	41%	0.413	22%	0.224	S	C	.	.	H	α-helix	trans	-75.2	-19.5	175.8	61.6	0	0	0	0	113.7	V194 Q195 E200	V194-S198 WeakPolarHBondContact O-CB 3.29Å; V194-S198 PolarHBondContact O-N 3.11Å; V194-S198 PolarHBondContact O-OG 2.79Å; Q195-S198 WeakPolarHBondContact CA-OG 3.4Å; Q195-S198 PolarHBondContact O-OG 3.27Å; Q195-S198 VanDerWaalsContact O-OG 3.1Å; S198-E200 PolarHBondContact O-N 3.12Å
199	S	82.6	Confident	80.9	Confident	20 Å²	20	45.9 Å²	45.9	14%	0.14	23%	0.232	C	C	.	.			trans	-60.1	126.2	-176.4	-177.6	0	0	0	0	113.3	L173 Q195 L196 L197 E201 R291	L173-S199 WeakPolarHBondContact CD2-OG 3.32Å; Q195-S199 PolarHBondContact O-N 3.42Å; L196-S199 WeakPolarHBondContact O-CB 2.88Å; L196-S199 PolarHBondContact O-N 3.28Å; L197-S199 VanDerWaalsContact C-N 3.33Å; S199-E201 PolarHBondContact O-N 2.63Å; S199-E201 PolarHBondContact OG-N 2.98Å; S199-R291 PolarHBondContact O-NH1 3.1Å
200	E	74.1	Confident	80.8	Confident	63 Å²	63	43 Å²	43	29%	0.294	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.1	174.7	-65.5	-167.6	157	0	0	113.7	S198 R289 K292	S198-E200 PolarHBondContact O-N 3.12Å; E200-R289 IonicContact OE1-CZ 2.75Å; E200-R289 IonicContact OE1-NH1 2.6Å; E200-R289 PolarHBondContact OE1-NH1 3.07Å; E200-K292 HydrophobicContact CB-CG 4.3Å; E200-K292 PolarHBondContact O-N 3.11Å
201	E	73.5	Confident	80.7	Confident	79 Å²	79	39.9 Å²	39.9	37%	0.369	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-0.4	-175.1	-70.5	179.3	-176	0	0	113.6	L173 S199 E203 K292	L173-E201 HydrophobicContact CD1-CB 3.79Å; S199-E201 PolarHBondContact O-N 2.63Å; S199-E201 PolarHBondContact OG-N 2.98Å; E201-E203 PolarHBondContact O-N 3.46Å; E201-K292 HydrophobicContact CG-CD 3.93Å; E201-K292 IonicContact OE1-NZ 3.39Å; E201-K292 PolarHBondContact OE1-NZ 3.44Å
202	L	78.2	Confident	80.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.			trans	-60.4	122.5	176	-166.2	77.9	0	0	0	110.5	L173 F176 L196 T204 V210 T293	L173-L202 HydrophobicContact CD2-CB 4.23Å; L173-L202 HydrophobicContact CD2-CD1 3.74Å; F176-L202 HydrophobicContact CB-CD1 3.72Å; F176-L202 HydrophobicContact CB-CG 4.23Å; F176-L202 HydrophobicContact CD1-CD1 4.35Å; F176-L202 HydrophobicContact CD1-CD2 4.1Å; F176-L202 HydrophobicContact CD1-CG 4.38Å; F176-L202 HydrophobicContact CD2-CD1 3.58Å; F176-L202 HydrophobicContact CD2-CD2 4.42Å; F176-L202 HydrophobicContact CD2-CG 4.43Å; F176-L202 HydrophobicContact CE1-CD2 4.18Å; F176-L202 HydrophobicContact CE2-CD1 4.25Å; F176-L202 HydrophobicContact CG-CD1 3.61Å; F176-L202 HydrophobicContact CG-CD2 4.19Å; F176-L202 HydrophobicContact CG-CG 4.09Å; F176-L202 HydrophobicContact CZ-CD2 4.38Å; L196-L202 HydrophobicContact CD1-CD1 4.44Å; L196-L202 HydrophobicContact CG-CD1 4.33Å; L202-T204 VanDerWaalsContact C-N 3.28Å; L202-T204 HydrophobicContact CD2-CG2 3.86Å; L202-T204 HydrophobicContact CG-CG2 4Å; L202-T204 PolarHBondContact O-N 3.32Å; L202-V210 HydrophobicContact CD2-CG2 3.94Å; L202-T293 PolarHBondContact O-OG1 3.39Å
203	E	70.9	Confident	80.7	Confident	111 Å²	111	38.4 Å²	38.4	52%	0.519	19%	0.19	S	C	.	.			trans	-84.5	69.2	-178.7	-55.6	-162.6	154.7	0	0	111	L173 S174 E201 T293	L173-E203 WeakPolarHBondContact O-CB 3.43Å; L173-E203 PolarHBondContact O-N 2.97Å; S174-E203 WeakPolarHBondContact CA-OE2 3.46Å; S174-E203 WeakPolarHBondContact CB-OE2 3.42Å; E201-E203 PolarHBondContact O-N 3.46Å; E203-T293 HydrophobicContact CB-CG2 4Å; E203-T293 HydrophobicContact CG-CG2 3.73Å
204	T	68.8	Low	80.7	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.055	19%	0.191	C	C	.	.			trans	-118.8	122.7	173.7	52.1	0	0	0	0	110.6	F176 L202 V210	F176-T204 HydrophobicContact CB-CG2 4.22Å; F176-T204 HydrophobicContact CD1-CG2 3.28Å; F176-T204 HydrophobicContact CE1-CG2 3.96Å; F176-T204 HydrophobicContact CG-CG2 4.08Å; L202-T204 VanDerWaalsContact C-N 3.28Å; L202-T204 HydrophobicContact CD2-CG2 3.86Å; L202-T204 HydrophobicContact CG-CG2 4Å; L202-T204 PolarHBondContact O-N 3.32Å; T204-V210 HydrophobicContact CG2-CG2 4.08Å
205	E	63	Low	80.6	Confident	86 Å²	86	37.8 Å²	37.8	40%	0.402	19%	0.186	S	C	.	.	S	Bend	trans	-75.1	-35.9	171.2	-65.2	-168.7	135.6	0	0	111.3	K316 K585 L587	E205-K316 WeakPolarHBondContact OE1-CE 3.43Å; E205-K316 IonicContact OE1-NZ 3.53Å; E205-K316 PolarHBondContact OE1-NZ 3.2Å; E205-K316 VanDerWaalsContact OE1-NZ 3.11Å; E205-K316 IonicContact OE2-NZ 2.68Å; E205-K316 PolarHBondContact OE2-NZ 3.37Å; E205-K585 IonicContact OE1-NZ 2.93Å; E205-K585 PolarHBondContact OE1-NZ 2.99Å; E205-L587 WeakPolarHBondContact O-CD1 3.1Å; E205-L587 WeakPolarHBondContact O-CD2 3.37Å
206	D	70.6	Confident	80.7	Confident	47 Å²	47	37.7 Å²	37.7	25%	0.251	19%	0.188	S	C	.	.			trans	-110	115.4	-177	-165.9	-5.6	0	0	0	111.4	R208 L209	D206-R208 PolarHBondContact O-N 3.44Å; D206-R208 VanDerWaalsContact OD1-CB 3.23Å; D206-R208 WeakPolarHBondContact OD1-CB 3.31Å; D206-R208 WeakPolarHBondContact OD1-CG 3.4Å; D206-R208 PolarHBondContact OD1-N 3.33Å; D206-R208 WeakPolarHBondContact OD2-CD 3.48Å; D206-L209 PolarHBondContact O-N 3.1Å
207	E	81.8	Confident	80.9	Confident	8 Å²	8	37.7 Å²	37.7	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-68.8	-14.4	176.3	-160.4	73.4	-171.5	0	0	111.5	L209 V210 Y211 V236 R237 L240 L241 R291	E207-L209 VanDerWaalsContact C-N 3.28Å; E207-L209 PolarHBondContact O-N 3.42Å; E207-V210 HydrophobicContact CG-CB 4.45Å; E207-V210 WeakPolarHBondContact O-CB 3.43Å; E207-V210 PolarHBondContact O-N 2.97Å; E207-Y211 PolarHBondContact O-N 3.36Å; E207-V236 HydrophobicContact CG-CG1 4.06Å; E207-R237 HydrophobicContact CG-CB 4.01Å; E207-R237 PolarHBondContact OE1-N 3.35Å; E207-L240 HydrophobicContact CB-CB 4.43Å; E207-L241 HydrophobicContact CB-CD2 4.17Å; E207-R291 IonicContact OE1-CZ 3.74Å; E207-R291 IonicContact OE1-NE 2.95Å; E207-R291 IonicContact OE1-NH2 3.57Å; E207-R291 PolarHBondContact OE1-NH2 3.38Å; E207-R291 IonicContact OE2-CZ 3.79Å; E207-R291 IonicContact OE2-NE 3.98Å; E207-R291 PolarHBondContact OE2-NE 3.24Å; E207-R291 IonicContact OE2-NH2 2.91Å
208	R	81.3	Confident	80.9	Confident	80 Å²	80	37.7 Å²	37.7	30%	0.302	19%	0.188	S	C	.	.	H	α-helix	trans	-57.6	-42.5	171.5	-68.4	174.2	175.7	176.7	-0.2	111.3	D206 V210 Y211 E212 L241 Y245	D206-R208 PolarHBondContact O-N 3.44Å; D206-R208 VanDerWaalsContact OD1-CB 3.23Å; D206-R208 WeakPolarHBondContact OD1-CB 3.31Å; D206-R208 WeakPolarHBondContact OD1-CG 3.4Å; D206-R208 PolarHBondContact OD1-N 3.33Å; D206-R208 WeakPolarHBondContact OD2-CD 3.48Å; R208-V210 VanDerWaalsContact C-N 3.28Å; R208-V210 PolarHBondContact O-N 3.27Å; R208-Y211 WeakPolarHBondContact O-CB 3.37Å; R208-Y211 PolarHBondContact O-N 2.87Å; R208-E212 WeakPolarHBondContact O-CB 3.4Å; R208-E212 WeakPolarHBondContact O-CG 3.43Å; R208-E212 PolarHBondContact O-N 2.9Å; R208-L241 VanDerWaalsContact CA-CD2 3.5Å; R208-L241 HydrophobicContact CB-CD2 4.14Å; R208-L241 HydrophobicContact CG-CD2 3.63Å; R208-L241 VanDerWaalsContact N-CD2 3.33Å; R208-Y245 HydrophobicContact CG-CD1 4.36Å; R208-Y245 HydrophobicContact CG-CE1 4.43Å
209	L	83.3	Confident	81	Confident	38 Å²	38	38.2 Å²	38.2	20%	0.199	19%	0.186	C	C	.	.	H	α-helix	trans	-61.9	-39	178	-69	173.1	0	0	0	111.5	Q177 D206 E207 S213	Q177-L209 HydrophobicContact CG-CD1 4.09Å; D206-L209 PolarHBondContact O-N 3.1Å; E207-L209 VanDerWaalsContact C-N 3.28Å; E207-L209 PolarHBondContact O-N 3.42Å; L209-S213 VanDerWaalsContact O-CB 3.28Å; L209-S213 WeakPolarHBondContact O-CB 3.27Å; L209-S213 PolarHBondContact O-N 3.23Å; L209-S213 PolarHBondContact O-OG 3.33Å
210	V	86.3	Confident	81.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-44.2	177.9	-173.8	0	0	0	0	110.3	F176 L197 L202 T204 E207 R208 A214 V236	F176-V210 HydrophobicContact CE1-CG2 4.15Å; L197-V210 HydrophobicContact CD2-CG1 3.66Å; L202-V210 HydrophobicContact CD2-CG2 3.94Å; T204-V210 HydrophobicContact CG2-CG2 4.08Å; E207-V210 HydrophobicContact CG-CB 4.45Å; E207-V210 WeakPolarHBondContact O-CB 3.43Å; E207-V210 PolarHBondContact O-N 2.97Å; R208-V210 VanDerWaalsContact C-N 3.28Å; R208-V210 PolarHBondContact O-N 3.27Å; V210-A214 PolarHBondContact O-N 3.13Å; V210-A214 VanDerWaalsContact O-N 3.07Å; V210-V236 HydrophobicContact CG1-CG2 4.14Å
211	Y	86.3	Confident	81.7	Confident	9 Å²	9	42.6 Å²	42.6	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-50.9	174.8	174.6	-99	0	0	0	112.1	E207 R208 S213 A214 I215 L233 L238 Y245 V250 I256	E207-Y211 PolarHBondContact O-N 3.36Å; R208-Y211 WeakPolarHBondContact O-CB 3.37Å; R208-Y211 PolarHBondContact O-N 2.87Å; Y211-S213 VanDerWaalsContact C-N 3.29Å; Y211-S213 PolarHBondContact O-N 2.81Å; Y211-A214 PolarHBondContact O-N 3.18Å; Y211-A214 VanDerWaalsContact O-N 3.16Å; Y211-I215 HydrophobicContact CD1-CG1 4.42Å; Y211-I215 HydrophobicContact CD2-CG1 4.38Å; Y211-I215 HydrophobicContact CE1-CG1 3.92Å; Y211-I215 HydrophobicContact CE2-CD1 4.16Å; Y211-I215 HydrophobicContact CE2-CG1 3.88Å; Y211-I215 WeakPolarHBondContact O-CG1 3.32Å; Y211-I215 PolarHBondContact O-N 3.1Å; Y211-L233 HydrophobicContact CD2-CD2 4.21Å; Y211-L233 HydrophobicContact CE2-CD2 3.91Å; Y211-L238 HydrophobicContact CD2-CD2 3.94Å; Y211-L238 HydrophobicContact CE2-CD2 4.41Å; Y211-Y245 AromaticContact CD1-CE1 3.94Å; Y211-Y245 HydrophobicContact CD1-CE1 3.94Å; Y211-Y245 HydrophobicContact CE1-CE1 4.19Å; Y211-V250 HydrophobicContact CD1-CG2 4.28Å; Y211-V250 HydrophobicContact CD2-CG2 4.5Å; Y211-V250 HydrophobicContact CE1-CG2 3.81Å; Y211-V250 HydrophobicContact CE2-CB 4.46Å; Y211-V250 HydrophobicContact CE2-CG1 3.73Å; Y211-V250 HydrophobicContact CE2-CG2 4.03Å; Y211-I256 HydrophobicContact CE2-CD1 4.16Å; Y211-I256 WeakPolarHBondContact OH-CD1 3.28Å
212	E	86.5	Confident	82.2	Confident	76 Å²	76	42.7 Å²	42.7	36%	0.355	20%	0.203	S	C	.	.	H	α-helix	trans	-59.9	-40.7	179.3	-73.5	176.1	177.5	0	0	111.4	R208 A214 I215 N216 Y245	R208-E212 WeakPolarHBondContact O-CB 3.4Å; R208-E212 WeakPolarHBondContact O-CG 3.43Å; R208-E212 PolarHBondContact O-N 2.9Å; E212-A214 PolarHBondContact O-N 2.98Å; E212-I215 PolarHBondContact O-N 3.04Å; E212-N216 VanDerWaalsContact O-CB 3.29Å; E212-N216 WeakPolarHBondContact O-CB 3.36Å; E212-N216 PolarHBondContact O-N 3.46Å; E212-N216 PolarHBondContact O-ND2 3.16Å; E212-Y245 PolarHBondContact OE1-OH 3.15Å
213	S	86.4	Confident	82.2	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.028	24%	0.238	C	C	.	.	H	α-helix	trans	-61.9	-43.8	176	-56.1	0	0	0	0	111.9	S180 L209 Y211 N216 W217	S180-S213 WeakPolarHBondContact CB-OG 3.46Å; L209-S213 VanDerWaalsContact O-CB 3.28Å; L209-S213 WeakPolarHBondContact O-CB 3.27Å; L209-S213 PolarHBondContact O-N 3.23Å; L209-S213 PolarHBondContact O-OG 3.33Å; Y211-S213 VanDerWaalsContact C-N 3.29Å; Y211-S213 PolarHBondContact O-N 2.81Å; S213-N216 PolarHBondContact O-N 3.04Å; S213-W217 WeakPolarHBondContact O-CB 3.49Å; S213-W217 PolarHBondContact O-N 3.21Å
214	A	87.9	Confident	82.8	Confident	2 Å²	2	49.3 Å²	49.3	2%	0.017	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-43.7	178.3	0	0	0	0	0	111.6	L197 V210 Y211 E212 W217 V218 V236	L197-A214 HydrophobicContact CD1-CB 3.99Å; V210-A214 PolarHBondContact O-N 3.13Å; V210-A214 VanDerWaalsContact O-N 3.07Å; Y211-A214 PolarHBondContact O-N 3.18Å; Y211-A214 VanDerWaalsContact O-N 3.16Å; E212-A214 PolarHBondContact O-N 2.98Å; A214-W217 PolarHBondContact O-N 2.97Å; A214-V218 WeakPolarHBondContact O-CG2 3.38Å; A214-V218 PolarHBondContact O-N 3.33Å; A214-V218 VanDerWaalsContact O-N 3.11Å; A214-V236 HydrophobicContact CB-CG2 4.42Å
215	I	87.3	Confident	83.6	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.062	25%	0.246	C	C	.	.	H	α-helix	trans	-67.1	-43.2	177.4	-65.3	-62.2	0	0	0	111.3	Y211 E212 W217 V218 N219 L229	Y211-I215 HydrophobicContact CD1-CG1 4.42Å; Y211-I215 HydrophobicContact CD2-CG1 4.38Å; Y211-I215 HydrophobicContact CE1-CG1 3.92Å; Y211-I215 HydrophobicContact CE2-CD1 4.16Å; Y211-I215 HydrophobicContact CE2-CG1 3.88Å; Y211-I215 WeakPolarHBondContact O-CG1 3.32Å; Y211-I215 PolarHBondContact O-N 3.1Å; E212-I215 PolarHBondContact O-N 3.04Å; I215-W217 VanDerWaalsContact C-N 3.31Å; I215-W217 PolarHBondContact O-N 3.36Å; I215-V218 PolarHBondContact O-N 3.32Å; I215-V218 VanDerWaalsContact O-N 3.16Å; I215-N219 WeakPolarHBondContact CG2-ND2 3.21Å; I215-N219 WeakPolarHBondContact O-CB 3.35Å; I215-N219 PolarHBondContact O-N 2.8Å; I215-N219 PolarHBondContact O-ND2 2.96Å; I215-L229 HydrophobicContact CD1-CD1 3.87Å
216	N	87.8	Confident	84.4	Confident	84 Å²	84	49 Å²	49	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-60.8	-40.6	176.7	-72.8	-20.6	0	0	0	111.9	L186 E212 S213 N219 Y220	L186-N216 HydrophobicContact CD2-CB 4.23Å; E212-N216 VanDerWaalsContact O-CB 3.29Å; E212-N216 WeakPolarHBondContact O-CB 3.36Å; E212-N216 PolarHBondContact O-N 3.46Å; E212-N216 PolarHBondContact O-ND2 3.16Å; S213-N216 PolarHBondContact O-N 3.04Å; N216-N219 PolarHBondContact O-N 3.24Å; N216-Y220 PolarHBondContact O-N 3.33Å; N216-Y220 VanDerWaalsContact O-N 3.12Å
217	W	90.3	Very high	85	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-40.1	174.8	-176	90.7	0	0	0	112.2	F185 L186 L188 K190 V193 S213 A214 I215 R225 Y228 L232	F185-W217 HydrophobicContact CE1-CB 4.26Å; L186-W217 HydrophobicContact CD2-CB 4.47Å; L188-W217 PolarHBondContact O-NE1 3.2Å; K190-W217 HydrophobicContact CB-CH2 3.8Å; K190-W217 HydrophobicContact CB-CZ2 4.23Å; V193-W217 HydrophobicContact CG2-CD2 4.43Å; V193-W217 HydrophobicContact CG2-CG 4.48Å; V193-W217 HydrophobicContact CG2-CZ2 4.4Å; S213-W217 WeakPolarHBondContact O-CB 3.49Å; S213-W217 PolarHBondContact O-N 3.21Å; A214-W217 PolarHBondContact O-N 2.97Å; I215-W217 VanDerWaalsContact C-N 3.31Å; I215-W217 PolarHBondContact O-N 3.36Å; W217-R225 HydrophobicContact CE3-CB 4.43Å; W217-R225 HydrophobicContact CE3-CG 4.43Å; W217-R225 HydrophobicContact CH2-CB 4.4Å; W217-R225 HydrophobicContact CH2-CG 3.9Å; W217-R225 HydrophobicContact CZ2-CG 4.43Å; W217-R225 HydrophobicContact CZ3-CB 3.93Å; W217-R225 HydrophobicContact CZ3-CG 3.89Å; W217-R225 WeakPolarHBondContact O-CD 3.36Å; W217-R225 PolarHBondContact O-NH1 3.31Å; W217-Y228 HydrophobicContact CH2-CD2 4.46Å; W217-L232 HydrophobicContact CE3-CD1 3.7Å; W217-L232 HydrophobicContact CZ3-CD1 3.76Å
218	V	86.9	Confident	85.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-40.4	175	174.8	0	0	0	0	111.4	A214 I215 Y220 D221 L222 R225 L229 L232	A214-V218 WeakPolarHBondContact O-CG2 3.38Å; A214-V218 PolarHBondContact O-N 3.33Å; A214-V218 VanDerWaalsContact O-N 3.11Å; I215-V218 PolarHBondContact O-N 3.32Å; I215-V218 VanDerWaalsContact O-N 3.16Å; V218-Y220 VanDerWaalsContact C-N 3.26Å; V218-Y220 PolarHBondContact O-N 3.21Å; V218-D221 CarbonylContact O-C 3.57Å; V218-D221 VanDerWaalsContact O-C 3.28Å; V218-D221 PolarHBondContact O-N 3.39Å; V218-L222 HydrophobicContact CG1-CD2 4.35Å; V218-L222 PolarHBondContact O-N 3.44Å; V218-R225 HydrophobicContact CG1-CB 4.39Å; V218-L229 HydrophobicContact CG2-CD1 4.26Å; V218-L232 HydrophobicContact CG2-CD1 3.63Å
219	N	86.4	Confident	85.2	Confident	69 Å²	69	49.8 Å²	49.8	37%	0.369	25%	0.25	S	S	.	.	H	α-helix	trans	-63.3	-29.6	179.9	-79.1	-25.3	0	0	0	113.4	I215 N216 D221 L255	I215-N219 WeakPolarHBondContact CG2-ND2 3.21Å; I215-N219 WeakPolarHBondContact O-CB 3.35Å; I215-N219 PolarHBondContact O-N 2.8Å; I215-N219 PolarHBondContact O-ND2 2.96Å; N216-N219 PolarHBondContact O-N 3.24Å; N219-D221 VanDerWaalsContact C-N 3.33Å; N219-D221 PolarHBondContact O-N 2.9Å; N219-L255 WeakPolarHBondContact OD1-CD1 3.06Å
220	Y	87.2	Confident	85.3	Confident	137 Å²	137	48.6 Å²	48.6	54%	0.537	25%	0.245	S	C	.	.	H	α-helix	trans	-62.9	-35.6	178.4	-174	-95.6	0	0	0	113.3	L186 N216 V218	L186-Y220 HydrophobicContact CB-CD1 4.45Å; L186-Y220 HydrophobicContact CB-CD2 3.97Å; L186-Y220 HydrophobicContact CB-CE2 4.39Å; L186-Y220 HydrophobicContact CB-CG 4Å; L186-Y220 HydrophobicContact CD1-CD2 3.88Å; L186-Y220 HydrophobicContact CD1-CE2 4.44Å; L186-Y220 HydrophobicContact CG-CD2 4.49Å; N216-Y220 PolarHBondContact O-N 3.33Å; N216-Y220 VanDerWaalsContact O-N 3.12Å; V218-Y220 VanDerWaalsContact C-N 3.26Å; V218-Y220 PolarHBondContact O-N 3.21Å
221	D	85.2	Confident	85.2	Confident	39 Å²	39	52.8 Å²	52.8	21%	0.209	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	74.9	172.4	-176	-1.4	0	0	0	110.6	V218 N219 S223 K224 R225	V218-D221 CarbonylContact O-C 3.57Å; V218-D221 VanDerWaalsContact O-C 3.28Å; V218-D221 PolarHBondContact O-N 3.39Å; N219-D221 VanDerWaalsContact C-N 3.33Å; N219-D221 PolarHBondContact O-N 2.9Å; D221-S223 PolarHBondContact O-N 3.33Å; D221-S223 VanDerWaalsContact O-N 3.12Å; D221-S223 PolarHBondContact OD1-N 2.75Å; D221-S223 PolarHBondContact OD1-OG 3.44Å; D221-K224 PolarHBondContact O-N 3.16Å; D221-K224 PolarHBondContact OD1-N 3.13Å; D221-K224 WeakPolarHBondContact OD2-CD 3.42Å; D221-R225 HydrophobicContact CB-CG 4.09Å; D221-R225 WeakPolarHBondContact O-CB 3.21Å; D221-R225 WeakPolarHBondContact O-CG 3.25Å; D221-R225 PolarHBondContact O-N 3.39Å
222	L	82.9	Confident	85.1	Confident	81 Å²	81	52.4 Å²	52.4	42%	0.424	26%	0.263	S	S	.	.	H	α-helix	trans	-54.2	-33.1	-179.9	-73.2	171.8	0	0	0	112.8	V218 H226 L255	V218-L222 HydrophobicContact CG1-CD2 4.35Å; V218-L222 PolarHBondContact O-N 3.44Å; L222-H226 WeakPolarHBondContact O-CB 3.41Å; L222-H226 PolarHBondContact O-N 3Å; L222-L255 HydrophobicContact CD2-CD1 4.26Å; L222-L255 HydrophobicContact CD2-CD2 3.96Å
223	S	80.2	Confident	85	Confident	104 Å²	104	48.9 Å²	48.9	73%	0.727	25%	0.247	S	C	*	.	H	α-helix	trans	-68.5	-42.4	-173.1	72.6	0	0	0	0	112.6	D221	D221-S223 PolarHBondContact O-N 3.33Å; D221-S223 VanDerWaalsContact O-N 3.12Å; D221-S223 PolarHBondContact OD1-N 2.75Å; D221-S223 PolarHBondContact OD1-OG 3.44Å
224	K	83	Confident	84.8	Confident	146 Å²	146	55.3 Å²	55.3	64%	0.635	28%	0.276	S	S	*	.	H	α-helix	trans	-97.4	-28.7	-179	-61.9	-177.9	-169.1	163.2	0	113	D221 C227 Y228	D221-K224 PolarHBondContact O-N 3.16Å; D221-K224 PolarHBondContact OD1-N 3.13Å; D221-K224 WeakPolarHBondContact OD2-CD 3.42Å; K224-C227 PolarHBondContact O-SG 3.18Å; K224-Y228 WeakPolarHBondContact O-CE2 3.08Å
225	R	85.8	Confident	84.5	Confident	29 Å²	29	56.2 Å²	56.2	11%	0.109	28%	0.281	C	S	.	.	H	α-helix	trans	-93.2	-17	-169.3	-60	177.6	-178.9	-176	-2.8	114.3	L186 W217 V218 D221 C227 Y228	L186-R225 VanDerWaalsContact O-CZ 3.29Å; L186-R225 PolarHBondContact O-NH1 3.01Å; L186-R225 PolarHBondContact O-NH2 3.15Å; W217-R225 HydrophobicContact CE3-CB 4.43Å; W217-R225 HydrophobicContact CE3-CG 4.43Å; W217-R225 HydrophobicContact CH2-CB 4.4Å; W217-R225 HydrophobicContact CH2-CG 3.9Å; W217-R225 HydrophobicContact CZ2-CG 4.43Å; W217-R225 HydrophobicContact CZ3-CB 3.93Å; W217-R225 HydrophobicContact CZ3-CG 3.89Å; W217-R225 WeakPolarHBondContact O-CD 3.36Å; W217-R225 PolarHBondContact O-NH1 3.31Å; V218-R225 HydrophobicContact CG1-CB 4.39Å; D221-R225 HydrophobicContact CB-CG 4.09Å; D221-R225 WeakPolarHBondContact O-CB 3.21Å; D221-R225 WeakPolarHBondContact O-CG 3.25Å; D221-R225 PolarHBondContact O-N 3.39Å; R225-C227 PolarHBondContact O-N 3.09Å; R225-C227 VanDerWaalsContact O-N 3.12Å; R225-Y228 PolarHBondContact O-N 3.21Å
226	H	79.7	Confident	84.3	Confident	59 Å²	59	55.8 Å²	55.8	27%	0.273	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-56.5	-30.5	178.9	-178.7	-80.5	0	0	0	113.2	L222 Y228 L229 Q259	L222-H226 WeakPolarHBondContact O-CB 3.41Å; L222-H226 PolarHBondContact O-N 3Å; H226-Y228 VanDerWaalsContact C-N 3.28Å; H226-Y228 PolarHBondContact O-N 3.34Å; H226-L229 PolarHBondContact O-N 3.24Å; H226-Q259 PolarHBondContact O-OE1 3.12Å
227	C	82.9	Confident	83.9	Confident	74 Å²	74	52.4 Å²	52.4	50%	0.5	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-68.3	-24.5	177.6	61.2	0	0	0	0	113.8	K224 R225 P230	K224-C227 PolarHBondContact O-SG 3.18Å; R225-C227 PolarHBondContact O-N 3.09Å; R225-C227 VanDerWaalsContact O-N 3.12Å; C227-P230 WeakPolarHBondContact O-CD 3.44Å
228	Y	83.4	Confident	83.3	Confident	76 Å²	76	52.2 Å²	52.2	30%	0.298	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-90.2	-6.5	-177.3	-53.2	-57.2	0	0	0	113.6	K190 W217 K224 R225 H226 P230 E231 L232	K190-Y228 HydrophobicContact CD-CD1 4.02Å; K190-Y228 HydrophobicContact CD-CD2 4.47Å; K190-Y228 HydrophobicContact CD-CE1 3.67Å; K190-Y228 HydrophobicContact CD-CE2 4.18Å; K190-Y228 HydrophobicContact CD-CG 4.42Å; W217-Y228 HydrophobicContact CH2-CD2 4.46Å; K224-Y228 WeakPolarHBondContact O-CE2 3.08Å; R225-Y228 PolarHBondContact O-N 3.21Å; H226-Y228 VanDerWaalsContact C-N 3.28Å; H226-Y228 PolarHBondContact O-N 3.34Å; Y228-P230 VanDerWaalsContact C-CD 3.43Å; Y228-E231 WeakPolarHBondContact O-CB 3.27Å; Y228-E231 PolarHBondContact O-N 2.86Å; Y228-E231 VanDerWaalsContact O-N 3.13Å; Y228-L232 PolarHBondContact O-N 3.32Å; Y228-L232 VanDerWaalsContact O-N 3.11Å
229	L	84.6	Confident	82.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-53.1	-43	-179	-179.1	64.8	0	0	0	114.1	I215 V218 H226 E231 L232 L233 L255 I256	I215-L229 HydrophobicContact CD1-CD1 3.87Å; V218-L229 HydrophobicContact CG2-CD1 4.26Å; H226-L229 PolarHBondContact O-N 3.24Å; L229-E231 VanDerWaalsContact C-N 3.32Å; L229-E231 PolarHBondContact O-N 3.29Å; L229-L232 PolarHBondContact O-N 3.48Å; L229-L233 HydrophobicContact CD1-CD1 4.12Å; L229-L233 HydrophobicContact CD1-CG 4.09Å; L229-L233 HydrophobicContact CG-CD1 3.93Å; L229-L233 HydrophobicContact CG-CG 4.33Å; L229-L233 WeakPolarHBondContact O-CB 3.17Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.42Å; L229-L233 PolarHBondContact O-N 3.23Å; L229-L255 HydrophobicContact CD2-CB 4.15Å; L229-I256 HydrophobicContact CD2-CG1 4.37Å
230	P	83.8	Confident	81.8	Confident	13 Å²	13	50.4 Å²	50.4	8%	0.084	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-36.3	179.5	-19.2	31.2	0	0	0	113	C227 Y228 L233 Q234 Q259 K261 I265	C227-P230 WeakPolarHBondContact O-CD 3.44Å; Y228-P230 VanDerWaalsContact C-CD 3.43Å; P230-L233 PolarHBondContact O-N 3.01Å; P230-Q234 WeakPolarHBondContact O-CG 3.32Å; P230-Q234 PolarHBondContact O-N 3.18Å; P230-Q234 VanDerWaalsContact O-N 3.1Å; P230-Q259 VanDerWaalsContact CG-CD 3.42Å; P230-Q259 HydrophobicContact CG-CG 4.35Å; P230-K261 HydrophobicContact CB-CB 4.16Å; P230-K261 HydrophobicContact CG-CB 4.18Å; P230-I265 HydrophobicContact CB-CD1 4.17Å
231	E	84.5	Confident	81.1	Confident	89 Å²	89	43.9 Å²	43.9	42%	0.416	22%	0.224	S	C	.	.	H	α-helix	trans	-67.8	-44.1	179.4	-172.8	172.2	-170.9	0	0	110	V194 Y228 L229 Q234 T235	V194-E231 HydrophobicContact CG1-CG 4.48Å; V194-E231 HydrophobicContact CG2-CG 4.25Å; Y228-E231 WeakPolarHBondContact O-CB 3.27Å; Y228-E231 PolarHBondContact O-N 2.86Å; Y228-E231 VanDerWaalsContact O-N 3.13Å; L229-E231 VanDerWaalsContact C-N 3.32Å; L229-E231 PolarHBondContact O-N 3.29Å; E231-Q234 PolarHBondContact O-N 2.79Å; E231-T235 PolarHBondContact O-N 2.95Å
232	L	84.8	Confident	80.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-45.9	173.5	-67.5	170.1	0	0	0	111.8	V193 V194 L197 W217 V218 Y228 L229 Q234 T235 V236	V193-L232 HydrophobicContact CG1-CD2 3.81Å; V194-L232 HydrophobicContact CG2-CD2 3.81Å; L197-L232 HydrophobicContact CD1-CD2 3.94Å; W217-L232 HydrophobicContact CE3-CD1 3.7Å; W217-L232 HydrophobicContact CZ3-CD1 3.76Å; V218-L232 HydrophobicContact CG2-CD1 3.63Å; Y228-L232 PolarHBondContact O-N 3.32Å; Y228-L232 VanDerWaalsContact O-N 3.11Å; L229-L232 PolarHBondContact O-N 3.48Å; L232-Q234 VanDerWaalsContact C-N 3.25Å; L232-Q234 PolarHBondContact O-N 2.69Å; L232-T235 WeakPolarHBondContact O-CB 3.46Å; L232-T235 PolarHBondContact O-N 2.68Å; L232-T235 PolarHBondContact O-OG1 3.31Å; L232-V236 PolarHBondContact O-N 2.95Å
233	L	83.3	Confident	80	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-29.5	179.3	-72.6	172.7	0	0	0	113.3	Y211 L229 P230 T235 V236 L238 I256 I265	Y211-L233 HydrophobicContact CD2-CD2 4.21Å; Y211-L233 HydrophobicContact CE2-CD2 3.91Å; L229-L233 HydrophobicContact CD1-CD1 4.12Å; L229-L233 HydrophobicContact CD1-CG 4.09Å; L229-L233 HydrophobicContact CG-CD1 3.93Å; L229-L233 HydrophobicContact CG-CG 4.33Å; L229-L233 WeakPolarHBondContact O-CB 3.17Å; L229-L233 VanDerWaalsContact O-CG 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.42Å; L229-L233 PolarHBondContact O-N 3.23Å; P230-L233 PolarHBondContact O-N 3.01Å; L233-T235 VanDerWaalsContact C-N 3.29Å; L233-V236 PolarHBondContact O-N 3.01Å; L233-L238 HydrophobicContact CD2-CD2 4.48Å; L233-I256 HydrophobicContact CD1-CD1 4.34Å; L233-I256 HydrophobicContact CD1-CG1 4.26Å; L233-I256 HydrophobicContact CD2-CD1 4.41Å; L233-I265 HydrophobicContact CB-CG2 4.43Å
234	Q	82.9	Confident	79.8	Confident	139 Å²	139	39 Å²	39	65%	0.65	19%	0.192	S	C	*	.	H	α-helix	trans	-69	-28.2	172.9	-74.2	177.6	3.3	0	0	112.8	P230 E231 L232 I265	P230-Q234 WeakPolarHBondContact O-CG 3.32Å; P230-Q234 PolarHBondContact O-N 3.18Å; P230-Q234 VanDerWaalsContact O-N 3.1Å; E231-Q234 PolarHBondContact O-N 2.79Å; L232-Q234 VanDerWaalsContact C-N 3.25Å; L232-Q234 PolarHBondContact O-N 2.69Å; Q234-I265 HydrophobicContact CG-CD1 3.64Å; Q234-I265 HydrophobicContact CG-CG1 4.17Å
235	T	81.8	Confident	79.5	Confident	21 Å²	21	33.7 Å²	33.7	13%	0.129	17%	0.168	C	C	.	.	H	α-helix	trans	-76.2	-27	176	69.4	0	0	0	0	112.9	V194 L197 E231 L232 L233	V194-T235 HydrophobicContact CG1-CG2 3.99Å; L197-T235 WeakPolarHBondContact CB-OG1 3.23Å; E231-T235 PolarHBondContact O-N 2.95Å; L232-T235 WeakPolarHBondContact O-CB 3.46Å; L232-T235 PolarHBondContact O-N 2.68Å; L232-T235 PolarHBondContact O-OG1 3.31Å; L233-T235 VanDerWaalsContact C-N 3.29Å
236	V	83.1	Confident	79.2	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	16%	0.163	C	C	.	.	S	Bend	trans	-79.9	133.2	179	-177.2	0	0	0	0	110.3	E207 V210 A214 L232 L233 L238	E207-V236 HydrophobicContact CG-CG1 4.06Å; V210-V236 HydrophobicContact CG1-CG2 4.14Å; A214-V236 HydrophobicContact CB-CG2 4.42Å; L232-V236 PolarHBondContact O-N 2.95Å; L233-V236 PolarHBondContact O-N 3.01Å; V236-L238 HydrophobicContact CB-CD2 4.31Å; V236-L238 HydrophobicContact CB-CG 4.46Å; V236-L238 HydrophobicContact CG1-CD2 3.84Å; V236-L238 HydrophobicContact CG1-CG 4.31Å; V236-L238 PolarHBondContact O-N 3.42Å
237	R	79.3	Confident	79	Confident	13 Å²	13	33.6 Å²	33.6	5%	0.049	17%	0.17	C	C	.	.			trans	-83.5	68.2	179.8	-62	152.4	-168.7	-134.7	6.8	110.7	E207 A239 L240 C287 R289 P290 R291	E207-R237 HydrophobicContact CG-CB 4.01Å; E207-R237 PolarHBondContact OE1-N 3.35Å; R237-A239 PolarHBondContact O-N 3.35Å; R237-A239 VanDerWaalsContact O-N 3.08Å; R237-L240 HydrophobicContact CB-CB 4.42Å; R237-L240 HydrophobicContact CB-CD1 3.63Å; R237-L240 HydrophobicContact CB-CG 4.03Å; R237-L240 HydrophobicContact CG-CD1 4.31Å; R237-L240 WeakPolarHBondContact O-CB 3.35Å; R237-L240 PolarHBondContact O-N 3.13Å; R237-C287 CarbonylContact C-O 3.56Å; R237-R289 WeakPolarHBondContact CD-O 3.41Å; R237-R289 PolarHBondContact NH1-O 3.15Å; R237-P290 PolarHBondContact NH1-O 3.44Å; R237-R291 VanDerWaalsContact NH1-CG 3.3Å
238	L	77.6	Confident	78.7	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-55	-30.3	-172.7	-65.9	173.8	0	0	0	114.1	Y211 L233 V236 L240 L241 L246 V250 I265 V266	Y211-L238 HydrophobicContact CD2-CD2 3.94Å; Y211-L238 HydrophobicContact CE2-CD2 4.41Å; L233-L238 HydrophobicContact CD2-CD2 4.48Å; V236-L238 HydrophobicContact CB-CD2 4.31Å; V236-L238 HydrophobicContact CB-CG 4.46Å; V236-L238 HydrophobicContact CG1-CD2 3.84Å; V236-L238 HydrophobicContact CG1-CG 4.31Å; V236-L238 PolarHBondContact O-N 3.42Å; L238-L240 PolarHBondContact O-N 3.32Å; L238-L241 HydrophobicContact CD2-CD1 3.7Å; L238-L241 WeakPolarHBondContact O-CB 3.39Å; L238-L241 PolarHBondContact O-N 2.89Å; L238-L241 VanDerWaalsContact O-N 3.16Å; L238-L246 HydrophobicContact CB-CD1 4.18Å; L238-V250 HydrophobicContact CD2-CG1 4.41Å; L238-I265 HydrophobicContact CD1-CG2 4.05Å; L238-V266 HydrophobicContact CD1-CG2 4.01Å
239	A	69.8	Low	78.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-74.1	-10	178.2	0	0	0	0	0	113.3	R237 C272 K273 I276 C287 A288	R237-A239 PolarHBondContact O-N 3.35Å; R237-A239 VanDerWaalsContact O-N 3.08Å; A239-C272 HydrophobicContact CB-CB 4.03Å; A239-K273 WeakPolarHBondContact O-CD 3.46Å; A239-K273 PolarHBondContact O-NZ 3.44Å; A239-I276 HydrophobicContact CB-CD1 4.44Å; A239-C287 HydrophobicContact CB-CB 4.43Å; A239-C287 VanDerWaalsContact CB-O 3.28Å; A239-C287 WeakPolarHBondContact CB-O 3.48Å; A239-C287 PolarHBondContact N-O 2.86Å; A239-C287 VanDerWaalsContact N-O 3.15Å; A239-A288 HydrophobicContact CB-CB 4.16Å
240	L	71.6	Confident	78.2	Confident	32 Å²	32	36.1 Å²	36.1	17%	0.168	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-86.2	-14.7	170.6	-61.1	177.3	0	0	0	112.8	E207 R237 L238 P290	E207-L240 HydrophobicContact CB-CB 4.43Å; R237-L240 HydrophobicContact CB-CB 4.42Å; R237-L240 HydrophobicContact CB-CD1 3.63Å; R237-L240 HydrophobicContact CB-CG 4.03Å; R237-L240 HydrophobicContact CG-CD1 4.31Å; R237-L240 WeakPolarHBondContact O-CB 3.35Å; R237-L240 PolarHBondContact O-N 3.13Å; L238-L240 PolarHBondContact O-N 3.32Å; L240-P290 HydrophobicContact CD1-CB 4.28Å; L240-P290 HydrophobicContact CD1-CG 4.38Å; L240-P290 HydrophobicContact CD2-CG 4.1Å
241	L	74.1	Confident	77.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-62.7	148.3	175.2	-65.6	173	0	0	0	110.7	E207 R208 L238 A243 Y245 L246 V250 K273	E207-L241 HydrophobicContact CB-CD2 4.17Å; R208-L241 VanDerWaalsContact CA-CD2 3.5Å; R208-L241 HydrophobicContact CB-CD2 4.14Å; R208-L241 HydrophobicContact CG-CD2 3.63Å; R208-L241 VanDerWaalsContact N-CD2 3.33Å; L238-L241 HydrophobicContact CD2-CD1 3.7Å; L238-L241 WeakPolarHBondContact O-CB 3.39Å; L238-L241 PolarHBondContact O-N 2.89Å; L238-L241 VanDerWaalsContact O-N 3.16Å; L241-A243 PolarHBondContact O-N 3.45Å; L241-Y245 HydrophobicContact CD1-CD1 4.46Å; L241-L246 HydrophobicContact CB-CB 4.4Å; L241-L246 HydrophobicContact CD1-CD1 4.17Å; L241-V250 HydrophobicContact CD1-CG2 4.04Å; L241-K273 WeakPolarHBondContact O-CE 3.48Å; L241-K273 PolarHBondContact O-NZ 2.8Å
242	P	72.2	Confident	77.2	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.039	20%	0.202	C	C	.	.			trans	-57.7	139.1	172.1	-34	45	0	0	0	111.7	I244 Y245 L246	P242-I244 VanDerWaalsContact C-N 3.3Å; P242-I244 PolarHBondContact O-N 2.94Å; P242-Y245 PolarHBondContact O-N 3.36Å; P242-Y245 VanDerWaalsContact O-N 3.12Å; P242-L246 PolarHBondContact O-N 2.92Å
243	A	71.3	Confident	77	Confident	17 Å²	17	42.9 Å²	42.9	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-40.5	-165.7	0	0	0	0	0	112.4	L241 L246 M247 L277	L241-A243 PolarHBondContact O-N 3.45Å; A243-L246 PolarHBondContact O-N 3Å; A243-M247 HydrophobicContact CB-CE 3.83Å; A243-M247 WeakPolarHBondContact O-CB 3.46Å; A243-M247 VanDerWaalsContact O-CE 3.23Å; A243-M247 WeakPolarHBondContact O-CE 3.48Å; A243-M247 WeakPolarHBondContact O-CG 3.33Å; A243-M247 PolarHBondContact O-N 3.16Å; A243-M247 VanDerWaalsContact O-N 3.08Å; A243-L277 HydrophobicContact CB-CD1 4.16Å
244	I	75.6	Confident	76.7	Confident	98 Å²	98	48.8 Å²	48.8	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-49.8	177.7	-58.9	171.1	0	0	0	109.9	P242 L246 M247 E248	P242-I244 VanDerWaalsContact C-N 3.3Å; P242-I244 PolarHBondContact O-N 2.94Å; I244-L246 VanDerWaalsContact C-N 3.35Å; I244-L246 PolarHBondContact O-N 3.17Å; I244-M247 PolarHBondContact O-N 3.07Å; I244-E248 HydrophobicContact CG2-CG 4.3Å; I244-E248 WeakPolarHBondContact O-CB 3.43Å; I244-E248 PolarHBondContact O-N 3.49Å
245	Y	77.9	Confident	76.4	Confident	35 Å²	35	43.1 Å²	43.1	14%	0.137	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-39.7	-179	-171.4	-92.5	0	0	0	112.5	R208 Y211 E212 L241 P242 N249 V250	R208-Y245 HydrophobicContact CG-CD1 4.36Å; R208-Y245 HydrophobicContact CG-CE1 4.43Å; Y211-Y245 AromaticContact CD1-CE1 3.94Å; Y211-Y245 HydrophobicContact CD1-CE1 3.94Å; Y211-Y245 HydrophobicContact CE1-CE1 4.19Å; E212-Y245 PolarHBondContact OE1-OH 3.15Å; L241-Y245 HydrophobicContact CD1-CD1 4.46Å; P242-Y245 PolarHBondContact O-N 3.36Å; P242-Y245 VanDerWaalsContact O-N 3.12Å; Y245-N249 HydrophobicContact CD2-CB 4.06Å; Y245-N249 HydrophobicContact CE2-CB 4.06Å; Y245-N249 HydrophobicContact CG-CB 4.33Å; Y245-N249 WeakPolarHBondContact O-CA 3.5Å; Y245-N249 VanDerWaalsContact O-CB 3.31Å; Y245-N249 WeakPolarHBondContact O-CB 3.29Å; Y245-N249 PolarHBondContact O-N 2.84Å; Y245-V250 HydrophobicContact CD1-CG2 3.88Å; Y245-V250 HydrophobicContact CE1-CG2 3.79Å; Y245-V250 PolarHBondContact O-N 3.37Å; Y245-V250 VanDerWaalsContact O-N 3.09Å
246	L	78.6	Confident	76.3	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	21%	0.213	C	C	.	.	I	π-helix	trans	-64.9	-42.3	176.8	-176.5	68.4	0	0	0	111.9	L238 L241 P242 A243 I244 V250 A251 I270 K273	L238-L246 HydrophobicContact CB-CD1 4.18Å; L241-L246 HydrophobicContact CB-CB 4.4Å; L241-L246 HydrophobicContact CD1-CD1 4.17Å; P242-L246 PolarHBondContact O-N 2.92Å; A243-L246 PolarHBondContact O-N 3Å; I244-L246 VanDerWaalsContact C-N 3.35Å; I244-L246 PolarHBondContact O-N 3.17Å; L246-V250 HydrophobicContact CD1-CB 4.13Å; L246-V250 HydrophobicContact CD1-CG1 4.19Å; L246-V250 HydrophobicContact CD1-CG2 4.39Å; L246-A251 WeakPolarHBondContact O-CB 3.37Å; L246-A251 PolarHBondContact O-N 3.38Å; L246-A251 VanDerWaalsContact O-N 3.07Å; L246-I270 HydrophobicContact CD2-CB 4.45Å; L246-I270 HydrophobicContact CD2-CG1 3.65Å; L246-I270 HydrophobicContact CG-CG1 3.84Å; L246-K273 HydrophobicContact CD2-CB 4.3Å
247	M	75.8	Confident	75.9	Confident	85 Å²	85	45.5 Å²	45.5	42%	0.419	23%	0.234	S	C	.	.	I	π-helix	trans	-81.1	-35.2	-175.7	-71.7	-174	-83.7	0	0	113.5	A243 I244	A243-M247 HydrophobicContact CB-CE 3.83Å; A243-M247 WeakPolarHBondContact O-CB 3.46Å; A243-M247 VanDerWaalsContact O-CE 3.23Å; A243-M247 WeakPolarHBondContact O-CE 3.48Å; A243-M247 WeakPolarHBondContact O-CG 3.33Å; A243-M247 PolarHBondContact O-N 3.16Å; A243-M247 VanDerWaalsContact O-N 3.08Å; I244-M247 PolarHBondContact O-N 3.07Å
248	E	78	Confident	75.9	Confident	128 Å²	128	51.4 Å²	51.4	60%	0.598	26%	0.259	S	S	*	.	I	π-helix	trans	-95.7	-38.9	-175.5	-65.3	-174.7	175.6	0	0	112.9	I244 M252	I244-E248 HydrophobicContact CG2-CG 4.3Å; I244-E248 WeakPolarHBondContact O-CB 3.43Å; I244-E248 PolarHBondContact O-N 3.49Å; E248-M252 VanDerWaalsContact O-CB 3.28Å; E248-M252 WeakPolarHBondContact O-CB 3.24Å; E248-M252 WeakPolarHBondContact O-CG 3.45Å
249	N	77.3	Confident	76.1	Confident	76 Å²	76	53.1 Å²	53.1	41%	0.406	27%	0.268	S	S	.	.	I	π-helix	trans	-96.4	-57.8	-175.8	-61	47.8	0	0	0	110.8	Y245 M252 E253	Y245-N249 HydrophobicContact CD2-CB 4.06Å; Y245-N249 HydrophobicContact CE2-CB 4.06Å; Y245-N249 HydrophobicContact CG-CB 4.33Å; Y245-N249 WeakPolarHBondContact O-CA 3.5Å; Y245-N249 VanDerWaalsContact O-CB 3.31Å; Y245-N249 WeakPolarHBondContact O-CB 3.29Å; Y245-N249 PolarHBondContact O-N 2.84Å; N249-M252 PolarHBondContact O-N 3.22Å; N249-E253 PolarHBondContact O-N 3.45Å; N249-E253 VanDerWaalsContact O-N 3.15Å
250	V	78.8	Confident	76.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.303	C	S	.	.	I	π-helix	trans	-68.6	-43	-172.8	-177.7	0	0	0	0	112	Y211 L238 L241 Y245 L246 M252 I256 V266	Y211-V250 HydrophobicContact CD1-CG2 4.28Å; Y211-V250 HydrophobicContact CD2-CG2 4.5Å; Y211-V250 HydrophobicContact CE1-CG2 3.81Å; Y211-V250 HydrophobicContact CE2-CB 4.46Å; Y211-V250 HydrophobicContact CE2-CG1 3.73Å; Y211-V250 HydrophobicContact CE2-CG2 4.03Å; L238-V250 HydrophobicContact CD2-CG1 4.41Å; L241-V250 HydrophobicContact CD1-CG2 4.04Å; Y245-V250 HydrophobicContact CD1-CG2 3.88Å; Y245-V250 HydrophobicContact CE1-CG2 3.79Å; Y245-V250 PolarHBondContact O-N 3.37Å; Y245-V250 VanDerWaalsContact O-N 3.09Å; L246-V250 HydrophobicContact CD1-CB 4.13Å; L246-V250 HydrophobicContact CD1-CG1 4.19Å; L246-V250 HydrophobicContact CD1-CG2 4.39Å; V250-M252 VanDerWaalsContact C-N 3.3Å; V250-M252 PolarHBondContact O-N 3.03Å; V250-I256 HydrophobicContact CG1-CD1 3.79Å; V250-I256 WeakPolarHBondContact O-CD1 3.34Å; V250-V266 HydrophobicContact CG1-CG1 4.29Å; V250-V266 HydrophobicContact CG1-CG2 4.04Å
251	A	74.3	Confident	77.1	Confident	31 Å²	31	67.8 Å²	67.8	26%	0.256	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-25	-179	0	0	0	0	0	113.6	L246 V266 I270	L246-A251 WeakPolarHBondContact O-CB 3.37Å; L246-A251 PolarHBondContact O-N 3.38Å; L246-A251 VanDerWaalsContact O-N 3.07Å; A251-V266 HydrophobicContact CB-CG1 4.28Å; A251-I270 HydrophobicContact CB-CD1 4.25Å
252	M	72.6	Confident	77.5	Confident	143 Å²	143	67.8 Å²	67.8	70%	0.704	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-8.9	-179.1	-62.4	-67.4	174.7	0	0	113.3	E248 N249 V250 E254	E248-M252 VanDerWaalsContact O-CB 3.28Å; E248-M252 WeakPolarHBondContact O-CB 3.24Å; E248-M252 WeakPolarHBondContact O-CG 3.45Å; N249-M252 PolarHBondContact O-N 3.22Å; V250-M252 VanDerWaalsContact C-N 3.3Å; V250-M252 PolarHBondContact O-N 3.03Å; M252-E254 PolarHBondContact O-N 3.25Å
253	E	81	Confident	78	Confident	70 Å²	70	72.4 Å²	72.4	33%	0.327	34%	0.344	S	S	.	.			trans	-58.3	128.1	-178.7	-168.2	66.2	-151.6	0	0	111.6	N249 L255 I256 T257	N249-E253 PolarHBondContact O-N 3.45Å; N249-E253 VanDerWaalsContact O-N 3.15Å; E253-L255 VanDerWaalsContact C-N 3.28Å; E253-L255 HydrophobicContact CG-CB 4.46Å; E253-L255 PolarHBondContact O-N 2.9Å; E253-I256 HydrophobicContact CB-CB 4.32Å; E253-I256 HydrophobicContact CB-CD1 4.04Å; E253-I256 HydrophobicContact CB-CG1 4.15Å; E253-I256 HydrophobicContact CG-CD1 4.43Å; E253-I256 HydrophobicContact CG-CG1 4.38Å; E253-I256 PolarHBondContact O-N 3.32Å; E253-I256 VanDerWaalsContact O-N 3.16Å; E253-T257 PolarHBondContact O-N 3.16Å; E253-T257 PolarHBondContact O-OG1 3.1Å
254	E	77.4	Confident	78.5	Confident	126 Å²	126	76.1 Å²	76.1	59%	0.589	36%	0.359	S	S	*	.	H	α-helix	trans	-61.4	-34.9	-175.4	-77.4	-162.7	-170	0	0	113.4	M252 I256 T257 K258	M252-E254 PolarHBondContact O-N 3.25Å; E254-I256 VanDerWaalsContact C-N 3.29Å; E254-I256 PolarHBondContact O-N 2.84Å; E254-T257 WeakPolarHBondContact CA-OG1 3.32Å; E254-T257 PolarHBondContact O-OG1 3.31Å; E254-T257 VanDerWaalsContact O-OG1 3.07Å; E254-K258 WeakPolarHBondContact O-CB 3.32Å; E254-K258 WeakPolarHBondContact O-CD 3.39Å; E254-K258 WeakPolarHBondContact O-CG 3.33Å; E254-K258 PolarHBondContact O-N 2.92Å; E254-K258 VanDerWaalsContact O-N 3.1Å; E254-K258 IonicContact OE2-NZ 3.83Å; E254-K258 PolarHBondContact OE2-NZ 2.61Å
255	L	76.8	Confident	78.8	Confident	20 Å²	20	72.8 Å²	72.8	11%	0.105	34%	0.341	C	S	.	.	H	α-helix	trans	-66.5	-35.3	-179.8	-62.6	173.7	0	0	0	111.6	N219 L222 L229 E253	N219-L255 WeakPolarHBondContact OD1-CD1 3.06Å; L222-L255 HydrophobicContact CD2-CD1 4.26Å; L222-L255 HydrophobicContact CD2-CD2 3.96Å; L229-L255 HydrophobicContact CD2-CB 4.15Å; E253-L255 VanDerWaalsContact C-N 3.28Å; E253-L255 HydrophobicContact CG-CB 4.46Å; E253-L255 PolarHBondContact O-N 2.9Å
256	I	78.4	Confident	79.1	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	34%	0.336	C	S	.	.	H	α-helix	trans	-79.1	-41.7	-178.9	-63.1	179.7	0	0	0	110.1	Y211 L229 L233 V250 E253 E254 K258 Q259 V266	Y211-I256 HydrophobicContact CE2-CD1 4.16Å; Y211-I256 WeakPolarHBondContact OH-CD1 3.28Å; L229-I256 HydrophobicContact CD2-CG1 4.37Å; L233-I256 HydrophobicContact CD1-CD1 4.34Å; L233-I256 HydrophobicContact CD1-CG1 4.26Å; L233-I256 HydrophobicContact CD2-CD1 4.41Å; V250-I256 HydrophobicContact CG1-CD1 3.79Å; V250-I256 WeakPolarHBondContact O-CD1 3.34Å; E253-I256 HydrophobicContact CB-CB 4.32Å; E253-I256 HydrophobicContact CB-CD1 4.04Å; E253-I256 HydrophobicContact CB-CG1 4.15Å; E253-I256 HydrophobicContact CG-CD1 4.43Å; E253-I256 HydrophobicContact CG-CG1 4.38Å; E253-I256 PolarHBondContact O-N 3.32Å; E253-I256 VanDerWaalsContact O-N 3.16Å; E254-I256 VanDerWaalsContact C-N 3.29Å; E254-I256 PolarHBondContact O-N 2.84Å; I256-K258 VanDerWaalsContact C-N 3.32Å; I256-K258 PolarHBondContact O-N 2.84Å; I256-Q259 PolarHBondContact O-N 2.98Å; I256-Q259 VanDerWaalsContact O-O 3.07Å; I256-V266 HydrophobicContact CG2-CG2 3.86Å
257	T	76	Confident	79.2	Confident	73 Å²	73	76.1 Å²	76.1	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-67.6	-30.7	179.2	52.5	0	0	0	0	113	E253 E254 Q259	E253-T257 PolarHBondContact O-N 3.16Å; E253-T257 PolarHBondContact O-OG1 3.1Å; E254-T257 WeakPolarHBondContact CA-OG1 3.32Å; E254-T257 PolarHBondContact O-OG1 3.31Å; E254-T257 VanDerWaalsContact O-OG1 3.07Å; T257-Q259 VanDerWaalsContact C-N 3.27Å; T257-Q259 PolarHBondContact O-N 2.97Å
258	K	79.2	Confident	79.4	Confident	136 Å²	136	75.7 Å²	75.7	59%	0.591	36%	0.355	S	S	*	.	H	α-helix	trans	-66.1	-25.7	174.8	-76.9	167.6	-170.1	161.4	0	113.1	E254 I256	E254-K258 WeakPolarHBondContact O-CB 3.32Å; E254-K258 WeakPolarHBondContact O-CD 3.39Å; E254-K258 WeakPolarHBondContact O-CG 3.33Å; E254-K258 PolarHBondContact O-N 2.92Å; E254-K258 VanDerWaalsContact O-N 3.1Å; E254-K258 IonicContact OE2-NZ 3.83Å; E254-K258 PolarHBondContact OE2-NZ 2.61Å; I256-K258 VanDerWaalsContact C-N 3.32Å; I256-K258 PolarHBondContact O-N 2.84Å
259	Q	82.1	Confident	79.2	Confident	37 Å²	37	69.8 Å²	69.8	17%	0.173	33%	0.328	C	S	.	.			trans	-114.4	113.4	-175.1	-166	172.6	17	0	0	112.8	H226 P230 I256 T257 K261 S262 K263	H226-Q259 PolarHBondContact O-OE1 3.12Å; P230-Q259 VanDerWaalsContact CG-CD 3.42Å; P230-Q259 HydrophobicContact CG-CG 4.35Å; I256-Q259 PolarHBondContact O-N 2.98Å; I256-Q259 VanDerWaalsContact O-O 3.07Å; T257-Q259 VanDerWaalsContact C-N 3.27Å; T257-Q259 PolarHBondContact O-N 2.97Å; Q259-K261 VanDerWaalsContact C-N 3.34Å; Q259-K261 PolarHBondContact O-N 3.26Å; Q259-S262 WeakPolarHBondContact O-CB 3.42Å; Q259-S262 PolarHBondContact O-N 3.33Å; Q259-S262 VanDerWaalsContact O-N 3.12Å; Q259-S262 PolarHBondContact OE1-OG 2.86Å; Q259-K263 PolarHBondContact O-N 3.01Å; Q259-K263 VanDerWaalsContact O-N 3.14Å
260	R	81.1	Confident	79.3	Confident	195 Å²	195	67.9 Å²	67.9	74%	0.736	32%	0.317	S	S	*	.	H	α-helix	trans	-53.1	-44.4	-177.1	-177.4	176.5	175.1	156.9	3.8	114.2	S262 K263 E264	R260-S262 PolarHBondContact O-N 2.9Å; R260-K263 PolarHBondContact O-N 2.72Å; R260-E264 WeakPolarHBondContact CG-OE1 3.47Å; R260-E264 IonicContact CZ-OE1 3.92Å; R260-E264 IonicContact NE-OE1 2.7Å; R260-E264 PolarHBondContact NE-OE1 3.29Å; R260-E264 IonicContact NH2-OE1 2.98Å; R260-E264 WeakPolarHBondContact O-CG 3.39Å; R260-E264 PolarHBondContact O-N 2.74Å
261	K	81.7	Confident	79.2	Confident	145 Å²	145	74 Å²	74	63%	0.63	34%	0.341	S	S	*	.	H	α-helix	trans	-63.4	-40.6	-179.2	-68.7	-173.8	177.7	-177.4	0	112.3	P230 Q259 K263 E264 I265	P230-K261 HydrophobicContact CB-CB 4.16Å; P230-K261 HydrophobicContact CG-CB 4.18Å; Q259-K261 VanDerWaalsContact C-N 3.34Å; Q259-K261 PolarHBondContact O-N 3.26Å; K261-K263 VanDerWaalsContact C-N 3.35Å; K261-E264 PolarHBondContact O-N 3.07Å; K261-I265 WeakPolarHBondContact O-CD1 3.29Å; K261-I265 WeakPolarHBondContact O-CG1 3.39Å; K261-I265 PolarHBondContact O-N 2.94Å
262	S	81.6	Confident	79	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.6	-41.6	177.6	-54.5	0	0	0	0	111	Q259 R260 I265 V266	Q259-S262 WeakPolarHBondContact O-CB 3.42Å; Q259-S262 PolarHBondContact O-N 3.33Å; Q259-S262 VanDerWaalsContact O-N 3.12Å; Q259-S262 PolarHBondContact OE1-OG 2.86Å; R260-S262 PolarHBondContact O-N 2.9Å; S262-I265 PolarHBondContact O-N 2.85Å; S262-V266 WeakPolarHBondContact O-CG2 3.49Å; S262-V266 PolarHBondContact O-N 3.49Å; S262-V266 VanDerWaalsContact O-N 3.11Å
263	K	82.2	Confident	78.9	Confident	103 Å²	103	66.7 Å²	66.7	45%	0.448	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-45.6	175.2	-176.7	173.3	173.9	172.2	0	112.9	Q259 R260 K261 I265 V266 E267	Q259-K263 PolarHBondContact O-N 3.01Å; Q259-K263 VanDerWaalsContact O-N 3.14Å; R260-K263 PolarHBondContact O-N 2.72Å; K261-K263 VanDerWaalsContact C-N 3.35Å; K263-I265 VanDerWaalsContact C-N 3.28Å; K263-I265 PolarHBondContact O-N 2.84Å; K263-V266 PolarHBondContact O-N 3.24Å; K263-E267 WeakPolarHBondContact CE-OE1 3Å; K263-E267 HydrophobicContact CG-CG 4.39Å; K263-E267 IonicContact NZ-OE1 2.99Å; K263-E267 WeakPolarHBondContact O-CG 3.35Å; K263-E267 PolarHBondContact O-N 3.06Å
264	E	83.3	Confident	78.4	Confident	95 Å²	95	66.8 Å²	66.8	44%	0.444	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-38	177.6	-72.5	170.6	-173	0	0	111.8	R260 K261 E268	R260-E264 WeakPolarHBondContact CG-OE1 3.47Å; R260-E264 IonicContact CZ-OE1 3.92Å; R260-E264 IonicContact NE-OE1 2.7Å; R260-E264 PolarHBondContact NE-OE1 3.29Å; R260-E264 IonicContact NH2-OE1 2.98Å; R260-E264 WeakPolarHBondContact O-CG 3.39Å; R260-E264 PolarHBondContact O-N 2.74Å; K261-E264 PolarHBondContact O-N 3.07Å; E264-E268 WeakPolarHBondContact O-CB 3.44Å; E264-E268 PolarHBondContact O-N 3.31Å
265	I	81.8	Confident	78	Confident	27 Å²	27	65 Å²	65	14%	0.138	29%	0.292	C	S	.	.	H	α-helix	trans	-67.2	-42.1	176.8	-65.6	157.4	0	0	0	111.7	P230 L233 Q234 L238 K261 S262 K263 S269	P230-I265 HydrophobicContact CB-CD1 4.17Å; L233-I265 HydrophobicContact CB-CG2 4.43Å; Q234-I265 HydrophobicContact CG-CD1 3.64Å; Q234-I265 HydrophobicContact CG-CG1 4.17Å; L238-I265 HydrophobicContact CD1-CG2 4.05Å; K261-I265 WeakPolarHBondContact O-CD1 3.29Å; K261-I265 WeakPolarHBondContact O-CG1 3.39Å; K261-I265 PolarHBondContact O-N 2.94Å; S262-I265 PolarHBondContact O-N 2.85Å; K263-I265 VanDerWaalsContact C-N 3.28Å; K263-I265 PolarHBondContact O-N 2.84Å; I265-S269 WeakPolarHBondContact O-CB 3.47Å; I265-S269 PolarHBondContact O-N 3.02Å; I265-S269 PolarHBondContact O-OG 3.26Å
266	V	82.6	Confident	77.5	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.024	30%	0.295	C	S	.	.	H	α-helix	trans	-67.8	-43.5	178.5	174.2	0	0	0	0	110.8	L238 V250 A251 I256 S262 K263 E268 S269 I270	L238-V266 HydrophobicContact CD1-CG2 4.01Å; V250-V266 HydrophobicContact CG1-CG1 4.29Å; V250-V266 HydrophobicContact CG1-CG2 4.04Å; A251-V266 HydrophobicContact CB-CG1 4.28Å; I256-V266 HydrophobicContact CG2-CG2 3.86Å; S262-V266 WeakPolarHBondContact O-CG2 3.49Å; S262-V266 PolarHBondContact O-N 3.49Å; S262-V266 VanDerWaalsContact O-N 3.11Å; K263-V266 PolarHBondContact O-N 3.24Å; V266-E268 VanDerWaalsContact C-N 3.34Å; V266-E268 PolarHBondContact O-N 3.22Å; V266-S269 WeakPolarHBondContact O-CB 3.34Å; V266-S269 PolarHBondContact O-N 2.88Å; V266-S269 VanDerWaalsContact O-N 3.13Å; V266-I270 HydrophobicContact CG1-CD1 3.93Å; V266-I270 HydrophobicContact CG1-CG1 4.42Å; V266-I270 WeakPolarHBondContact O-CG1 3.42Å; V266-I270 PolarHBondContact O-N 3.08Å
267	E	80.6	Confident	76.8	Confident	102 Å²	102	68.6 Å²	68.6	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-42.4	176	-74	177.5	177.5	0	0	111.9	K263 S269 I270 R271	K263-E267 WeakPolarHBondContact CE-OE1 3Å; K263-E267 HydrophobicContact CG-CG 4.39Å; K263-E267 IonicContact NZ-OE1 2.99Å; K263-E267 WeakPolarHBondContact O-CG 3.35Å; K263-E267 PolarHBondContact O-N 3.06Å; E267-S269 VanDerWaalsContact C-N 3.3Å; E267-S269 PolarHBondContact O-N 3.06Å; E267-I270 PolarHBondContact O-N 3.16Å; E267-R271 WeakPolarHBondContact O-CB 3.34Å; E267-R271 PolarHBondContact O-N 3.43Å
268	E	79.8	Confident	76.1	Confident	77 Å²	77	70.9 Å²	70.9	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-40.7	174.4	-175.9	59.3	-164.7	0	0	111.7	E264 V266 R271 C272	E264-E268 WeakPolarHBondContact O-CB 3.44Å; E264-E268 PolarHBondContact O-N 3.31Å; V266-E268 VanDerWaalsContact C-N 3.34Å; V266-E268 PolarHBondContact O-N 3.22Å; E268-R271 WeakPolarHBondContact O-CB 3.38Å; E268-R271 PolarHBondContact O-N 3.49Å; E268-R271 IonicContact OE1-CZ 2.67Å; E268-R271 IonicContact OE1-NE 3.56Å; E268-R271 IonicContact OE1-NH2 2.97Å; E268-R271 PolarHBondContact OE1-NH2 3Å; E268-R271 IonicContact OE2-CZ 2.85Å; E268-R271 IonicContact OE2-NE 2.66Å; E268-R271 PolarHBondContact OE2-NE 3.18Å; E268-R271 IonicContact OE2-NH2 3.78Å; E268-R271 PolarHBondContact OE2-NH2 2.96Å; E268-C272 PolarHBondContact O-N 3.01Å; E268-C272 PolarHBondContact O-SG 3.18Å; E268-C272 VanDerWaalsContact O-SG 3.36Å
269	S	75.6	Confident	75	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.021	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-38.1	178.7	-59.1	0	0	0	0	112.4	I265 V266 E267 C272 K273	I265-S269 WeakPolarHBondContact O-CB 3.47Å; I265-S269 PolarHBondContact O-N 3.02Å; I265-S269 PolarHBondContact O-OG 3.26Å; V266-S269 WeakPolarHBondContact O-CB 3.34Å; V266-S269 PolarHBondContact O-N 2.88Å; V266-S269 VanDerWaalsContact O-N 3.13Å; E267-S269 VanDerWaalsContact C-N 3.3Å; E267-S269 PolarHBondContact O-N 3.06Å; S269-C272 WeakPolarHBondContact O-CB 3.44Å; S269-C272 PolarHBondContact O-N 2.93Å; S269-K273 PolarHBondContact O-N 3.08Å
270	I	78	Confident	73.5	Confident	36 Å²	36	71 Å²	71	19%	0.185	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-45	172.5	-68.5	166.2	0	0	0	110	L246 A251 V266 E267 C272 K273 L274	L246-I270 HydrophobicContact CD2-CB 4.45Å; L246-I270 HydrophobicContact CD2-CG1 3.65Å; L246-I270 HydrophobicContact CG-CG1 3.84Å; A251-I270 HydrophobicContact CB-CD1 4.25Å; V266-I270 HydrophobicContact CG1-CD1 3.93Å; V266-I270 HydrophobicContact CG1-CG1 4.42Å; V266-I270 WeakPolarHBondContact O-CG1 3.42Å; V266-I270 PolarHBondContact O-N 3.08Å; E267-I270 PolarHBondContact O-N 3.16Å; I270-C272 VanDerWaalsContact C-N 3.29Å; I270-C272 PolarHBondContact O-N 2.8Å; I270-K273 PolarHBondContact O-N 3.1Å; I270-K273 VanDerWaalsContact O-N 3.14Å; I270-L274 HydrophobicContact CG2-CD1 3.99Å; I270-L274 HydrophobicContact CG2-CG 4.33Å; I270-L274 WeakPolarHBondContact O-CG 3.45Å; I270-L274 PolarHBondContact O-N 3.47Å
271	R	76.2	Confident	72.1	Confident	129 Å²	129	63.1 Å²	63.1	49%	0.487	31%	0.305	S	S	.	.	H	α-helix	trans	-59.7	-41.6	176	-173.6	174.4	69.7	139.6	-0.5	111.6	E267 E268 K275	E267-R271 WeakPolarHBondContact O-CB 3.34Å; E267-R271 PolarHBondContact O-N 3.43Å; E268-R271 WeakPolarHBondContact O-CB 3.38Å; E268-R271 PolarHBondContact O-N 3.49Å; E268-R271 IonicContact OE1-CZ 2.67Å; E268-R271 IonicContact OE1-NE 3.56Å; E268-R271 IonicContact OE1-NH2 2.97Å; E268-R271 PolarHBondContact OE1-NH2 3Å; E268-R271 IonicContact OE2-CZ 2.85Å; E268-R271 IonicContact OE2-NE 2.66Å; E268-R271 PolarHBondContact OE2-NE 3.18Å; E268-R271 IonicContact OE2-NH2 3.78Å; E268-R271 PolarHBondContact OE2-NH2 2.96Å; R271-K275 WeakPolarHBondContact O-CG 3.44Å; R271-K275 PolarHBondContact O-N 2.93Å; R271-K275 VanDerWaalsContact O-N 3.1Å
272	C	70.8	Confident	70.6	Confident	6 Å²	6	58.1 Å²	58.1	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-46.7	172.4	-74.6	0	0	0	0	111.8	A239 E268 S269 I270 L274 K275 I276 V283 S285	A239-C272 HydrophobicContact CB-CB 4.03Å; E268-C272 PolarHBondContact O-N 3.01Å; E268-C272 PolarHBondContact O-SG 3.18Å; E268-C272 VanDerWaalsContact O-SG 3.36Å; S269-C272 WeakPolarHBondContact O-CB 3.44Å; S269-C272 PolarHBondContact O-N 2.93Å; I270-C272 VanDerWaalsContact C-N 3.29Å; I270-C272 PolarHBondContact O-N 2.8Å; C272-L274 PolarHBondContact O-N 2.83Å; C272-K275 WeakPolarHBondContact O-CB 3.49Å; C272-K275 PolarHBondContact O-N 3.09Å; C272-I276 WeakPolarHBondContact O-CG1 3.22Å; C272-I276 PolarHBondContact O-N 3.12Å; C272-V283 HydrophobicContact CB-CG1 4.02Å; C272-S285 PolarHBondContact SG-OG 2.75Å
273	K	71.5	Confident	69.3	Low	15 Å²	15	58.9 Å²	58.9	7%	0.065	29%	0.291	C	S	.	.	H	α-helix	trans	-59.1	-45.3	177.3	-172.7	78.7	-174.8	-168.8	0	111.9	A239 L241 L246 S269 I270 K275 I276 L277	A239-K273 WeakPolarHBondContact O-CD 3.46Å; A239-K273 PolarHBondContact O-NZ 3.44Å; L241-K273 WeakPolarHBondContact O-CE 3.48Å; L241-K273 PolarHBondContact O-NZ 2.8Å; L246-K273 HydrophobicContact CD2-CB 4.3Å; S269-K273 PolarHBondContact O-N 3.08Å; I270-K273 PolarHBondContact O-N 3.1Å; I270-K273 VanDerWaalsContact O-N 3.14Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 2.84Å; K273-I276 WeakPolarHBondContact O-CB 3.45Å; K273-I276 PolarHBondContact O-N 2.83Å; K273-I276 VanDerWaalsContact O-N 3.13Å; K273-L277 HydrophobicContact CG-CD1 4.11Å; K273-L277 HydrophobicContact CG-CG 4.5Å; K273-L277 WeakPolarHBondContact O-CG 3.28Å; K273-L277 PolarHBondContact O-N 3.14Å
274	L	70.7	Confident	67.8	Low	72 Å²	72	58.7 Å²	58.7	38%	0.377	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-40.4	177.9	-72	172.4	0	0	0	111.5	I270 C272 I276 L277 Q278	I270-L274 HydrophobicContact CG2-CD1 3.99Å; I270-L274 HydrophobicContact CG2-CG 4.33Å; I270-L274 WeakPolarHBondContact O-CG 3.45Å; I270-L274 PolarHBondContact O-N 3.47Å; C272-L274 PolarHBondContact O-N 2.83Å; L274-I276 VanDerWaalsContact C-N 3.35Å; L274-I276 PolarHBondContact O-N 3.2Å; L274-L277 PolarHBondContact O-N 2.8Å; L274-Q278 VanDerWaalsContact O-CB 3.26Å; L274-Q278 WeakPolarHBondContact O-CB 3.5Å; L274-Q278 VanDerWaalsContact O-CG 3.27Å; L274-Q278 WeakPolarHBondContact O-CG 3.47Å; L274-Q278 PolarHBondContact O-N 2.83Å
275	K	68.3	Low	66.6	Low	88 Å²	88	55.8 Å²	55.8	38%	0.383	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-39.6	172.6	-74.2	179.8	177.7	-174.9	0	113	R271 C272 K273 N279 D280 V283	R271-K275 WeakPolarHBondContact O-CG 3.44Å; R271-K275 PolarHBondContact O-N 2.93Å; R271-K275 VanDerWaalsContact O-N 3.1Å; C272-K275 WeakPolarHBondContact O-CB 3.49Å; C272-K275 PolarHBondContact O-N 3.09Å; K273-K275 VanDerWaalsContact C-N 3.32Å; K273-K275 PolarHBondContact O-N 2.84Å; K275-N279 PolarHBondContact O-N 2.75Å; K275-N279 VanDerWaalsContact O-N 3.15Å; K275-D280 PolarHBondContact O-N 2.87Å; K275-D280 VanDerWaalsContact O-N 3.15Å; K275-V283 HydrophobicContact CB-CG2 3.98Å
276	I	65.5	Low	65.2	Low	30 Å²	30	60.8 Å²	60.8	15%	0.154	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-47.2	175.5	-63.1	166.3	0	0	0	110.1	A239 C272 K273 L274 N279 V283 A288 L364	A239-I276 HydrophobicContact CB-CD1 4.44Å; C272-I276 WeakPolarHBondContact O-CG1 3.22Å; C272-I276 PolarHBondContact O-N 3.12Å; K273-I276 WeakPolarHBondContact O-CB 3.45Å; K273-I276 PolarHBondContact O-N 2.83Å; K273-I276 VanDerWaalsContact O-N 3.13Å; L274-I276 VanDerWaalsContact C-N 3.35Å; L274-I276 PolarHBondContact O-N 3.2Å; I276-N279 PolarHBondContact O-N 3.09Å; I276-V283 HydrophobicContact CD1-CG2 4.49Å; I276-V283 HydrophobicContact CG1-CB 4.1Å; I276-V283 HydrophobicContact CG1-CG2 3.61Å; I276-A288 HydrophobicContact CD1-CB 3.81Å; I276-L364 HydrophobicContact CG2-CD1 3.79Å
277	L	63.5	Low	63.9	Low	67 Å²	67	61.7 Å²	61.7	35%	0.351	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-38.4	-178.9	-68	172.2	0	0	0	112.7	A243 K273 L274 N279	A243-L277 HydrophobicContact CB-CD1 4.16Å; K273-L277 HydrophobicContact CG-CD1 4.11Å; K273-L277 HydrophobicContact CG-CG 4.5Å; K273-L277 WeakPolarHBondContact O-CG 3.28Å; K273-L277 PolarHBondContact O-N 3.14Å; L274-L277 PolarHBondContact O-N 2.8Å; L277-N279 PolarHBondContact O-N 3.24Å
278	Q	62	Low	62.8	Low	121 Å²	121	56.9 Å²	56.9	57%	0.565	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-2.4	179.9	-69.3	174.5	-12.9	0	0	113.3	L274 D280	L274-Q278 VanDerWaalsContact O-CB 3.26Å; L274-Q278 WeakPolarHBondContact O-CB 3.5Å; L274-Q278 VanDerWaalsContact O-CG 3.27Å; L274-Q278 WeakPolarHBondContact O-CG 3.47Å; L274-Q278 PolarHBondContact O-N 2.83Å; Q278-D280 PolarHBondContact O-N 3.46Å
279	N	57.2	Low	62.1	Low	62 Å²	62	58.5 Å²	58.5	33%	0.332	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	18.2	-178.9	-115.4	-16.5	0	0	0	115.4	K275 I276 L277 G281 K341 D362	K275-N279 PolarHBondContact O-N 2.75Å; K275-N279 VanDerWaalsContact O-N 3.15Å; I276-N279 PolarHBondContact O-N 3.09Å; L277-N279 PolarHBondContact O-N 3.24Å; N279-G281 PolarHBondContact O-N 2.83Å; N279-K341 WeakPolarHBondContact OD1-CE 3.47Å; N279-K341 PolarHBondContact OD1-NZ 2.85Å; N279-D362 PolarHBondContact ND2-OD2 2.63Å
280	D	49.9	Very low	61.5	Low	114 Å²	114	58.8 Å²	58.8	61%	0.61	30%	0.303	S	S	*	.			trans	-86.5	68.7	-173.8	-87.1	-15.9	0	0	0	112.8	K275 Q278	K275-D280 PolarHBondContact O-N 2.87Å; K275-D280 VanDerWaalsContact O-N 3.15Å; Q278-D280 PolarHBondContact O-N 3.46Å
281	G	52.2	Low	61	Low	30 Å²	30	57.3 Å²	57.3	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	94	175.8	170.6	0	0	0	0	0	115.2	N279	N279-G281 PolarHBondContact O-N 2.83Å
282	V	49.9	Very low	60.3	Low	40 Å²	40	53.9 Å²	53.9	24%	0.242	28%	0.284	C	S	.	.			trans	-84	117.3	-179.3	-173.3	0	0	0	0	109.1	T284 I338 H388 P419	V282-T284 PolarHBondContact O-N 2.78Å; V282-I338 HydrophobicContact CG1-CG2 4.45Å; V282-I338 HydrophobicContact CG2-CG2 4.29Å; V282-H388 HydrophobicContact CB-CB 4.04Å; V282-H388 HydrophobicContact CG1-CB 3.78Å; V282-H388 HydrophobicContact CG2-CB 4.11Å; V282-P419 HydrophobicContact CG2-CB 4.32Å; V282-P419 HydrophobicContact CG2-CG 4.45Å
283	V	53.8	Low	59.4	Low	15 Å²	15	55.4 Å²	55.4	9%	0.091	29%	0.293	C	S	.	.			trans	-80.7	110.6	177.1	-174.4	0	0	0	0	108.9	C272 K275 I276 S285 A288	C272-V283 HydrophobicContact CB-CG1 4.02Å; K275-V283 HydrophobicContact CB-CG2 3.98Å; I276-V283 HydrophobicContact CD1-CG2 4.49Å; I276-V283 HydrophobicContact CG1-CB 4.1Å; I276-V283 HydrophobicContact CG1-CG2 3.61Å; V283-S285 VanDerWaalsContact CG1-OG 3.24Å; V283-S285 WeakPolarHBondContact CG1-OG 3.4Å; V283-A288 HydrophobicContact CB-CB 4.06Å; V283-A288 HydrophobicContact CG1-CB 3.41Å; V283-A288 VanDerWaalsContact CG1-CB 3.41Å
284	T	50.8	Low	58.7	Low	100 Å²	100	55.2 Å²	55.2	61%	0.613	30%	0.296	S	S	*	.			trans	-96.6	-2	-174.8	62.5	0	0	0	0	113.5	V282 H388	V282-T284 PolarHBondContact O-N 2.78Å; T284-H388 WeakPolarHBondContact CG2-CD2 3.31Å; T284-H388 VanDerWaalsContact CG2-NE2 3.34Å; T284-H388 WeakPolarHBondContact CG2-NE2 3.38Å
285	S	57.9	Low	58.6	Low	34 Å²	34	53.9 Å²	53.9	24%	0.238	29%	0.287	C	S	.	.	S	Bend	trans	-72.8	141.2	-178.8	48	0	0	0	0	111.2	C272 V283 C287 A288	C272-S285 PolarHBondContact SG-OG 2.75Å; V283-S285 VanDerWaalsContact CG1-OG 3.24Å; V283-S285 WeakPolarHBondContact CG1-OG 3.4Å; S285-C287 VanDerWaalsContact CB-SG 3.52Å; S285-C287 PolarHBondContact O-N 3.12Å; S285-C287 VanDerWaalsContact O-N 3.1Å; S285-C287 PolarHBondContact OG-SG 2.89Å; S285-A288 PolarHBondContact O-N 3.08Å
286	L	52.3	Low	58.8	Low	132 Å²	132	50.6 Å²	50.6	69%	0.691	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-52.6	-32.1	176.4	-84.7	150.1	0	0	0	112.3	A288 R289	L286-A288 PolarHBondContact O-N 3.23Å; L286-A288 VanDerWaalsContact O-N 3.16Å; L286-R289 PolarHBondContact O-N 2.7Å
287	C	56.1	Low	59.5	Low	22 Å²	22	49.2 Å²	49.2	15%	0.149	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-64.5	-16.6	178.6	63.1	0	0	0	0	114.5	R237 A239 S285	R237-C287 CarbonylContact C-O 3.56Å; A239-C287 HydrophobicContact CB-CB 4.43Å; A239-C287 VanDerWaalsContact CB-O 3.28Å; A239-C287 WeakPolarHBondContact CB-O 3.48Å; A239-C287 PolarHBondContact N-O 2.86Å; A239-C287 VanDerWaalsContact N-O 3.15Å; S285-C287 VanDerWaalsContact CB-SG 3.52Å; S285-C287 PolarHBondContact O-N 3.12Å; S285-C287 VanDerWaalsContact O-N 3.1Å; S285-C287 PolarHBondContact OG-SG 2.89Å
288	A	57.5	Low	60.4	Low	1 Å²	1	46.6 Å²	46.6	1%	0.008	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-111.1	-3.1	-178.2	0	0	0	0	0	113.9	A239 I276 V283 S285 L286 P290 W584	A239-A288 HydrophobicContact CB-CB 4.16Å; I276-A288 HydrophobicContact CD1-CB 3.81Å; V283-A288 HydrophobicContact CB-CB 4.06Å; V283-A288 HydrophobicContact CG1-CB 3.41Å; V283-A288 VanDerWaalsContact CG1-CB 3.41Å; S285-A288 PolarHBondContact O-N 3.08Å; L286-A288 PolarHBondContact O-N 3.23Å; L286-A288 VanDerWaalsContact O-N 3.16Å; A288-P290 WeakPolarHBondContact O-CD 3.47Å; A288-W584 WeakPolarHBondContact O-CZ3 3.34Å
289	R	64.4	Low	61.3	Low	111 Å²	111	40.8 Å²	40.8	42%	0.419	23%	0.227	S	C	.	.	S	Bend	trans	-90.9	120.7	-179	-172.4	176.2	179.8	-142.6	-5.4	109.8	E200 R237 L286 W584	E200-R289 IonicContact OE1-CZ 2.75Å; E200-R289 IonicContact OE1-NH1 2.6Å; E200-R289 PolarHBondContact OE1-NH1 3.07Å; R237-R289 WeakPolarHBondContact CD-O 3.41Å; R237-R289 PolarHBondContact NH1-O 3.15Å; L286-R289 PolarHBondContact O-N 2.7Å; R289-W584 HydrophobicContact CB-CZ2 4.46Å; R289-W584 HydrophobicContact CG-CH2 4.49Å; R289-W584 HydrophobicContact CG-CZ2 3.98Å
290	P	62	Low	62.4	Low	9 Å²	9	37.9 Å²	37.9	6%	0.058	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-63.1	156.6	175.6	-21.7	33.3	0	0	0	113.8	R237 L240 A288 W584	R237-P290 PolarHBondContact NH1-O 3.44Å; L240-P290 HydrophobicContact CD1-CB 4.28Å; L240-P290 HydrophobicContact CD1-CG 4.38Å; L240-P290 HydrophobicContact CD2-CG 4.1Å; A288-P290 WeakPolarHBondContact O-CD 3.47Å; P290-W584 HydrophobicContact CG-CB 3.66Å; P290-W584 HydrophobicContact CG-CD2 3.87Å; P290-W584 HydrophobicContact CG-CE3 4.25Å; P290-W584 HydrophobicContact CG-CG 3.58Å
291	R	69.1	Low	63.3	Low	5 Å²	5	32.4 Å²	32.4	2%	0.019	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-68.9	163.3	174.3	-67.4	177.4	-171	-94.8	-0.1	109.3	L197 S199 E207 R237 T293 G294 H295	L197-R291 VanDerWaalsContact O-CZ 3.31Å; L197-R291 PolarHBondContact O-NH1 3.16Å; L197-R291 PolarHBondContact O-NH2 3.4Å; S199-R291 PolarHBondContact O-NH1 3.1Å; E207-R291 IonicContact OE1-CZ 3.74Å; E207-R291 IonicContact OE1-NE 2.95Å; E207-R291 IonicContact OE1-NH2 3.57Å; E207-R291 PolarHBondContact OE1-NH2 3.38Å; E207-R291 IonicContact OE2-CZ 3.79Å; E207-R291 IonicContact OE2-NE 3.98Å; E207-R291 PolarHBondContact OE2-NE 3.24Å; E207-R291 IonicContact OE2-NH2 2.91Å; R237-R291 VanDerWaalsContact NH1-CG 3.3Å; R291-T293 PolarHBondContact O-N 3.09Å; R291-G294 WeakPolarHBondContact O-CA 3.28Å; R291-G294 PolarHBondContact O-N 3Å; R291-H295 PolarHBondContact O-CD2 2.84Å
292	K	60.2	Low	63.6	Low	58 Å²	58	31 Å²	31	25%	0.252	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-24	-176.5	-70.5	-179.4	-172.4	173.8	0	113.1	E200 E201 H295 G537	E200-K292 HydrophobicContact CB-CG 4.3Å; E200-K292 PolarHBondContact O-N 3.11Å; E201-K292 HydrophobicContact CG-CD 3.93Å; E201-K292 IonicContact OE1-NZ 3.39Å; E201-K292 PolarHBondContact OE1-NZ 3.44Å; K292-H295 PolarHBondContact O-CD2 3.45Å; K292-G537 WeakPolarHBondContact O-CA 3.48Å; K292-G537 PolarHBondContact O-N 3.23Å
293	T	52.3	Low	63.5	Low	37 Å²	37	35.7 Å²	35.7	23%	0.227	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-17.9	175.5	47.8	0	0	0	0	114.4	L202 E203 R291 H295	L202-T293 PolarHBondContact O-OG1 3.39Å; E203-T293 HydrophobicContact CB-CG2 4Å; E203-T293 HydrophobicContact CG-CG2 3.73Å; R291-T293 PolarHBondContact O-N 3.09Å; T293-H295 PolarHBondContact O-N 3.34Å
294	G	57	Low	63.6	Low	12 Å²	12	38.8 Å²	38.8	12%	0.124	21%	0.206	C	C	.	.	S	Bend	trans	-86.4	36.6	177.5	0	0	0	0	0	113.2	R291 K585	R291-G294 WeakPolarHBondContact O-CA 3.28Å; R291-G294 PolarHBondContact O-N 3Å; G294-K585 VanDerWaalsContact C-CB 3.44Å; G294-K585 WeakPolarHBondContact O-CA 2.97Å; G294-K585 WeakPolarHBondContact O-CB 3.29Å; G294-K585 PolarHBondContact O-N 3.19Å
295	H	68.4	Low	63.9	Low	43 Å²	43	39.6 Å²	39.6	20%	0.199	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.3	178.6	-77.6	-99.7	0	0	0	111.4	R291 K292 T293 S536 S582 T583 W584	R291-H295 PolarHBondContact O-CD2 2.84Å; K292-H295 PolarHBondContact O-CD2 3.45Å; T293-H295 PolarHBondContact O-N 3.34Å; H295-S536 VanDerWaalsContact CB-OG 3.29Å; H295-S536 WeakPolarHBondContact CB-OG 3.34Å; H295-S582 PolarHBondContact ND1-OG 3.14Å; H295-T583 CarbonylContact C-O 3.58Å; H295-T583 VanDerWaalsContact CA-O 3.23Å; H295-T583 WeakPolarHBondContact CA-O 3.31Å; H295-W584 AromaticContact CE1-CD1 3.76Å
296	S	72.6	Confident	63.9	Low	19 Å²	19	39.6 Å²	39.6	13%	0.133	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	126.2	174	-74.6	0	0	0	0	110.3	T583 K585	S296-T583 PolarHBondContact N-O 2.8Å; S296-T583 PolarHBondContact O-N 2.96Å; S296-T583 PolarHBondContact O-OG1 3.33Å; S296-T583 VanDerWaalsContact O-OG1 3.07Å; S296-K585 WeakPolarHBondContact OG-CB 3.11Å; S296-K585 WeakPolarHBondContact OG-CG 2.95Å
297	L	80.3	Confident	64.5	Low	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.3	177.1	-69.2	178.2	0	0	0	109.6	V313 V534 Y541 F580	L297-V313 HydrophobicContact CB-CB 3.96Å; L297-V313 HydrophobicContact CB-CG2 4.45Å; L297-V313 PolarHBondContact O-N 3.3Å; L297-V534 HydrophobicContact CD2-CG1 3.49Å; L297-V534 VanDerWaalsContact CD2-CG1 3.49Å; L297-Y541 HydrophobicContact CD1-CD1 4.06Å; L297-Y541 HydrophobicContact CD1-CD2 3.97Å; L297-Y541 HydrophobicContact CD1-CE1 4.17Å; L297-Y541 HydrophobicContact CD1-CE2 4.12Å; L297-Y541 HydrophobicContact CD1-CG 3.95Å; L297-F580 HydrophobicContact CB-CE2 4.07Å; L297-F580 HydrophobicContact CB-CZ 4.26Å; L297-F580 HydrophobicContact CD1-CZ 4.17Å; L297-F580 HydrophobicContact CD2-CE2 4.48Å; L297-F580 HydrophobicContact CD2-CZ 4.16Å; L297-F580 HydrophobicContact CG-CZ 4.44Å
298	F	81.8	Confident	65.3	Low	12 Å²	12	34.6 Å²	34.6	5%	0.053	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.7	177.2	-75.9	-79.8	0	0	0	111.2	L310 Y311 L312 T363 F580 V581 T583	F298-L310 HydrophobicContact CB-CD1 3.86Å; F298-L310 HydrophobicContact CD1-CD1 3.72Å; F298-L310 HydrophobicContact CD1-CD2 3.84Å; F298-L310 HydrophobicContact CD1-CG 3.69Å; F298-L310 HydrophobicContact CE1-CD2 3.94Å; F298-L310 HydrophobicContact CE1-CG 4.21Å; F298-L310 HydrophobicContact CG-CD1 4.09Å; F298-Y311 CarbonylContact C-O 3.57Å; F298-Y311 VanDerWaalsContact CA-O 3.31Å; F298-Y311 WeakPolarHBondContact CA-O 3.36Å; F298-L312 HydrophobicContact CD1-CB 4.38Å; F298-L312 HydrophobicContact CD1-CD1 4.3Å; F298-L312 HydrophobicContact CE1-CB 4.11Å; F298-L312 HydrophobicContact CE1-CD1 3.93Å; F298-L312 HydrophobicContact CE2-CD1 4.28Å; F298-L312 HydrophobicContact CZ-CD1 3.93Å; F298-T363 HydrophobicContact CE2-CG2 3.69Å; F298-T363 HydrophobicContact CZ-CG2 3.96Å; F298-F580 VanDerWaalsContact O-CD2 3.28Å; F298-F580 WeakPolarHBondContact O-CD2 3.35Å; F298-V581 HydrophobicContact CB-CG2 3.78Å; F298-V581 PolarHBondContact N-O 2.94Å; F298-V581 PolarHBondContact O-N 2.84Å; F298-T583 HydrophobicContact CD2-CG2 3.92Å; F298-T583 VanDerWaalsContact CD2-OG1 3.24Å; F298-T583 WeakPolarHBondContact CD2-OG1 3.12Å; F298-T583 HydrophobicContact CE2-CG2 4.34Å; F298-T583 WeakPolarHBondContact CE2-OG1 3.5Å
299	L	81.8	Confident	66.4	Low	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	118.6	174.9	-170	67.6	0	0	0	108.8	Y311 V313 I320 V543 V571 L575 P577 F580	L299-Y311 PolarHBondContact N-O 3.26Å; L299-Y311 PolarHBondContact O-N 2.84Å; L299-V313 HydrophobicContact CB-CG2 4.31Å; L299-I320 HydrophobicContact CD2-CD1 4.37Å; L299-V543 HydrophobicContact CD1-CB 4.21Å; L299-V543 HydrophobicContact CD1-CG1 3.46Å; L299-V543 VanDerWaalsContact CD1-CG1 3.46Å; L299-V543 HydrophobicContact CD1-CG2 3.84Å; L299-V543 HydrophobicContact CD2-CG2 4.22Å; L299-V571 HydrophobicContact CD2-CG1 4.24Å; L299-L575 HydrophobicContact CD2-CD1 4.35Å; L299-L575 HydrophobicContact CD2-CD2 3.39Å; L299-L575 HydrophobicContact CG-CD2 3.94Å; L299-P577 HydrophobicContact CD1-CB 3.44Å; L299-P577 VanDerWaalsContact CD1-CB 3.44Å; L299-P577 HydrophobicContact CD1-CG 4.38Å; L299-P577 HydrophobicContact CG-CB 4.06Å; L299-F580 HydrophobicContact CB-CD2 4.37Å; L299-F580 HydrophobicContact CD1-CB 4.35Å; L299-F580 HydrophobicContact CD1-CD2 3.76Å; L299-F580 HydrophobicContact CD1-CE2 4.4Å; L299-F580 HydrophobicContact CD1-CG 4.27Å
300	L	79.3	Confident	67.3	Low	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	107.4	172.7	-60.5	112	0	0	0	107.5	L310 I326 F333 A335 V342 I344 P577 T578 A579 V581	L300-L310 HydrophobicContact CD1-CD1 4.42Å; L300-L310 HydrophobicContact CD2-CD1 3.82Å; L300-L310 HydrophobicContact CG-CD1 3.7Å; L300-I326 HydrophobicContact CD2-CD1 4.09Å; L300-F333 HydrophobicContact CB-CE2 4.25Å; L300-F333 HydrophobicContact CB-CZ 3.98Å; L300-F333 HydrophobicContact CD2-CE2 4.34Å; L300-A335 HydrophobicContact CD1-CB 3.78Å; L300-V342 HydrophobicContact CD1-CG1 4.43Å; L300-I344 HydrophobicContact CD2-CD1 3.51Å; L300-I344 HydrophobicContact CD2-CG1 3.95Å; L300-P577 WeakPolarHBondContact O-CA 3.45Å; L300-T578 PolarHBondContact O-N 2.69Å; L300-T578 PolarHBondContact O-OG1 3.01Å; L300-T578 VanDerWaalsContact O-OG1 3.04Å; L300-A579 HydrophobicContact CB-CB 4.33Å; L300-A579 HydrophobicContact CD1-CB 3.96Å; L300-A579 PolarHBondContact N-O 3.46Å; L300-A579 PolarHBondContact O-N 3.09Å; L300-V581 HydrophobicContact CD1-CG1 4.31Å; L300-V581 HydrophobicContact CD1-CG2 3.95Å
301	G	69.5	Low	68.3	Low	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	175.1	179	0	0	0	0	0	112.1	C307 D308 K309 I576	G301-C307 WeakPolarHBondContact CA-SG 3.47Å; G301-C307 PolarHBondContact N-SG 3.24Å; G301-C307 PolarHBondContact O-SG 3.08Å; G301-D308 PolarHBondContact O-N 3.27Å; G301-K309 PolarHBondContact N-O 2.93Å; G301-K309 PolarHBondContact O-N 3.02Å; G301-K309 VanDerWaalsContact O-N 3.12Å; G301-I576 VanDerWaalsContact CA-O 3.29Å; G301-I576 WeakPolarHBondContact CA-O 3.1Å
302	G	59.4	Low	68.9	Low	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	172.2	170.5	0	0	0	0	0	112.8	T304 M306 D308 L575 I576	G302-T304 CarbonylContact C-O 3.53Å; G302-T304 PolarHBondContact O-N 3.16Å; G302-M306 VanDerWaalsContact CA-O 3.31Å; G302-M306 WeakPolarHBondContact CA-O 3.47Å; G302-D308 WeakPolarHBondContact CA-OD1 3.48Å; G302-L575 WeakPolarHBondContact O-CA 3.4Å; G302-I576 PolarHBondContact N-O 3.31Å; G302-I576 PolarHBondContact O-N 3.49Å
303	Q	46.6	Very low	69.7	Low	138 Å²	138	32.7 Å²	32.7	65%	0.645	17%	0.166	S	C	*	.	S	Bend	trans	-67.3	-14.1	-173.9	178.6	158.5	18.2	0	0	113.8	S574	Q303-S574 CarbonylContact C-O 3.1Å; Q303-S574 WeakPolarHBondContact CA-O 3.25Å; Q303-S574 VanDerWaalsContact O-O 3.08Å
304	T	56.8	Low	70.6	Confident	81 Å²	81	33.4 Å²	33.4	50%	0.497	17%	0.168	S	C	.	.	S	Bend	trans	-131	-171.2	174.2	59.5	0	0	0	0	109.2	G302 M306	G302-T304 CarbonylContact C-O 3.53Å; G302-T304 PolarHBondContact O-N 3.16Å; T304-M306 PolarHBondContact O-N 3.31Å; T304-M306 PolarHBondContact OG1-N 2.89Å
305	F	56.5	Low	70.9	Confident	117 Å²	117	36.7 Å²	36.7	51%	0.513	18%	0.181	S	C	.	.	S	Bend	trans	-58.5	-11.4	169.4	-72.6	-80.4	0	0	0	113.5	K331 I576	F305-K331 HydrophobicContact CB-CD 3.81Å; F305-K331 VanDerWaalsContact CB-CE 3.45Å; F305-K331 WeakPolarHBondContact O-CG 3.48Å; F305-I576 HydrophobicContact CD1-CD1 4.23Å; F305-I576 HydrophobicContact CE1-CD1 4.43Å; F305-I576 HydrophobicContact CG-CD1 4.33Å
306	M	57.3	Low	70.6	Confident	33 Å²	33	41.7 Å²	41.7	16%	0.163	20%	0.201	C	C	.	.	S	Bend	trans	-86.5	125.9	170.6	-66.3	-66.5	-170.4	0	0	109.8	G302 T304 P329 K331 S350	G302-M306 VanDerWaalsContact CA-O 3.31Å; G302-M306 WeakPolarHBondContact CA-O 3.47Å; T304-M306 PolarHBondContact O-N 3.31Å; T304-M306 PolarHBondContact OG1-N 2.89Å; M306-P329 HydrophobicContact CB-CB 4.43Å; M306-K331 HydrophobicContact CE-CG 4.33Å; M306-K331 HydrophobicContact SD-CD 4.21Å; M306-K331 VanDerWaalsContact SD-CE 3.57Å; M306-K331 HydrophobicContact SD-CG 3.58Å; M306-K331 VanDerWaalsContact SD-CG 3.58Å; M306-S350 VanDerWaalsContact CE-N 3.35Å
307	C	64.6	Low	69.7	Low	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	116.1	171.7	-171.8	0	0	0	0	110.1	G301 I326 P329 R330 F333 T578	G301-C307 WeakPolarHBondContact CA-SG 3.47Å; G301-C307 PolarHBondContact N-SG 3.24Å; G301-C307 PolarHBondContact O-SG 3.08Å; C307-I326 HydrophobicContact CB-CD1 4.44Å; C307-I326 WeakPolarHBondContact SG-CD1 3.39Å; C307-P329 WeakPolarHBondContact O-CA 3.41Å; C307-P329 VanDerWaalsContact O-CB 3.29Å; C307-P329 WeakPolarHBondContact O-CB 3.45Å; C307-R330 PolarHBondContact N-O 3.08Å; C307-F333 HydrophobicContact CB-CE1 3.45Å; C307-F333 VanDerWaalsContact CB-CE1 3.45Å; C307-F333 HydrophobicContact CB-CZ 3.89Å; C307-T578 HydrophobicContact CB-CG2 4.12Å; C307-T578 VanDerWaalsContact CB-OG1 3.31Å; C307-T578 WeakPolarHBondContact CB-OG1 3.4Å; C307-T578 PolarHBondContact SG-OG1 3.15Å; C307-T578 VanDerWaalsContact SG-OG1 3.35Å
308	D	74.8	Confident	69.2	Low	50 Å²	50	48.5 Å²	48.5	27%	0.267	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-19.8	-179.9	60.6	-22.2	0	0	0	112.8	G301 G302 D325 I326 P329	G301-D308 PolarHBondContact O-N 3.27Å; G302-D308 WeakPolarHBondContact CA-OD1 3.48Å; D308-D325 WeakPolarHBondContact O-CA 3.43Å; D308-I326 PolarHBondContact O-N 3.33Å; D308-P329 HydrophobicContact CB-CB 4.41Å; D308-P329 HydrophobicContact CB-CG 4.24Å
309	K	80.6	Confident	68.8	Low	74 Å²	74	53.9 Å²	53.9	32%	0.322	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	146.6	-170.9	-74.7	-178	-179.6	-172.6	0	114	G301 Y311 D325	G301-K309 PolarHBondContact N-O 2.93Å; G301-K309 PolarHBondContact O-N 3.02Å; G301-K309 VanDerWaalsContact O-N 3.12Å; K309-Y311 HydrophobicContact CB-CD2 4.1Å; K309-Y311 HydrophobicContact CB-CE2 3.38Å; K309-D325 WeakPolarHBondContact CE-OD1 3.43Å; K309-D325 VanDerWaalsContact CG-OD1 3.31Å; K309-D325 WeakPolarHBondContact CG-OD1 3.47Å
310	L	82.9	Confident	68.6	Low	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126.3	166.9	-177.8	69.4	0	0	0	108.8	F298 L300 K323 A324 Y361 W368	F298-L310 HydrophobicContact CB-CD1 3.86Å; F298-L310 HydrophobicContact CD1-CD1 3.72Å; F298-L310 HydrophobicContact CD1-CD2 3.84Å; F298-L310 HydrophobicContact CD1-CG 3.69Å; F298-L310 HydrophobicContact CE1-CD2 3.94Å; F298-L310 HydrophobicContact CE1-CG 4.21Å; F298-L310 HydrophobicContact CG-CD1 4.09Å; L300-L310 HydrophobicContact CD1-CD1 4.42Å; L300-L310 HydrophobicContact CD2-CD1 3.82Å; L300-L310 HydrophobicContact CG-CD1 3.7Å; L310-K323 PolarHBondContact O-N 3.31Å; L310-A324 HydrophobicContact CB-CB 4.43Å; L310-A324 PolarHBondContact N-O 3.06Å; L310-A324 PolarHBondContact O-N 3.02Å; L310-Y361 HydrophobicContact CD2-CD1 3.39Å; L310-Y361 HydrophobicContact CD2-CD2 4.32Å; L310-Y361 HydrophobicContact CD2-CE1 3.21Å; L310-Y361 HydrophobicContact CD2-CE2 4.19Å; L310-Y361 HydrophobicContact CD2-CG 3.94Å; L310-W368 HydrophobicContact CD2-CZ2 4.44Å
311	Y	81.8	Confident	68.6	Low	28 Å²	28	58.5 Å²	58.5	11%	0.11	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138	177.5	-59.7	-98.2	0	0	0	110.6	F298 L299 K309 I320 I321 P322 L575	F298-Y311 CarbonylContact C-O 3.57Å; F298-Y311 VanDerWaalsContact CA-O 3.31Å; F298-Y311 WeakPolarHBondContact CA-O 3.36Å; L299-Y311 PolarHBondContact N-O 3.26Å; L299-Y311 PolarHBondContact O-N 2.84Å; K309-Y311 HydrophobicContact CB-CD2 4.1Å; K309-Y311 HydrophobicContact CB-CE2 3.38Å; Y311-I320 HydrophobicContact CD1-CG2 3.85Å; Y311-I320 HydrophobicContact CG-CG2 3.96Å; Y311-I321 CarbonylContact C-O 3.49Å; Y311-I321 VanDerWaalsContact CA-O 3.29Å; Y311-I321 WeakPolarHBondContact CA-O 3.44Å; Y311-P322 HydrophobicContact CD1-CB 3.95Å; Y311-P322 HydrophobicContact CE1-CB 3.88Å; Y311-L575 HydrophobicContact CD1-CD1 3.8Å; Y311-L575 HydrophobicContact CD2-CD1 3.51Å; Y311-L575 HydrophobicContact CD2-CD2 4.49Å; Y311-L575 HydrophobicContact CD2-CG 4.19Å; Y311-L575 HydrophobicContact CE1-CD1 3.59Å; Y311-L575 HydrophobicContact CE2-CD1 3.28Å; Y311-L575 HydrophobicContact CE2-CD2 4.46Å; Y311-L575 HydrophobicContact CE2-CG 3.76Å; Y311-L575 HydrophobicContact CG-CD1 3.76Å
312	L	82.9	Confident	69.1	Low	32 Å²	32	62.3 Å²	62.3	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.2	171.1	178.1	68.6	0	0	0	109.1	F298 I321 K323	F298-L312 HydrophobicContact CD1-CB 4.38Å; F298-L312 HydrophobicContact CD1-CD1 4.3Å; F298-L312 HydrophobicContact CE1-CB 4.11Å; F298-L312 HydrophobicContact CE1-CD1 3.93Å; F298-L312 HydrophobicContact CE2-CD1 4.28Å; F298-L312 HydrophobicContact CZ-CD1 3.93Å; L312-I321 PolarHBondContact N-O 3.37Å; L312-I321 PolarHBondContact O-N 2.72Å; L312-K323 HydrophobicContact CB-CG 3.78Å
313	V	77.4	Confident	70.2	Confident	10 Å²	10	66.4 Å²	66.4	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.2	172.6	-177	0	0	0	0	108.1	L297 L299 I320 L555 F580	L297-V313 HydrophobicContact CB-CB 3.96Å; L297-V313 HydrophobicContact CB-CG2 4.45Å; L297-V313 PolarHBondContact O-N 3.3Å; L299-V313 HydrophobicContact CB-CG2 4.31Å; V313-I320 HydrophobicContact CG2-CG1 4.43Å; V313-L555 HydrophobicContact CG1-CD2 3.71Å; V313-F580 HydrophobicContact CG2-CE2 4.27Å
314	D	71	Confident	71.9	Confident	52 Å²	52	60.7 Å²	60.7	28%	0.278	31%	0.306	S	S	.	.			trans	-82.5	119	173.4	-176.6	11.8	0	0	0	110	K316 A317 K318 E319 I321	D314-K316 VanDerWaalsContact C-N 3.31Å; D314-K316 PolarHBondContact OD1-N 2.95Å; D314-A317 HydrophobicContact CB-CB 4.21Å; D314-A317 WeakPolarHBondContact OD2-CB 3.46Å; D314-A317 PolarHBondContact OD2-N 3.17Å; D314-K318 VanDerWaalsContact O-CA 3.28Å; D314-K318 WeakPolarHBondContact O-CA 3.34Å; D314-K318 PolarHBondContact O-N 2.9Å; D314-E319 PolarHBondContact N-O 3.07Å; D314-I321 HydrophobicContact CB-CD1 4.33Å
315	Q	63.8	Low	73.1	Confident	81 Å²	81	62 Å²	62	38%	0.379	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-29	179.4	-65.3	-175.3	-6.7	0	0	112.3	Y541	Q315-Y541 PolarHBondContact NE2-OH 3.41Å
316	K	61.8	Low	74.3	Confident	147 Å²	147	56.9 Å²	56.9	64%	0.639	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-48.9	-177.9	-65.7	-171.4	-176.1	-179.4	0	111.4	E205 D314 K318	E205-K316 WeakPolarHBondContact OE1-CE 3.43Å; E205-K316 IonicContact OE1-NZ 3.53Å; E205-K316 PolarHBondContact OE1-NZ 3.2Å; E205-K316 VanDerWaalsContact OE1-NZ 3.11Å; E205-K316 IonicContact OE2-NZ 2.68Å; E205-K316 PolarHBondContact OE2-NZ 3.37Å; D314-K316 VanDerWaalsContact C-N 3.31Å; D314-K316 PolarHBondContact OD1-N 2.95Å; K316-K318 VanDerWaalsContact C-N 3.29Å; K316-K318 PolarHBondContact O-N 3.28Å
317	A	53.9	Low	75.1	Confident	48 Å²	48	58.5 Å²	58.5	40%	0.397	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-16.1	177.2	0	0	0	0	0	113.3	D314 E319	D314-A317 HydrophobicContact CB-CB 4.21Å; D314-A317 WeakPolarHBondContact OD2-CB 3.46Å; D314-A317 PolarHBondContact OD2-N 3.17Å; A317-E319 HydrophobicContact CB-CB 4.06Å; A317-E319 HydrophobicContact CB-CG 4.16Å; A317-E319 PolarHBondContact O-N 3.19Å
318	K	68.4	Low	75.7	Confident	116 Å²	116	60.2 Å²	60.2	50%	0.504	31%	0.312	S	S	.	.			trans	54.9	26.6	-168.6	-58.6	-178.7	177.8	-179.5	0	112.6	D314 K316 I568 T569	D314-K318 VanDerWaalsContact O-CA 3.28Å; D314-K318 WeakPolarHBondContact O-CA 3.34Å; D314-K318 PolarHBondContact O-N 2.9Å; K316-K318 VanDerWaalsContact C-N 3.29Å; K316-K318 PolarHBondContact O-N 3.28Å; K318-I568 HydrophobicContact CB-CG2 4.29Å; K318-I568 HydrophobicContact CD-CG2 4.14Å; K318-I568 HydrophobicContact CG-CG2 3.93Å; K318-T569 WeakPolarHBondContact O-CB 3.32Å; K318-T569 PolarHBondContact O-OG1 2.77Å
319	E	73.8	Confident	75.7	Confident	124 Å²	124	60.7 Å²	60.7	58%	0.579	32%	0.318	S	S	*	.			trans	-108.9	154.8	-177.6	-72.6	-175	176	0	0	111.3	D314 A317	D314-E319 PolarHBondContact N-O 3.07Å; A317-E319 HydrophobicContact CB-CB 4.06Å; A317-E319 HydrophobicContact CB-CG 4.16Å; A317-E319 PolarHBondContact O-N 3.19Å
320	I	77.2	Confident	75.6	Confident	30 Å²	30	58 Å²	58	15%	0.154	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.2	177.6	-58.8	178.8	0	0	0	107.5	L299 Y311 V313 V571 L575	L299-I320 HydrophobicContact CD2-CD1 4.37Å; Y311-I320 HydrophobicContact CD1-CG2 3.85Å; Y311-I320 HydrophobicContact CG-CG2 3.96Å; V313-I320 HydrophobicContact CG2-CG1 4.43Å; I320-V571 HydrophobicContact CD1-CB 4.23Å; I320-V571 HydrophobicContact CD1-CG1 4.19Å; I320-V571 HydrophobicContact CD1-CG2 3.97Å; I320-L575 HydrophobicContact CG2-CD1 4.48Å
321	I	80.6	Confident	75.3	Confident	67 Å²	67	61.5 Å²	61.5	34%	0.344	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.2	-171.6	-54.7	172.1	0	0	0	109.2	Y311 L312 D314	Y311-I321 CarbonylContact C-O 3.49Å; Y311-I321 VanDerWaalsContact CA-O 3.29Å; Y311-I321 WeakPolarHBondContact CA-O 3.44Å; L312-I321 PolarHBondContact N-O 3.37Å; L312-I321 PolarHBondContact O-N 2.72Å; D314-I321 HydrophobicContact CB-CD1 4.33Å
322	P	80.2	Confident	75.1	Confident	80 Å²	80	64.7 Å²	64.7	52%	0.519	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	133	173.3	28.6	-32.7	0	0	0	110.3	Y311	Y311-P322 HydrophobicContact CD1-CB 3.95Å; Y311-P322 HydrophobicContact CE1-CB 3.88Å
323	K	80.8	Confident	75.1	Confident	86 Å²	86	63.7 Å²	63.7	37%	0.374	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	-55.4	-176	-85.4	-66.7	-163.8	162.7	0	114	L310 L312 E366	L310-K323 PolarHBondContact O-N 3.31Å; L312-K323 HydrophobicContact CB-CG 3.78Å; K323-E366 IonicContact NZ-OE1 2.79Å; K323-E366 PolarHBondContact NZ-OE1 3.43Å
324	A	82	Confident	75.5	Confident	18 Å²	18	64 Å²	64	15%	0.149	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	150.6	-175.1	0	0	0	0	0	111.8	L310 Y361	L310-A324 HydrophobicContact CB-CB 4.43Å; L310-A324 PolarHBondContact N-O 3.06Å; L310-A324 PolarHBondContact O-N 3.02Å; A324-Y361 HydrophobicContact CB-CE2 3.78Å
325	D	82.1	Confident	76.3	Confident	108 Å²	108	62.2 Å²	62.2	58%	0.578	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.7	172.5	-63.4	-44.8	0	0	0	110.1	D308 K309 W368	D308-D325 WeakPolarHBondContact O-CA 3.43Å; K309-D325 WeakPolarHBondContact CE-OD1 3.43Å; K309-D325 VanDerWaalsContact CG-OD1 3.31Å; K309-D325 WeakPolarHBondContact CG-OD1 3.47Å; D325-W368 PolarHBondContact O-NE1 3.07Å
326	I	81.9	Confident	77.4	Confident	10 Å²	10	59 Å²	59	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.2	-179.8	-60.2	173.1	0	0	0	108.4	L300 C307 D308 S328 I344 W368	L300-I326 HydrophobicContact CD2-CD1 4.09Å; C307-I326 HydrophobicContact CB-CD1 4.44Å; C307-I326 WeakPolarHBondContact SG-CD1 3.39Å; D308-I326 PolarHBondContact O-N 3.33Å; I326-S328 PolarHBondContact O-N 3.38Å; I326-I344 HydrophobicContact CD1-CD1 4.25Å; I326-I344 HydrophobicContact CG2-CD1 4.13Å; I326-W368 HydrophobicContact CG1-CH2 4.34Å; I326-W368 HydrophobicContact CG1-CZ2 3.92Å
327	P	75.8	Confident	78.6	Confident	68 Å²	68	52.9 Å²	52.9	44%	0.442	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	-17.3	-174.8	-25.9	33.3	0	0	0	115.5	W359 W368	P327-W359 HydrophobicContact CB-CD2 4.4Å; P327-W359 HydrophobicContact CB-CE3 4.24Å; P327-W359 HydrophobicContact CB-CH2 3.8Å; P327-W359 HydrophobicContact CB-CZ2 3.98Å; P327-W359 HydrophobicContact CB-CZ3 3.94Å; P327-W359 HydrophobicContact CG-CD2 4.43Å; P327-W359 HydrophobicContact CG-CE3 4.03Å; P327-W359 HydrophobicContact CG-CH2 4.39Å; P327-W359 HydrophobicContact CG-CZ3 4.01Å; P327-W368 HydrophobicContact CG-CB 3.7Å; P327-W368 HydrophobicContact CG-CD2 4.17Å; P327-W368 HydrophobicContact CG-CG 3.71Å
328	S	76.1	Confident	79.8	Confident	35 Å²	35	51 Å²	51	25%	0.245	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	97.1	178.2	-175.9	0	0	0	0	110.4	I326 R330	I326-S328 PolarHBondContact O-N 3.38Å; S328-R330 WeakPolarHBondContact O-CG 3.4Å; S328-R330 PolarHBondContact O-N 2.96Å; S328-R330 PolarHBondContact OG-NE 3.17Å; S328-R330 PolarHBondContact OG-NH2 3.26Å
329	P	75.3	Confident	80.1	Confident	61 Å²	61	46.2 Å²	46.2	40%	0.396	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	127.9	179.6	-25.1	34.9	0	0	0	112.8	M306 C307 D308	M306-P329 HydrophobicContact CB-CB 4.43Å; C307-P329 WeakPolarHBondContact O-CA 3.41Å; C307-P329 VanDerWaalsContact O-CB 3.29Å; C307-P329 WeakPolarHBondContact O-CB 3.45Å; D308-P329 HydrophobicContact CB-CB 4.41Å; D308-P329 HydrophobicContact CB-CG 4.24Å
330	R	78.3	Confident	80.2	Confident	16 Å²	16	41.3 Å²	41.3	6%	0.06	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	160.7	-171.7	-69.5	169	-169.3	-145.8	-6.1	112.1	C307 S328 F333 G346 S355 D357	C307-R330 PolarHBondContact N-O 3.08Å; S328-R330 WeakPolarHBondContact O-CG 3.4Å; S328-R330 PolarHBondContact O-N 2.96Å; S328-R330 PolarHBondContact OG-NE 3.17Å; S328-R330 PolarHBondContact OG-NH2 3.26Å; R330-F333 HydrophobicContact CB-CD1 3.99Å; R330-G346 WeakPolarHBondContact CD-O 3.43Å; R330-G346 PolarHBondContact NH1-O 3.31Å; R330-G346 VanDerWaalsContact NH1-O 3.13Å; R330-S355 PolarHBondContact NH1-OG 2.83Å; R330-S355 PolarHBondContact NH2-OG 2.83Å; R330-D357 IonicContact CZ-OD2 3.74Å; R330-D357 IonicContact NH1-OD2 3.85Å; R330-D357 IonicContact NH2-OD2 2.78Å; R330-D357 PolarHBondContact NH2-OD2 2.83Å
331	K	77.4	Confident	80.3	Confident	74 Å²	74	42 Å²	42	32%	0.322	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-108.1	151.4	171.4	-43.1	-164.1	171.5	173.5	0	110.5	F305 M306 F333 G347 R348	F305-K331 HydrophobicContact CB-CD 3.81Å; F305-K331 VanDerWaalsContact CB-CE 3.45Å; F305-K331 WeakPolarHBondContact O-CG 3.48Å; M306-K331 HydrophobicContact CE-CG 4.33Å; M306-K331 HydrophobicContact SD-CD 4.21Å; M306-K331 VanDerWaalsContact SD-CE 3.57Å; M306-K331 HydrophobicContact SD-CG 3.58Å; M306-K331 VanDerWaalsContact SD-CG 3.58Å; K331-F333 PolarHBondContact O-N 2.79Å; K331-G347 WeakPolarHBondContact O-CA 3.35Å; K331-R348 PolarHBondContact N-O 2.8Å; K331-R348 PolarHBondContact O-N 3.16Å
332	E	76.6	Confident	80.7	Confident	96 Å²	96	38.8 Å²	38.8	45%	0.449	22%	0.221	S	C	.	.	S	Bend	trans	51.4	33	170.4	-58.6	177.6	176.3	0	0	113.7	F379 G380	E332-F379 WeakPolarHBondContact OE2-CD2 3.4Å; E332-G380 PolarHBondContact O-N 3.5Å
333	F	82.9	Confident	81.1	Confident	11 Å²	11	35.3 Å²	35.3	5%	0.048	20%	0.198	C	C	.	.			trans	-79.9	163.6	165.9	66	-90.9	0	0	0	109.2	L300 C307 R330 K331 A335 I344 T345 T578 A579	L300-F333 HydrophobicContact CB-CE2 4.25Å; L300-F333 HydrophobicContact CB-CZ 3.98Å; L300-F333 HydrophobicContact CD2-CE2 4.34Å; C307-F333 HydrophobicContact CB-CE1 3.45Å; C307-F333 VanDerWaalsContact CB-CE1 3.45Å; C307-F333 HydrophobicContact CB-CZ 3.89Å; R330-F333 HydrophobicContact CB-CD1 3.99Å; K331-F333 PolarHBondContact O-N 2.79Å; F333-A335 HydrophobicContact CE2-CB 4.27Å; F333-I344 HydrophobicContact CB-CG2 4.28Å; F333-I344 HydrophobicContact CD2-CB 4.45Å; F333-I344 HydrophobicContact CD2-CG1 4.42Å; F333-I344 HydrophobicContact CD2-CG2 3.57Å; F333-I344 HydrophobicContact CE2-CD1 4.24Å; F333-I344 HydrophobicContact CE2-CG1 4.17Å; F333-I344 HydrophobicContact CE2-CG2 4.06Å; F333-I344 HydrophobicContact CG-CG2 3.99Å; F333-T345 WeakPolarHBondContact CB-O 3.4Å; F333-T578 HydrophobicContact CE1-CG2 4.32Å; F333-T578 WeakPolarHBondContact CE1-OG1 3.34Å; F333-T578 WeakPolarHBondContact CZ-OG1 3.49Å; F333-A579 HydrophobicContact CE2-CB 4.08Å
334	S	85.5	Confident	81.5	Confident	16 Å²	16	31.4 Å²	31.4	11%	0.112	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.4	173.3	-157	0	0	0	0	109.5	T345 H381 S383	S334-T345 PolarHBondContact N-O 3.09Å; S334-T345 PolarHBondContact O-N 2.93Å; S334-T345 PolarHBondContact O-OG1 2.6Å; S334-H381 VanDerWaalsContact CB-CD2 3.49Å; S334-H381 WeakPolarHBondContact CB-CD2 3.41Å; S334-H381 VanDerWaalsContact CB-NE2 3.31Å; S334-H381 WeakPolarHBondContact CB-NE2 3.19Å; S334-H381 WeakPolarHBondContact CB-O 3.36Å; S334-H381 PolarHBondContact OG-O 3.07Å; S334-S383 WeakPolarHBondContact CB-OG 3.44Å; S334-S383 WeakPolarHBondContact OG-CB 3.23Å; S334-S383 PolarHBondContact OG-N 3.41Å; S334-S383 PolarHBondContact OG-OG 3.39Å
335	A	87.6	Confident	81.9	Confident	14 Å²	14	30.5 Å²	30.5	12%	0.116	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.9	174.5	0	0	0	0	0	111.5	L300 F333 Y343 I344 S383 A579 V581	L300-A335 HydrophobicContact CD1-CB 3.78Å; F333-A335 HydrophobicContact CE2-CB 4.27Å; A335-Y343 CarbonylContact C-O 3.51Å; A335-Y343 WeakPolarHBondContact CA-O 3.34Å; A335-I344 HydrophobicContact CB-CG1 4.44Å; A335-S383 PolarHBondContact O-OG 3.15Å; A335-A579 HydrophobicContact CB-CB 3.51Å; A335-V581 HydrophobicContact CB-CG1 3.79Å
336	C	88.3	Confident	82.1	Confident	13 Å²	13	25.4 Å²	25.4	9%	0.088	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142.2	177.9	-172.5	0	0	0	0	109.5	Y343 A384 E385 L390	C336-Y343 PolarHBondContact N-O 3.23Å; C336-Y343 PolarHBondContact O-N 3.02Å; C336-A384 VanDerWaalsContact SG-C 3.59Å; C336-E385 PolarHBondContact SG-N 2.93Å; C336-L390 HydrophobicContact CB-CD1 3.38Å
337	A	85.3	Confident	82.2	Confident	20 Å²	20	24.9 Å²	24.9	17%	0.165	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.1	176.6	0	0	0	0	0	110.3	K341 V581 S582 T583	A337-K341 WeakPolarHBondContact CA-O 3.44Å; A337-V581 HydrophobicContact CB-CB 4.28Å; A337-S582 WeakPolarHBondContact CB-O 3.47Å; A337-T583 HydrophobicContact CB-CG2 3.53Å
338	I	80.7	Confident	82.4	Confident	7 Å²	7	28.3 Å²	28.3	4%	0.036	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	107.1	169.1	-49.5	-173.5	0	0	0	106.9	V282 C340 K341 Y343 E385 L390 P419	V282-I338 HydrophobicContact CG1-CG2 4.45Å; V282-I338 HydrophobicContact CG2-CG2 4.29Å; I338-C340 PolarHBondContact O-N 3.46Å; I338-K341 PolarHBondContact N-O 2.92Å; I338-K341 PolarHBondContact O-N 2.75Å; I338-K341 VanDerWaalsContact O-N 3.09Å; I338-Y343 HydrophobicContact CB-CD2 4.31Å; I338-Y343 HydrophobicContact CB-CE2 3.85Å; I338-Y343 HydrophobicContact CD1-CD2 4.3Å; I338-Y343 HydrophobicContact CD1-CE2 4.17Å; I338-Y343 HydrophobicContact CG1-CD2 4.02Å; I338-Y343 HydrophobicContact CG1-CE2 3.98Å; I338-E385 HydrophobicContact CB-CG 4.44Å; I338-E385 HydrophobicContact CD1-CG 4.16Å; I338-E385 HydrophobicContact CG1-CB 4.17Å; I338-E385 HydrophobicContact CG1-CG 3.8Å; I338-E385 HydrophobicContact CG2-CG 4.26Å; I338-L390 HydrophobicContact CD1-CB 3.85Å; I338-P419 HydrophobicContact CD1-CG 4.13Å
339	G	74.8	Confident	82.2	Confident	16 Å²	16	27.7 Å²	27.7	17%	0.165	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-122.9	-175	0	0	0	0	0	112.7	K341 W584	G339-K341 VanDerWaalsContact C-N 3.34Å; G339-W584 PolarHBondContact O-N 3.35Å; G339-W584 VanDerWaalsContact O-N 3.11Å
340	C	74.1	Confident	81.7	Confident	22 Å²	22	29.4 Å²	29.4	15%	0.149	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	13.3	176.6	-55.9	0	0	0	0	113.5	I338 T363 L364	I338-C340 PolarHBondContact O-N 3.46Å; C340-T363 WeakPolarHBondContact CB-OG1 3.42Å; C340-T363 WeakPolarHBondContact O-CB 3.45Å; C340-T363 WeakPolarHBondContact O-CG2 3.42Å; C340-T363 PolarHBondContact O-N 2.81Å; C340-T363 PolarHBondContact O-OG1 3.36Å; C340-L364 HydrophobicContact CB-CD1 4.44Å; C340-L364 HydrophobicContact CB-CD2 4.01Å; C340-L364 HydrophobicContact CB-CG 3.99Å
341	K	81.1	Confident	80.7	Confident	43 Å²	43	37.2 Å²	37.2	19%	0.187	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.8	-179.5	-69.7	-179.9	180	178.7	0	111.4	N279 A337 I338 G339 Y343 V360 Y361	N279-K341 WeakPolarHBondContact OD1-CE 3.47Å; N279-K341 PolarHBondContact OD1-NZ 2.85Å; A337-K341 WeakPolarHBondContact CA-O 3.44Å; I338-K341 PolarHBondContact N-O 2.92Å; I338-K341 PolarHBondContact O-N 2.75Å; I338-K341 VanDerWaalsContact O-N 3.09Å; G339-K341 VanDerWaalsContact C-N 3.34Å; K341-Y343 HydrophobicContact CB-CD2 4.32Å; K341-Y343 HydrophobicContact CB-CE2 3.55Å; K341-Y343 WeakPolarHBondContact CD-OH 3.27Å; K341-V360 HydrophobicContact CB-CG1 3.95Å; K341-V360 HydrophobicContact CD-CG1 3.94Å; K341-V360 HydrophobicContact CG-CG1 4.15Å; K341-Y361 WeakPolarHBondContact CA-O 3.48Å
342	V	87.5	Confident	79.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.2	171.5	-179.2	0	0	0	0	109.1	L300 V360 Y361 T363 V581 T583	L300-V342 HydrophobicContact CD1-CG1 4.43Å; V342-V360 CarbonylContact O-C 3.55Å; V342-V360 WeakPolarHBondContact O-CA 3.38Å; V342-Y361 PolarHBondContact N-O 3.07Å; V342-Y361 PolarHBondContact O-N 3.37Å; V342-T363 HydrophobicContact CG2-CG2 4.46Å; V342-V581 HydrophobicContact CG1-CG2 3.93Å; V342-V581 HydrophobicContact CG2-CG2 4Å; V342-T583 HydrophobicContact CG2-CG2 3.28Å
343	Y	88.5	Confident	79.5	Confident	8 Å²	8	38 Å²	38	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	122.2	177.5	-65.1	-98.1	0	0	0	109.5	A335 C336 I338 K341 V358 W359 V360 L390 Y417	A335-Y343 CarbonylContact C-O 3.51Å; A335-Y343 WeakPolarHBondContact CA-O 3.34Å; C336-Y343 PolarHBondContact N-O 3.23Å; C336-Y343 PolarHBondContact O-N 3.02Å; I338-Y343 HydrophobicContact CB-CD2 4.31Å; I338-Y343 HydrophobicContact CB-CE2 3.85Å; I338-Y343 HydrophobicContact CD1-CD2 4.3Å; I338-Y343 HydrophobicContact CD1-CE2 4.17Å; I338-Y343 HydrophobicContact CG1-CD2 4.02Å; I338-Y343 HydrophobicContact CG1-CE2 3.98Å; K341-Y343 HydrophobicContact CB-CD2 4.32Å; K341-Y343 HydrophobicContact CB-CE2 3.55Å; K341-Y343 WeakPolarHBondContact CD-OH 3.27Å; Y343-V358 HydrophobicContact CD1-CG1 4.46Å; Y343-W359 CarbonylContact C-O 3.57Å; Y343-W359 WeakPolarHBondContact CA-O 2.95Å; Y343-V360 HydrophobicContact CD1-CB 4.39Å; Y343-V360 HydrophobicContact CD1-CG1 4.2Å; Y343-V360 HydrophobicContact CD1-CG2 3.47Å; Y343-V360 VanDerWaalsContact CD1-CG2 3.47Å; Y343-V360 HydrophobicContact CE1-CB 4.28Å; Y343-V360 HydrophobicContact CE1-CG1 3.82Å; Y343-V360 HydrophobicContact CE1-CG2 3.43Å; Y343-V360 VanDerWaalsContact CE1-CG2 3.43Å; Y343-V360 HydrophobicContact CE2-CG1 4.38Å; Y343-V360 HydrophobicContact CG-CG2 4.41Å; Y343-L390 HydrophobicContact CD1-CD2 4.38Å; Y343-L390 HydrophobicContact CG-CD2 4.18Å; Y343-Y417 HydrophobicContact CD1-CE1 4.17Å; Y343-Y417 HydrophobicContact CE1-CD1 4.42Å; Y343-Y417 AromaticContact CE1-CE1 3.66Å; Y343-Y417 HydrophobicContact CE1-CE1 3.66Å
344	I	90	Very high	79.3	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	128.9	169	-66.3	180	0	0	0	108.1	L300 I326 F333 A335 V358 W359 W368	L300-I344 HydrophobicContact CD2-CD1 3.51Å; L300-I344 HydrophobicContact CD2-CG1 3.95Å; I326-I344 HydrophobicContact CD1-CD1 4.25Å; I326-I344 HydrophobicContact CG2-CD1 4.13Å; F333-I344 HydrophobicContact CB-CG2 4.28Å; F333-I344 HydrophobicContact CD2-CB 4.45Å; F333-I344 HydrophobicContact CD2-CG1 4.42Å; F333-I344 HydrophobicContact CD2-CG2 3.57Å; F333-I344 HydrophobicContact CE2-CD1 4.24Å; F333-I344 HydrophobicContact CE2-CG1 4.17Å; F333-I344 HydrophobicContact CE2-CG2 4.06Å; F333-I344 HydrophobicContact CG-CG2 3.99Å; A335-I344 HydrophobicContact CB-CG1 4.44Å; I344-V358 VanDerWaalsContact O-CA 3.28Å; I344-V358 WeakPolarHBondContact O-CA 3.22Å; I344-W359 HydrophobicContact CB-CB 4.24Å; I344-W359 PolarHBondContact N-O 2.95Å; I344-W359 PolarHBondContact O-N 2.98Å; I344-W368 HydrophobicContact CD1-CH2 3.4Å; I344-W368 HydrophobicContact CD1-CZ2 4.49Å; I344-W368 HydrophobicContact CD1-CZ3 3.65Å; I344-W368 HydrophobicContact CG1-CH2 4.21Å; I344-W368 HydrophobicContact CG1-CZ3 4.19Å
345	T	89.8	Confident	79.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	132.3	-178.2	54.7	0	0	0	0	111.8	F333 S334 V358 M374 H381 L390 V392 W424	F333-T345 WeakPolarHBondContact CB-O 3.4Å; S334-T345 PolarHBondContact N-O 3.09Å; S334-T345 PolarHBondContact O-N 2.93Å; S334-T345 PolarHBondContact O-OG1 2.6Å; T345-V358 HydrophobicContact CG2-CG1 4.09Å; T345-V358 HydrophobicContact CG2-CG2 4.29Å; T345-M374 HydrophobicContact CG2-SD 4.41Å; T345-H381 PolarHBondContact O-CE1 2.86Å; T345-H381 PolarHBondContact O-NE2 3.26Å; T345-H381 PolarHBondContact OG1-NE2 3.15Å; T345-L390 HydrophobicContact CG2-CD2 3.68Å; T345-V392 HydrophobicContact CG2-CG2 4.12Å; T345-W424 HydrophobicContact CG2-CH2 4.2Å; T345-W424 HydrophobicContact CG2-CZ2 4.38Å
346	G	86.9	Confident	79.2	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.244	C	C	.	.			trans	65.9	-140.6	168.1	0	0	0	0	0	114.9	R330 S355 D357	R330-G346 WeakPolarHBondContact CD-O 3.43Å; R330-G346 PolarHBondContact NH1-O 3.31Å; R330-G346 VanDerWaalsContact NH1-O 3.13Å; G346-S355 WeakPolarHBondContact CA-O 3.5Å; G346-D357 PolarHBondContact N-O 2.92Å; G346-D357 VanDerWaalsContact N-O 3.14Å
347	G	84	Confident	79.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.248	C	C	.	.			trans	96.8	177.3	-179.8	0	0	0	0	0	114.2	K331 S355 R378	K331-G347 WeakPolarHBondContact O-CA 3.35Å; G347-S355 PolarHBondContact O-N 3.4Å; G347-R378 PolarHBondContact N-O 3.15Å
348	R	79.9	Confident	79.3	Confident	139 Å²	139	43.2 Å²	43.2	53%	0.525	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-118.3	125.6	-177.7	-174	175.7	179.2	177.7	1.3	110.7	K331 F379	K331-R348 PolarHBondContact N-O 2.8Å; K331-R348 PolarHBondContact O-N 3.16Å; R348-F379 HydrophobicContact CB-CB 4.33Å; R348-F379 HydrophobicContact CB-CG 4.48Å
349	G	71.8	Confident	79.8	Confident	22 Å²	22	45 Å²	45	23%	0.227	25%	0.247	C	C	.	.			trans	-86.5	174.8	174.2	0	0	0	0	0	112.9	N352	G349-N352 PolarHBondContact N-O 3Å
350	S	64.4	Low	80.4	Confident	97 Å²	97	44.6 Å²	44.6	68%	0.678	24%	0.241	S	C	*	.	S	Bend	trans	-73.8	-43.3	172.5	33.2	0	0	0	0	112.2	M306	M306-S350 VanDerWaalsContact CE-N 3.35Å
351	E	57.9	Low	81	Confident	181 Å²	181	43.7 Å²	43.7	85%	0.846	23%	0.234	S	C	*	.	S	Bend	trans	-110.1	-17.3	-170.9	-65.6	-179.1	168.5	0	0	112.9
352	N	56.2	Low	81	Confident	129 Å²	129	42 Å²	42	69%	0.69	23%	0.227	S	C	*	.	S	Bend	trans	-114.3	134.9	179.5	-73	-26.2	0	0	0	110.2	G349	G349-N352 PolarHBondContact N-O 3Å
353	G	71.3	Confident	80.4	Confident	56 Å²	56	42.7 Å²	42.7	58%	0.577	23%	0.232	S	C	*	.			trans	-54	-179.1	170	0	0	0	0	0	112.7	S355	G353-S355 PolarHBondContact O-N 2.95Å
354	V	79.6	Confident	79.5	Confident	25 Å²	25	43.7 Å²	43.7	15%	0.152	24%	0.238	C	C	.	.	S	Bend	trans	-47.7	132.8	-177.7	-169.8	0	0	0	0	111.2	A377 F379 A398	V354-A377 HydrophobicContact CB-CB 4.25Å; V354-A377 HydrophobicContact CG1-CB 4.02Å; V354-A377 WeakPolarHBondContact CG1-O 3.43Å; V354-A377 WeakPolarHBondContact O-CB 3.27Å; V354-F379 HydrophobicContact CB-CD1 4.26Å; V354-F379 HydrophobicContact CG1-CB 4.41Å; V354-F379 HydrophobicContact CG1-CD1 3.79Å; V354-F379 HydrophobicContact CG2-CD1 3.43Å; V354-F379 VanDerWaalsContact CG2-CD1 3.43Å; V354-F379 HydrophobicContact CG2-CE1 3.64Å; V354-A398 HydrophobicContact CG2-CB 3.63Å
355	S	83.1	Confident	78.5	Confident	16 Å²	16	48 Å²	48	11%	0.112	26%	0.257	C	S	.	.			trans	-103.2	153.4	-174.5	-176.7	0	0	0	0	113.3	R330 G346 G347 G353 D357 A377 R378	R330-S355 PolarHBondContact NH1-OG 2.83Å; R330-S355 PolarHBondContact NH2-OG 2.83Å; G346-S355 WeakPolarHBondContact CA-O 3.5Å; G347-S355 PolarHBondContact O-N 3.4Å; G353-S355 PolarHBondContact O-N 2.95Å; S355-D357 PolarHBondContact OG-N 2.99Å; S355-D357 PolarHBondContact OG-OD2 3.49Å; S355-A377 WeakPolarHBondContact O-CA 3.26Å; S355-R378 PolarHBondContact O-N 2.91Å
356	K	87.4	Confident	78	Confident	110 Å²	110	53 Å²	53	48%	0.478	28%	0.281	S	S	.	.			trans	-106.2	-1.2	171.3	64.1	177.8	-178	178.5	0	113.5	P373 M374 A377	K356-P373 HydrophobicContact CD-CB 4.09Å; K356-P373 HydrophobicContact CG-CB 3.99Å; K356-P373 CarbonylContact O-C 3.53Å; K356-P373 WeakPolarHBondContact O-CA 3.23Å; K356-M374 HydrophobicContact CB-CB 4.31Å; K356-M374 PolarHBondContact O-N 2.83Å; K356-A377 HydrophobicContact CB-CB 4.2Å
357	D	88	Confident	77.8	Confident	34 Å²	34	59.4 Å²	59.4	18%	0.182	31%	0.311	C	S	.	.			trans	-67.6	149	-176.1	-59.7	-56.9	0	0	0	111.8	R330 G346 S355 K370	R330-D357 IonicContact CZ-OD2 3.74Å; R330-D357 IonicContact NH1-OD2 3.85Å; R330-D357 IonicContact NH2-OD2 2.78Å; R330-D357 PolarHBondContact NH2-OD2 2.83Å; G346-D357 PolarHBondContact N-O 2.92Å; G346-D357 VanDerWaalsContact N-O 3.14Å; S355-D357 PolarHBondContact OG-N 2.99Å; S355-D357 PolarHBondContact OG-OD2 3.49Å; D357-K370 WeakPolarHBondContact OD1-CE 3.32Å; D357-K370 IonicContact OD1-NZ 2.69Å; D357-K370 PolarHBondContact OD1-NZ 2.85Å
358	V	89	Confident	78	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122	176.4	-175.1	0	0	0	0	108	Y343 I344 T345 A371 A372 M374 W424	Y343-V358 HydrophobicContact CD1-CG1 4.46Å; I344-V358 VanDerWaalsContact O-CA 3.28Å; I344-V358 WeakPolarHBondContact O-CA 3.22Å; T345-V358 HydrophobicContact CG2-CG1 4.09Å; T345-V358 HydrophobicContact CG2-CG2 4.29Å; V358-A371 HydrophobicContact CB-CB 4.12Å; V358-A371 HydrophobicContact CG1-CB 3.94Å; V358-A371 PolarHBondContact O-N 2.83Å; V358-A372 WeakPolarHBondContact CG2-O 3.05Å; V358-M374 HydrophobicContact CG2-CG 3.69Å; V358-W424 HydrophobicContact CG1-CZ2 4.45Å; V358-W424 HydrophobicContact CG2-CZ2 3.66Å
359	W	89.9	Confident	78.4	Confident	44 Å²	44	58 Å²	58	17%	0.167	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	139.3	176.8	-68.4	100.5	0	0	0	109.6	P327 Y343 I344 W368 K370	P327-W359 HydrophobicContact CB-CD2 4.4Å; P327-W359 HydrophobicContact CB-CE3 4.24Å; P327-W359 HydrophobicContact CB-CH2 3.8Å; P327-W359 HydrophobicContact CB-CZ2 3.98Å; P327-W359 HydrophobicContact CB-CZ3 3.94Å; P327-W359 HydrophobicContact CG-CD2 4.43Å; P327-W359 HydrophobicContact CG-CE3 4.03Å; P327-W359 HydrophobicContact CG-CH2 4.39Å; P327-W359 HydrophobicContact CG-CZ3 4.01Å; Y343-W359 CarbonylContact C-O 3.57Å; Y343-W359 WeakPolarHBondContact CA-O 2.95Å; I344-W359 HydrophobicContact CB-CB 4.24Å; I344-W359 PolarHBondContact N-O 2.95Å; I344-W359 PolarHBondContact O-N 2.98Å; W359-W368 HydrophobicContact CB-CE3 3.93Å; W359-W368 HydrophobicContact CB-CZ3 3.95Å; W359-K370 HydrophobicContact CE3-CB 4.23Å; W359-K370 HydrophobicContact CH2-CB 4.47Å; W359-K370 HydrophobicContact CH2-CD 4.4Å; W359-K370 HydrophobicContact CZ3-CB 4Å; W359-K370 HydrophobicContact CZ3-CG 4.5Å
360	V	88.9	Confident	79.2	Confident	8 Å²	8	62.7 Å²	62.7	5%	0.048	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	118.5	-179.6	-171.6	0	0	0	0	108	K341 V342 Y343 W368 S369 A371	K341-V360 HydrophobicContact CB-CG1 3.95Å; K341-V360 HydrophobicContact CD-CG1 3.94Å; K341-V360 HydrophobicContact CG-CG1 4.15Å; V342-V360 CarbonylContact O-C 3.55Å; V342-V360 WeakPolarHBondContact O-CA 3.38Å; Y343-V360 HydrophobicContact CD1-CB 4.39Å; Y343-V360 HydrophobicContact CD1-CG1 4.2Å; Y343-V360 HydrophobicContact CD1-CG2 3.47Å; Y343-V360 VanDerWaalsContact CD1-CG2 3.47Å; Y343-V360 HydrophobicContact CE1-CB 4.28Å; Y343-V360 HydrophobicContact CE1-CG1 3.82Å; Y343-V360 HydrophobicContact CE1-CG2 3.43Å; Y343-V360 VanDerWaalsContact CE1-CG2 3.43Å; Y343-V360 HydrophobicContact CE2-CG1 4.38Å; Y343-V360 HydrophobicContact CG-CG2 4.41Å; V360-W368 WeakPolarHBondContact O-CA 3.47Å; V360-S369 PolarHBondContact N-O 3.27Å; V360-S369 PolarHBondContact O-N 3.41Å; V360-S369 PolarHBondContact O-OG 3.26Å; V360-A371 HydrophobicContact CG2-CB 3.61Å
361	Y	86.4	Confident	80.4	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.2	170.2	-175.1	-113.8	0	0	0	109	L310 A324 K341 V342 T363 W368	L310-Y361 HydrophobicContact CD2-CD1 3.39Å; L310-Y361 HydrophobicContact CD2-CD2 4.32Å; L310-Y361 HydrophobicContact CD2-CE1 3.21Å; L310-Y361 HydrophobicContact CD2-CE2 4.19Å; L310-Y361 HydrophobicContact CD2-CG 3.94Å; A324-Y361 HydrophobicContact CB-CE2 3.78Å; K341-Y361 WeakPolarHBondContact CA-O 3.48Å; V342-Y361 PolarHBondContact N-O 3.07Å; V342-Y361 PolarHBondContact O-N 3.37Å; Y361-T363 HydrophobicContact CD1-CG2 3.95Å; Y361-T363 HydrophobicContact CE1-CG2 4.05Å; Y361-W368 AromaticContact CD2-CD1 3.87Å; Y361-W368 AromaticContact CD2-CD2 3.75Å; Y361-W368 HydrophobicContact CD2-CD2 3.75Å; Y361-W368 AromaticContact CD2-CE2 3.48Å; Y361-W368 VanDerWaalsContact CD2-CE2 3.48Å; Y361-W368 HydrophobicContact CD2-CE3 4.38Å; Y361-W368 AromaticContact CD2-CG 3.99Å; Y361-W368 HydrophobicContact CD2-CG 3.99Å; Y361-W368 HydrophobicContact CD2-CH2 4.48Å; Y361-W368 AromaticContact CD2-CZ2 3.89Å; Y361-W368 HydrophobicContact CD2-CZ2 3.89Å; Y361-W368 AromaticContact CD2-NE1 3.58Å; Y361-W368 AromaticContact CE2-NE1 3.95Å; Y361-W368 HydrophobicContact CG-CD2 4.31Å; Y361-W368 HydrophobicContact CG-CH2 4.24Å; Y361-W368 HydrophobicContact CG-CZ2 4.02Å
362	D	80.6	Confident	81.8	Confident	7 Å²	7	51 Å²	51	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.9	171.8	-167.9	-17.9	0	0	0	108.8	N279 L364 H365 E366 E367	N279-D362 PolarHBondContact ND2-OD2 2.63Å; D362-L364 PolarHBondContact O-N 2.54Å; D362-L364 WeakPolarHBondContact OD1-CB 3.32Å; D362-L364 VanDerWaalsContact OD1-CG 3.31Å; D362-L364 WeakPolarHBondContact OD1-CG 3.45Å; D362-L364 PolarHBondContact OD1-N 2.81Å; D362-H365 IonicContact OD1-ND1 3.07Å; D362-H365 IonicContact OD2-CE1 2.6Å; D362-H365 IonicContact OD2-CG 2.68Å; D362-H365 IonicContact OD2-ND1 2.67Å; D362-H365 PolarHBondContact OD2-ND1 3.37Å; D362-E366 VanDerWaalsContact O-CA 3.28Å; D362-E366 WeakPolarHBondContact O-CA 3.27Å; D362-E366 PolarHBondContact O-N 3.02Å; D362-E367 PolarHBondContact N-O 3.27Å; D362-E367 PolarHBondContact O-N 3.45Å
363	T	75.2	Confident	83.4	Confident	16 Å²	16	47.7 Å²	47.7	10%	0.098	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-11	178.8	67.1	0	0	0	0	112.6	F298 C340 V342 Y361	F298-T363 HydrophobicContact CE2-CG2 3.69Å; F298-T363 HydrophobicContact CZ-CG2 3.96Å; C340-T363 WeakPolarHBondContact CB-OG1 3.42Å; C340-T363 WeakPolarHBondContact O-CB 3.45Å; C340-T363 WeakPolarHBondContact O-CG2 3.42Å; C340-T363 PolarHBondContact O-N 2.81Å; C340-T363 PolarHBondContact O-OG1 3.36Å; V342-T363 HydrophobicContact CG2-CG2 4.46Å; Y361-T363 HydrophobicContact CD1-CG2 3.95Å; Y361-T363 HydrophobicContact CE1-CG2 4.05Å
364	L	68.4	Low	84.3	Confident	29 Å²	29	45.2 Å²	45.2	15%	0.152	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-51	177.3	-55.1	176.7	0	0	0	111.4	I276 C340 D362 H586	I276-L364 HydrophobicContact CG2-CD1 3.79Å; C340-L364 HydrophobicContact CB-CD1 4.44Å; C340-L364 HydrophobicContact CB-CD2 4.01Å; C340-L364 HydrophobicContact CB-CG 3.99Å; D362-L364 PolarHBondContact O-N 2.54Å; D362-L364 WeakPolarHBondContact OD1-CB 3.32Å; D362-L364 VanDerWaalsContact OD1-CG 3.31Å; D362-L364 WeakPolarHBondContact OD1-CG 3.45Å; D362-L364 PolarHBondContact OD1-N 2.81Å; L364-H586 HydrophobicContact CD2-CB 3.8Å; L364-H586 WeakPolarHBondContact CD2-CD2 3.31Å
365	H	69.8	Low	84.7	Confident	93 Å²	93	48.5 Å²	48.5	43%	0.431	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-8.2	-176.4	-59.3	97.4	0	0	0	112.4	D362 E367	D362-H365 IonicContact OD1-ND1 3.07Å; D362-H365 IonicContact OD2-CE1 2.6Å; D362-H365 IonicContact OD2-CG 2.68Å; D362-H365 IonicContact OD2-ND1 2.67Å; D362-H365 PolarHBondContact OD2-ND1 3.37Å; H365-E367 HydrophobicContact CB-CB 4.35Å; H365-E367 HydrophobicContact CB-CG 4.33Å; H365-E367 PolarHBondContact O-N 2.83Å
366	E	79.8	Confident	84.8	Confident	104 Å²	104	49 Å²	49	49%	0.486	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	30.7	-172	-60.2	-167.5	148.8	0	0	113.2	K323 D362	K323-E366 IonicContact NZ-OE1 2.79Å; K323-E366 PolarHBondContact NZ-OE1 3.43Å; D362-E366 VanDerWaalsContact O-CA 3.28Å; D362-E366 WeakPolarHBondContact O-CA 3.27Å; D362-E366 PolarHBondContact O-N 3.02Å
367	E	82.8	Confident	84.7	Confident	136 Å²	136	45 Å²	45	64%	0.636	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114	148.1	-175.5	-73.5	-176.9	178.9	0	0	113.2	D362 H365	D362-E367 PolarHBondContact N-O 3.27Å; D362-E367 PolarHBondContact O-N 3.45Å; H365-E367 HydrophobicContact CB-CB 4.35Å; H365-E367 HydrophobicContact CB-CG 4.33Å; H365-E367 PolarHBondContact O-N 2.83Å
368	W	87.1	Confident	84.6	Confident	49 Å²	49	43.4 Å²	43.4	19%	0.186	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132.6	172	-72.6	98.2	0	0	0	111.3	L310 D325 I326 P327 I344 W359 V360 Y361	L310-W368 HydrophobicContact CD2-CZ2 4.44Å; D325-W368 PolarHBondContact O-NE1 3.07Å; I326-W368 HydrophobicContact CG1-CH2 4.34Å; I326-W368 HydrophobicContact CG1-CZ2 3.92Å; P327-W368 HydrophobicContact CG-CB 3.7Å; P327-W368 HydrophobicContact CG-CD2 4.17Å; P327-W368 HydrophobicContact CG-CG 3.71Å; I344-W368 HydrophobicContact CD1-CH2 3.4Å; I344-W368 HydrophobicContact CD1-CZ2 4.49Å; I344-W368 HydrophobicContact CD1-CZ3 3.65Å; I344-W368 HydrophobicContact CG1-CH2 4.21Å; I344-W368 HydrophobicContact CG1-CZ3 4.19Å; W359-W368 HydrophobicContact CB-CE3 3.93Å; W359-W368 HydrophobicContact CB-CZ3 3.95Å; V360-W368 WeakPolarHBondContact O-CA 3.47Å; Y361-W368 AromaticContact CD2-CD1 3.87Å; Y361-W368 AromaticContact CD2-CD2 3.75Å; Y361-W368 HydrophobicContact CD2-CD2 3.75Å; Y361-W368 AromaticContact CD2-CE2 3.48Å; Y361-W368 VanDerWaalsContact CD2-CE2 3.48Å; Y361-W368 HydrophobicContact CD2-CE3 4.38Å; Y361-W368 AromaticContact CD2-CG 3.99Å; Y361-W368 HydrophobicContact CD2-CG 3.99Å; Y361-W368 HydrophobicContact CD2-CH2 4.48Å; Y361-W368 AromaticContact CD2-CZ2 3.89Å; Y361-W368 HydrophobicContact CD2-CZ2 3.89Å; Y361-W368 AromaticContact CD2-NE1 3.58Å; Y361-W368 AromaticContact CE2-NE1 3.95Å; Y361-W368 HydrophobicContact CG-CD2 4.31Å; Y361-W368 HydrophobicContact CG-CH2 4.24Å; Y361-W368 HydrophobicContact CG-CZ2 4.02Å
369	S	88.4	Confident	84.5	Confident	61 Å²	61	44.4 Å²	44.4	43%	0.427	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156.8	173.1	61.5	0	0	0	0	111	V360	V360-S369 PolarHBondContact N-O 3.27Å; V360-S369 PolarHBondContact O-N 3.41Å; V360-S369 PolarHBondContact O-OG 3.26Å
370	K	88.3	Confident	84	Confident	119 Å²	119	42.6 Å²	42.6	52%	0.517	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	125	177.7	-165.9	171.9	-176	173	0	109.7	D357 W359	D357-K370 WeakPolarHBondContact OD1-CE 3.32Å; D357-K370 IonicContact OD1-NZ 2.69Å; D357-K370 PolarHBondContact OD1-NZ 2.85Å; W359-K370 HydrophobicContact CE3-CB 4.23Å; W359-K370 HydrophobicContact CH2-CB 4.47Å; W359-K370 HydrophobicContact CH2-CD 4.4Å; W359-K370 HydrophobicContact CZ3-CB 4Å; W359-K370 HydrophobicContact CZ3-CG 4.5Å
371	A	89.3	Confident	83.9	Confident	11 Å²	11	42.7 Å²	42.7	9%	0.091	23%	0.226	C	C	.	.			trans	-92.2	175.3	174.2	0	0	0	0	0	111.6	V358 V360	V358-A371 HydrophobicContact CB-CB 4.12Å; V358-A371 HydrophobicContact CG1-CB 3.94Å; V358-A371 PolarHBondContact O-N 2.83Å; V360-A371 HydrophobicContact CG2-CB 3.61Å
372	A	88.3	Confident	83.9	Confident	22 Å²	22	43 Å²	43	18%	0.182	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-54.6	134.6	173.7	0	0	0	0	0	110.5	V358 Y417 N422 W424	V358-A372 WeakPolarHBondContact CG2-O 3.05Å; A372-Y417 HydrophobicContact CB-CE2 4.34Å; A372-N422 WeakPolarHBondContact CB-O 3.42Å; A372-N422 VanDerWaalsContact CB-OD1 3.25Å; A372-N422 WeakPolarHBondContact CB-OD1 3.4Å; A372-N422 PolarHBondContact N-OD1 3.15Å; A372-W424 PolarHBondContact O-NE1 3.38Å
373	P	89.4	Confident	84.4	Confident	60 Å²	60	43.3 Å²	43.3	39%	0.39	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-68.3	148.1	179.4	29.2	-34.5	0	0	0	110.6	K356	K356-P373 HydrophobicContact CD-CB 4.09Å; K356-P373 HydrophobicContact CG-CB 3.99Å; K356-P373 CarbonylContact O-C 3.53Å; K356-P373 WeakPolarHBondContact O-CA 3.23Å
374	M	90.1	Very high	85.1	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.02	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-57.7	156.3	172.1	-61.1	-174.1	-60.9	0	0	111	T345 K356 V358 V376 R378 V392 W424	T345-M374 HydrophobicContact CG2-SD 4.41Å; K356-M374 HydrophobicContact CB-CB 4.31Å; K356-M374 PolarHBondContact O-N 2.83Å; V358-M374 HydrophobicContact CG2-CG 3.69Å; M374-V376 VanDerWaalsContact C-N 3.34Å; M374-R378 HydrophobicContact CE-CG 3.91Å; M374-R378 HydrophobicContact SD-CG 4.41Å; M374-V392 HydrophobicContact SD-CG1 4.15Å; M374-V392 HydrophobicContact SD-CG2 4.34Å; M374-W424 HydrophobicContact CG-CD2 4.31Å; M374-W424 HydrophobicContact CG-CH2 3.95Å; M374-W424 HydrophobicContact CG-CZ2 3.68Å; M374-W424 HydrophobicContact CG-CZ3 4.37Å; M374-W424 HydrophobicContact SD-CH2 4.4Å
375	L	87.5	Confident	86.1	Confident	93 Å²	93	44.2 Å²	44.2	49%	0.487	24%	0.235	S	C	.	.	S	Bend	trans	-70.4	-36.4	175.5	-54.7	173.5	0	0	0	110.5	E415 W424 M426	L375-E415 WeakPolarHBondContact CA-OE2 3.42Å; L375-E415 WeakPolarHBondContact CB-OE2 3.46Å; L375-E415 WeakPolarHBondContact CG-OE2 3.36Å; L375-E415 PolarHBondContact N-OE2 3.31Å; L375-W424 HydrophobicContact CD1-CB 4.23Å; L375-W424 HydrophobicContact CD2-CB 4.18Å; L375-W424 HydrophobicContact CG-CB 3.82Å; L375-M426 HydrophobicContact CB-SD 4.5Å; L375-M426 HydrophobicContact CD1-CG 3.67Å; L375-M426 HydrophobicContact CD1-SD 3.66Å
376	V	85.3	Confident	86.9	Confident	28 Å²	28	40 Å²	40	17%	0.17	22%	0.216	C	C	.	.	S	Bend	trans	-123.7	127.4	-178.2	-173.5	0	0	0	0	111.2	M374 R378 L411 E415	M374-V376 VanDerWaalsContact C-N 3.34Å; V376-R378 PolarHBondContact O-N 3.48Å; V376-L411 HydrophobicContact CG1-CD1 4.09Å; V376-E415 VanDerWaalsContact CB-OE1 3.26Å; V376-E415 WeakPolarHBondContact CB-OE1 3.48Å; V376-E415 WeakPolarHBondContact CG2-OE1 3.26Å; V376-E415 PolarHBondContact N-OE1 2.77Å
377	A	85.7	Confident	87	Confident	26 Å²	26	39.2 Å²	39.2	22%	0.215	21%	0.211	C	C	.	.			trans	-69.8	123.3	173.1	0	0	0	0	0	110.5	V354 S355 K356 T397	V354-A377 HydrophobicContact CB-CB 4.25Å; V354-A377 HydrophobicContact CG1-CB 4.02Å; V354-A377 WeakPolarHBondContact CG1-O 3.43Å; V354-A377 WeakPolarHBondContact O-CB 3.27Å; S355-A377 WeakPolarHBondContact O-CA 3.26Å; K356-A377 HydrophobicContact CB-CB 4.2Å; A377-T397 WeakPolarHBondContact O-CB 3.13Å; A377-T397 PolarHBondContact O-OG1 2.86Å
378	R	87.1	Confident	86.8	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.			trans	-145.5	157.1	-176.7	60.5	178.6	83.7	-156.9	5.3	114.5	G347 S355 M374 V376 H381 V392 G394 H396 L411 Q413 E415	G347-R378 PolarHBondContact N-O 3.15Å; S355-R378 PolarHBondContact O-N 2.91Å; M374-R378 HydrophobicContact CE-CG 3.91Å; M374-R378 HydrophobicContact SD-CG 4.41Å; V376-R378 PolarHBondContact O-N 3.48Å; R378-H381 HydrophobicContact CG-CB 4.24Å; R378-V392 HydrophobicContact CG-CG1 4.45Å; R378-G394 WeakPolarHBondContact CD-O 3.12Å; R378-G394 PolarHBondContact NH1-O 3.27Å; R378-H396 CarbonylContact C-O 3.48Å; R378-H396 WeakPolarHBondContact CA-O 3.5Å; R378-L411 HydrophobicContact CB-CD1 3.97Å; R378-Q413 PolarHBondContact NH1-O 3.47Å; R378-E415 IonicContact CZ-OE1 2.66Å; R378-E415 IonicContact NE-OE1 3.11Å; R378-E415 IonicContact NH2-OE1 2.77Å; R378-E415 PolarHBondContact NH2-OE1 3.04Å
379	F	85.5	Confident	86.8	Confident	20 Å²	20	34.5 Å²	34.5	9%	0.088	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-138.5	156.6	172.3	70.1	-85.5	0	0	0	110.9	E332 R348 V354 H381 G395 H396	E332-F379 WeakPolarHBondContact OE2-CD2 3.4Å; R348-F379 HydrophobicContact CB-CB 4.33Å; R348-F379 HydrophobicContact CB-CG 4.48Å; V354-F379 HydrophobicContact CB-CD1 4.26Å; V354-F379 HydrophobicContact CG1-CB 4.41Å; V354-F379 HydrophobicContact CG1-CD1 3.79Å; V354-F379 HydrophobicContact CG2-CD1 3.43Å; V354-F379 VanDerWaalsContact CG2-CD1 3.43Å; V354-F379 HydrophobicContact CG2-CE1 3.64Å; F379-H381 PolarHBondContact O-N 3.12Å; F379-G395 WeakPolarHBondContact O-CA 3.48Å; F379-H396 HydrophobicContact CD1-CB 3.88Å; F379-H396 VanDerWaalsContact CD1-O 3.3Å; F379-H396 WeakPolarHBondContact CD1-O 3.42Å; F379-H396 HydrophobicContact CD2-CB 4.24Å; F379-H396 HydrophobicContact CE1-CB 3.4Å; F379-H396 VanDerWaalsContact CE1-CB 3.4Å; F379-H396 HydrophobicContact CE2-CB 3.81Å; F379-H396 AromaticContact CE2-ND1 3.92Å; F379-H396 HydrophobicContact CG-CB 4.31Å; F379-H396 HydrophobicContact CZ-CB 3.37Å; F379-H396 PolarHBondContact N-O 2.77Å; F379-H396 PolarHBondContact O-N 3.41Å
380	G	79.1	Confident	86.9	Confident	7 Å²	7	31.6 Å²	31.6	7%	0.072	17%	0.172	C	C	.	.	S	Bend	trans	63	25.3	-176.4	0	0	0	0	0	113.4	E332 N436	E332-G380 PolarHBondContact O-N 3.5Å; G380-N436 WeakPolarHBondContact CA-OD1 3.42Å; G380-N436 PolarHBondContact O-N 3.24Å
381	H	87.9	Confident	87	Confident	10 Å²	10	25.9 Å²	25.9	5%	0.046	15%	0.147	C	C	.	.			trans	-87.5	157.8	174.1	60	-79.4	0	0	0	111	S334 T345 R378 F379 V392 G394	S334-H381 VanDerWaalsContact CB-CD2 3.49Å; S334-H381 WeakPolarHBondContact CB-CD2 3.41Å; S334-H381 VanDerWaalsContact CB-NE2 3.31Å; S334-H381 WeakPolarHBondContact CB-NE2 3.19Å; S334-H381 WeakPolarHBondContact CB-O 3.36Å; S334-H381 PolarHBondContact OG-O 3.07Å; T345-H381 PolarHBondContact O-CE1 2.86Å; T345-H381 PolarHBondContact O-NE2 3.26Å; T345-H381 PolarHBondContact OG1-NE2 3.15Å; R378-H381 HydrophobicContact CG-CB 4.24Å; F379-H381 PolarHBondContact O-N 3.12Å; H381-V392 HydrophobicContact CB-CG1 4.43Å; H381-V392 VanDerWaalsContact CD2-CG1 3.5Å; H381-V392 WeakPolarHBondContact CD2-CG1 3.46Å; H381-G394 WeakPolarHBondContact CB-O 3.36Å
382	G	87.2	Confident	87.1	Confident	8 Å²	8	25.4 Å²	25.4	8%	0.082	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	145.9	169.3	0	0	0	0	0	110.8	V393	G382-V393 PolarHBondContact N-O 2.76Å; G382-V393 VanDerWaalsContact N-O 3.07Å; G382-V393 PolarHBondContact O-N 3.37Å
383	S	90.5	Very high	87.1	Confident	13 Å²	13	24.4 Å²	24.4	9%	0.091	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.6	171.9	64.3	0	0	0	0	110.6	S334 A335 Y391	S334-S383 WeakPolarHBondContact CB-OG 3.44Å; S334-S383 WeakPolarHBondContact OG-CB 3.23Å; S334-S383 PolarHBondContact OG-N 3.41Å; S334-S383 PolarHBondContact OG-OG 3.39Å; A335-S383 PolarHBondContact O-OG 3.15Å; S383-Y391 VanDerWaalsContact CA-O 3.24Å; S383-Y391 WeakPolarHBondContact CA-O 3.49Å
384	A	90.6	Very high	87	Confident	6 Å²	6	21.6 Å²	21.6	5%	0.05	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	149.9	178.7	0	0	0	0	0	111	C336 Y391 V439 L446	C336-A384 VanDerWaalsContact SG-C 3.59Å; A384-Y391 PolarHBondContact N-O 3.09Å; A384-Y391 PolarHBondContact O-N 3.11Å; A384-V439 HydrophobicContact CB-CG1 3.96Å; A384-L446 HydrophobicContact CB-CD2 3.63Å
385	E	88.4	Confident	86.7	Confident	58 Å²	58	21.4 Å²	21.4	27%	0.271	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.2	176.3	179.2	-88	136.5	0	0	109.2	C336 I338 K387 H388 C389 S441	C336-E385 PolarHBondContact SG-N 2.93Å; I338-E385 HydrophobicContact CB-CG 4.44Å; I338-E385 HydrophobicContact CD1-CG 4.16Å; I338-E385 HydrophobicContact CG1-CB 4.17Å; I338-E385 HydrophobicContact CG1-CG 3.8Å; I338-E385 HydrophobicContact CG2-CG 4.26Å; E385-K387 PolarHBondContact OE1-N 2.92Å; E385-H388 WeakPolarHBondContact OE1-CA 3.2Å; E385-H388 PolarHBondContact OE1-N 3.43Å; E385-C389 WeakPolarHBondContact CA-O 3.21Å; E385-S441 WeakPolarHBondContact O-CB 3.25Å; E385-S441 PolarHBondContact O-OG 2.91Å
386	L	85.8	Confident	86.3	Confident	5 Å²	5	17.8 Å²	17.8	3%	0.026	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	119.4	172	175.4	74.4	0	0	0	109.1	H388 C389 Y391 L444 L446 Q467	L386-H388 PolarHBondContact O-N 3.13Å; L386-C389 PolarHBondContact N-O 2.87Å; L386-C389 PolarHBondContact O-N 2.8Å; L386-C389 VanDerWaalsContact O-N 3.07Å; L386-Y391 HydrophobicContact CB-CD2 3.75Å; L386-Y391 HydrophobicContact CB-CE2 3.66Å; L386-Y391 HydrophobicContact CD2-CE2 3.96Å; L386-Y391 HydrophobicContact CG-CE2 4.2Å; L386-L444 VanDerWaalsContact CD1-C 3.42Å; L386-L446 HydrophobicContact CB-CD1 4.39Å; L386-L446 HydrophobicContact CB-CD2 4.1Å; L386-L446 HydrophobicContact CB-CG 4.17Å; L386-L446 HydrophobicContact CD2-CD1 4.07Å; L386-L446 HydrophobicContact CD2-CG 3.99Å; L386-Q467 HydrophobicContact CD2-CB 4.1Å; L386-Q467 HydrophobicContact CD2-CG 4.48Å
387	K	82.1	Confident	85.9	Confident	87 Å²	87	18.2 Å²	18.2	38%	0.378	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	47.8	-178.6	-61	-168.5	-167.1	156.7	0	111.8	E385 C389 L444	E385-K387 PolarHBondContact OE1-N 2.92Å; K387-C389 PolarHBondContact O-N 3.37Å; K387-C389 VanDerWaalsContact O-N 3.12Å; K387-L444 HydrophobicContact CD-CD2 4.47Å; K387-L444 HydrophobicContact CG-CD2 3.95Å
388	H	79.3	Confident	84.9	Confident	70 Å²	70	19.6 Å²	19.6	32%	0.324	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	9.6	177.9	-47.7	-61.3	0	0	0	115.4	V282 T284 E385 L386 P419	V282-H388 HydrophobicContact CB-CB 4.04Å; V282-H388 HydrophobicContact CG1-CB 3.78Å; V282-H388 HydrophobicContact CG2-CB 4.11Å; T284-H388 WeakPolarHBondContact CG2-CD2 3.31Å; T284-H388 VanDerWaalsContact CG2-NE2 3.34Å; T284-H388 WeakPolarHBondContact CG2-NE2 3.38Å; E385-H388 WeakPolarHBondContact OE1-CA 3.2Å; E385-H388 PolarHBondContact OE1-N 3.43Å; L386-H388 PolarHBondContact O-N 3.13Å; H388-P419 WeakPolarHBondContact O-CD 3.36Å; H388-P419 WeakPolarHBondContact O-CG 3.36Å
389	C	86.4	Confident	83.3	Confident	16 Å²	16	22.5 Å²	22.5	11%	0.108	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	145.2	170.6	-64.1	0	0	0	0	109.7	E385 L386 K387 Y391 Q416 Y417	E385-C389 WeakPolarHBondContact CA-O 3.21Å; L386-C389 PolarHBondContact N-O 2.87Å; L386-C389 PolarHBondContact O-N 2.8Å; L386-C389 VanDerWaalsContact O-N 3.07Å; K387-C389 PolarHBondContact O-N 3.37Å; K387-C389 VanDerWaalsContact O-N 3.12Å; C389-Y391 HydrophobicContact CB-CD2 4.4Å; C389-Y391 HydrophobicContact CB-CE2 3.87Å; C389-Q416 HydrophobicContact CB-CG 3.93Å; C389-Q416 PolarHBondContact SG-NE2 3.32Å; C389-Y417 WeakPolarHBondContact CA-O 3.24Å; C389-Y417 WeakPolarHBondContact CB-O 3.34Å
390	L	90.4	Very high	81.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.3	175.4	177.4	64.8	0	0	0	109.1	C336 I338 Y343 T345 V392 Q416 Y417 W424	C336-L390 HydrophobicContact CB-CD1 3.38Å; I338-L390 HydrophobicContact CD1-CB 3.85Å; Y343-L390 HydrophobicContact CD1-CD2 4.38Å; Y343-L390 HydrophobicContact CG-CD2 4.18Å; T345-L390 HydrophobicContact CG2-CD2 3.68Å; L390-V392 HydrophobicContact CG-CG2 4.48Å; L390-Q416 CarbonylContact O-C 3.59Å; L390-Q416 WeakPolarHBondContact O-CA 3.5Å; L390-Y417 HydrophobicContact CB-CD1 4.15Å; L390-Y417 HydrophobicContact CD2-CD1 4.49Å; L390-Y417 PolarHBondContact N-O 2.95Å; L390-Y417 PolarHBondContact O-N 3.16Å; L390-W424 HydrophobicContact CD2-CH2 3.99Å; L390-W424 HydrophobicContact CD2-CZ2 4.43Å; L390-W424 HydrophobicContact CG-CH2 4.4Å
391	Y	91.3	Very high	79.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.1	174.1	-74.6	-99.3	0	0	0	110.4	S383 A384 L386 C389 V414 E415 Q416 V427 L446 Y465 Q467	S383-Y391 VanDerWaalsContact CA-O 3.24Å; S383-Y391 WeakPolarHBondContact CA-O 3.49Å; A384-Y391 PolarHBondContact N-O 3.09Å; A384-Y391 PolarHBondContact O-N 3.11Å; L386-Y391 HydrophobicContact CB-CD2 3.75Å; L386-Y391 HydrophobicContact CB-CE2 3.66Å; L386-Y391 HydrophobicContact CD2-CE2 3.96Å; L386-Y391 HydrophobicContact CG-CE2 4.2Å; C389-Y391 HydrophobicContact CB-CD2 4.4Å; C389-Y391 HydrophobicContact CB-CE2 3.87Å; Y391-V414 HydrophobicContact CD1-CG1 4.43Å; Y391-E415 WeakPolarHBondContact CA-O 3.21Å; Y391-Q416 HydrophobicContact CD1-CB 3.97Å; Y391-Q416 HydrophobicContact CD1-CG 4.3Å; Y391-Q416 HydrophobicContact CD2-CG 4.46Å; Y391-Q416 HydrophobicContact CE1-CB 3.66Å; Y391-Q416 HydrophobicContact CE1-CG 3.77Å; Y391-Q416 HydrophobicContact CE2-CG 3.96Å; Y391-Q416 PolarHBondContact OH-NE2 2.83Å; Y391-Q416 PolarHBondContact OH-OE1 2.92Å; Y391-V427 HydrophobicContact CD1-CG2 4.4Å; Y391-V427 HydrophobicContact CE1-CG1 4.22Å; Y391-V427 HydrophobicContact CE1-CG2 4.31Å; Y391-L446 HydrophobicContact CD1-CD1 3.59Å; Y391-L446 HydrophobicContact CD2-CD1 3.85Å; Y391-L446 HydrophobicContact CE1-CD1 4.18Å; Y391-L446 HydrophobicContact CE2-CD1 4.4Å; Y391-L446 HydrophobicContact CG-CD1 3.39Å; Y391-Y465 AromaticContact CE1-CE1 3.94Å; Y391-Y465 HydrophobicContact CE1-CE1 3.94Å; Y391-Q467 PolarHBondContact OH-NE2 2.95Å
392	V	91.1	Very high	77.4	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.7	178.7	168.2	0	0	0	0	108.8	T345 M374 R378 H381 L390 V414 E415 W424	T345-V392 HydrophobicContact CG2-CG2 4.12Å; M374-V392 HydrophobicContact SD-CG1 4.15Å; M374-V392 HydrophobicContact SD-CG2 4.34Å; R378-V392 HydrophobicContact CG-CG1 4.45Å; H381-V392 HydrophobicContact CB-CG1 4.43Å; H381-V392 VanDerWaalsContact CD2-CG1 3.5Å; H381-V392 WeakPolarHBondContact CD2-CG1 3.46Å; L390-V392 HydrophobicContact CG-CG2 4.48Å; V392-V414 WeakPolarHBondContact O-CA 3.43Å; V392-V414 WeakPolarHBondContact O-CG1 3.29Å; V392-E415 PolarHBondContact N-O 2.88Å; V392-E415 PolarHBondContact O-N 3.07Å; V392-W424 HydrophobicContact CB-CH2 4.42Å; V392-W424 HydrophobicContact CB-CZ3 4.09Å; V392-W424 HydrophobicContact CG2-CH2 3.6Å; V392-W424 HydrophobicContact CG2-CZ3 3.75Å
393	V	89.8	Confident	74.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.1	-166.4	178.9	0	0	0	0	110.4	G382 V414 L430 V439 A448 W472	G382-V393 PolarHBondContact N-O 2.76Å; G382-V393 VanDerWaalsContact N-O 3.07Å; G382-V393 PolarHBondContact O-N 3.37Å; V393-V414 HydrophobicContact CB-CG2 4.48Å; V393-V414 HydrophobicContact CG1-CG2 4.15Å; V393-V414 HydrophobicContact CG2-CG1 3.77Å; V393-V414 HydrophobicContact CG2-CG2 4.36Å; V393-L430 HydrophobicContact CG1-CD1 3.75Å; V393-L430 HydrophobicContact CG1-CD2 3.85Å; V393-L430 HydrophobicContact CG1-CG 4.1Å; V393-V439 HydrophobicContact CB-CG1 4.15Å; V393-V439 HydrophobicContact CB-CG2 4.02Å; V393-V439 HydrophobicContact CG1-CG2 4.16Å; V393-V439 HydrophobicContact CG2-CG1 3.91Å; V393-A448 HydrophobicContact CG1-CB 4.45Å; V393-W472 HydrophobicContact CG1-CH2 4.04Å; V393-W472 HydrophobicContact CG1-CZ2 4.26Å; V393-W472 HydrophobicContact CG2-CH2 4.2Å; V393-W472 HydrophobicContact CG2-CZ2 4.22Å
394	G	86.1	Confident	72.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	31%	0.306	C	S	.	.			trans	67.9	-147.1	171.1	0	0	0	0	0	114.6	R378 H381 Q413 V434	R378-G394 WeakPolarHBondContact CD-O 3.12Å; R378-G394 PolarHBondContact NH1-O 3.27Å; H381-G394 WeakPolarHBondContact CB-O 3.36Å; G394-Q413 PolarHBondContact N-O 2.86Å; G394-V434 WeakPolarHBondContact CA-O 3.5Å
395	G	83.8	Confident	69.9	Low	1 Å²	1	52.6 Å²	52.6	1%	0.01	34%	0.341	C	S	.	.			trans	97.1	-171.5	-178.5	0	0	0	0	0	113.7	F379 L411 V434	F379-G395 WeakPolarHBondContact O-CA 3.48Å; G395-L411 WeakPolarHBondContact O-CB 3.23Å; G395-L411 PolarHBondContact O-N 3.03Å; G395-V434 PolarHBondContact N-O 3.44Å
396	H	80.2	Confident	67.7	Low	17 Å²	17	52.9 Å²	52.9	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.1	178.3	-67.3	110.7	0	0	0	110.8	R378 F379 S408 S435	R378-H396 CarbonylContact C-O 3.48Å; R378-H396 WeakPolarHBondContact CA-O 3.5Å; F379-H396 HydrophobicContact CD1-CB 3.88Å; F379-H396 VanDerWaalsContact CD1-O 3.3Å; F379-H396 WeakPolarHBondContact CD1-O 3.42Å; F379-H396 HydrophobicContact CD2-CB 4.24Å; F379-H396 HydrophobicContact CE1-CB 3.4Å; F379-H396 VanDerWaalsContact CE1-CB 3.4Å; F379-H396 HydrophobicContact CE2-CB 3.81Å; F379-H396 AromaticContact CE2-ND1 3.92Å; F379-H396 HydrophobicContact CG-CB 4.31Å; F379-H396 HydrophobicContact CZ-CB 3.37Å; F379-H396 PolarHBondContact N-O 2.77Å; F379-H396 PolarHBondContact O-N 3.41Å; H396-S408 WeakPolarHBondContact CD2-CB 3.21Å; H396-S408 PolarHBondContact CD2-OG 2.9Å; H396-S408 VanDerWaalsContact CD2-OG 3.27Å; H396-S408 PolarHBondContact NE2-OG 2.81Å; H396-S435 WeakPolarHBondContact CE1-CB 2.76Å; H396-S435 PolarHBondContact CE1-OG 2.99Å; H396-S435 WeakPolarHBondContact ND1-CB 3.26Å; H396-S435 PolarHBondContact NE2-OG 2.78Å; H396-S435 VanDerWaalsContact NE2-OG 3.12Å
397	T	76.8	Confident	65.9	Low	36 Å²	36	58 Å²	58	22%	0.221	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	151.8	165.2	-159.9	0	0	0	0	110.5	A377 L411	A377-T397 WeakPolarHBondContact O-CB 3.13Å; A377-T397 PolarHBondContact O-OG1 2.86Å; T397-L411 HydrophobicContact CG2-CD2 3.81Å; T397-L411 HydrophobicContact CG2-CG 4.4Å
398	A	64.3	Low	64.7	Low	55 Å²	55	56.9 Å²	56.9	46%	0.455	39%	0.386	S	S	.	.			trans	-83.2	117	168.2	0	0	0	0	0	107.6	V354 T400	V354-A398 HydrophobicContact CG2-CB 3.63Å; A398-T400 PolarHBondContact O-N 3.42Å
399	A	53.5	Low	64	Low	62 Å²	62	57.8 Å²	57.8	51%	0.512	40%	0.396	S	S	.	.			trans	-65.2	103.4	171.8	0	0	0	0	0	108.7	G401	A399-G401 PolarHBondContact O-N 3.19Å; A399-G401 VanDerWaalsContact O-N 3.13Å
400	T	43.9	Very low	63.4	Low	146 Å²	146	57.8 Å²	57.8	90%	0.896	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	110.5	167.7	42.3	0	0	0	0	108.3	A398	A398-T400 PolarHBondContact O-N 3.42Å
401	G	46.3	Very low	62.8	Low	77 Å²	77	58.7 Å²	58.7	79%	0.794	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.3	-2.7	168.4	0	0	0	0	0	117.6	A399	A399-G401 PolarHBondContact O-N 3.19Å; A399-G401 VanDerWaalsContact O-N 3.13Å
402	C	36.9	Very low	62.5	Low	90 Å²	90	63.9 Å²	63.9	61%	0.608	42%	0.424	S	S	*	.	S	Bend	trans	-120.1	138.9	174.2	-68.7	0	0	0	0	111.3	S406	C402-S406 WeakPolarHBondContact CB-OG 3.39Å
403	L	34.7	Very low	62.2	Low	147 Å²	147	67.4 Å²	67.4	77%	0.77	44%	0.44	S	S	*	.			trans	-29.4	154.8	178.6	-67.4	161.7	0	0	0	115.6	A405 S406	L403-A405 PolarHBondContact O-N 2.66Å; L403-S406 PolarHBondContact O-N 3.04Å
404	P	39.6	Very low	62.2	Low	142 Å²	142	67.3 Å²	67.3	92%	0.922	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	18	-169.4	27	-35.6	0	0	0	116.9
405	A	36.6	Very low	62.5	Low	94 Å²	94	67.3 Å²	67.3	78%	0.777	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	21.3	179.3	0	0	0	0	0	113.7	L403	L403-A405 PolarHBondContact O-N 2.66Å
406	S	42.7	Very low	62.9	Low	64 Å²	64	68.8 Å²	68.8	45%	0.448	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-83.3	125.5	174.6	-60.3	0	0	0	0	110.9	C402 L403	C402-S406 WeakPolarHBondContact CB-OG 3.39Å; L403-S406 PolarHBondContact O-N 3.04Å
407	P	48.3	Very low	63.4	Low	113 Å²	113	68.4 Å²	68.4	73%	0.734	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-63.3	141.6	177.8	25.1	-31.3	0	0	0	110.2	V409	P407-V409 PolarHBondContact O-N 2.85Å
408	S	57.3	Low	63.9	Low	62 Å²	62	68.7 Å²	68.7	43%	0.434	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-56.1	120.6	175.6	50.7	0	0	0	0	110.2	H396 S410	H396-S408 WeakPolarHBondContact CD2-CB 3.21Å; H396-S408 PolarHBondContact CD2-OG 2.9Å; H396-S408 VanDerWaalsContact CD2-OG 3.27Å; H396-S408 PolarHBondContact NE2-OG 2.81Å; S408-S410 PolarHBondContact O-N 3.01Å
409	V	64.2	Low	64.8	Low	89 Å²	89	67.2 Å²	67.2	54%	0.539	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	120.8	-179.2	-178.1	0	0	0	0	109.1	P407 L411	P407-V409 PolarHBondContact O-N 2.85Å; V409-L411 PolarHBondContact O-N 2.9Å
410	S	73.3	Confident	66.1	Low	17 Å²	17	68.9 Å²	68.9	12%	0.119	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	121.5	172.1	-52.3	0	0	0	0	110	S408	S408-S410 PolarHBondContact O-N 3.01Å
411	L	77.9	Confident	67.9	Low	18 Å²	18	65.4 Å²	65.4	9%	0.094	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-77.3	142.2	-176.9	-66.9	175.2	0	0	0	111.5	V376 R378 G395 T397 V409 G433	V376-L411 HydrophobicContact CG1-CD1 4.09Å; R378-L411 HydrophobicContact CB-CD1 3.97Å; G395-L411 WeakPolarHBondContact O-CB 3.23Å; G395-L411 PolarHBondContact O-N 3.03Å; T397-L411 HydrophobicContact CG2-CD2 3.81Å; T397-L411 HydrophobicContact CG2-CG 4.4Å; V409-L411 PolarHBondContact O-N 2.9Å; L411-G433 WeakPolarHBondContact O-CA 3.38Å
412	K	84.3	Confident	69.8	Low	109 Å²	109	65.3 Å²	65.3	47%	0.474	39%	0.394	S	S	.	.			trans	-93.1	-15.6	165.9	-63.5	-172.9	-179.2	-159	0	113	P429 L430 R431	K412-P429 HydrophobicContact CB-CB 4.16Å; K412-P429 CarbonylContact O-C 3.59Å; K412-P429 VanDerWaalsContact O-CA 3.27Å; K412-P429 WeakPolarHBondContact O-CA 3.25Å; K412-P429 WeakPolarHBondContact O-CB 3.44Å; K412-L430 HydrophobicContact CB-CB 4.4Å; K412-L430 PolarHBondContact O-N 2.99Å; K412-R431 PolarHBondContact NZ-O 3.36Å
413	Q	85.9	Confident	72.3	Confident	75 Å²	75	67.6 Å²	67.6	35%	0.35	39%	0.393	S	S	.	.			trans	-68.6	135.7	-171.6	-76.5	170.4	-23.2	0	0	111.4	R378 G394 M426	R378-Q413 PolarHBondContact NH1-O 3.47Å; G394-Q413 PolarHBondContact N-O 2.86Å; Q413-M426 HydrophobicContact CB-CE 3.9Å; Q413-M426 HydrophobicContact CG-CE 3.84Å
414	V	89.5	Confident	75.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	133.5	175.5	-176.8	0	0	0	0	108.1	Y391 V392 V393 V427 L430 W472	Y391-V414 HydrophobicContact CD1-CG1 4.43Å; V392-V414 WeakPolarHBondContact O-CA 3.43Å; V392-V414 WeakPolarHBondContact O-CG1 3.29Å; V393-V414 HydrophobicContact CB-CG2 4.48Å; V393-V414 HydrophobicContact CG1-CG2 4.15Å; V393-V414 HydrophobicContact CG2-CG1 3.77Å; V393-V414 HydrophobicContact CG2-CG2 4.36Å; V414-V427 HydrophobicContact CB-CG2 3.62Å; V414-V427 HydrophobicContact CG1-CG2 3.38Å; V414-V427 PolarHBondContact O-N 2.94Å; V414-V427 VanDerWaalsContact O-N 3.09Å; V414-L430 HydrophobicContact CG2-CD1 4.36Å; V414-L430 HydrophobicContact CG2-CG 3.84Å; V414-W472 HydrophobicContact CG1-CZ2 4.26Å; V414-W472 HydrophobicContact CG2-CZ2 3.83Å
415	E	91.9	Very high	77.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	141.1	-179.4	-61.9	178.5	-131.7	0	0	109.8	L375 V376 R378 Y391 V392 W424 T425 M426	L375-E415 WeakPolarHBondContact CA-OE2 3.42Å; L375-E415 WeakPolarHBondContact CB-OE2 3.46Å; L375-E415 WeakPolarHBondContact CG-OE2 3.36Å; L375-E415 PolarHBondContact N-OE2 3.31Å; V376-E415 VanDerWaalsContact CB-OE1 3.26Å; V376-E415 WeakPolarHBondContact CB-OE1 3.48Å; V376-E415 WeakPolarHBondContact CG2-OE1 3.26Å; V376-E415 PolarHBondContact N-OE1 2.77Å; R378-E415 IonicContact CZ-OE1 2.66Å; R378-E415 IonicContact NE-OE1 3.11Å; R378-E415 IonicContact NH2-OE1 2.77Å; R378-E415 PolarHBondContact NH2-OE1 3.04Å; Y391-E415 WeakPolarHBondContact CA-O 3.21Å; V392-E415 PolarHBondContact N-O 2.88Å; V392-E415 PolarHBondContact O-N 3.07Å; E415-W424 HydrophobicContact CB-CE3 3.67Å; E415-W424 HydrophobicContact CB-CZ3 3.96Å; E415-T425 WeakPolarHBondContact CA-O 3.19Å; E415-M426 HydrophobicContact CG-CE 4.45Å; E415-M426 HydrophobicContact CG-SD 3.63Å
416	Q	93.1	Very high	80.1	Confident	32 Å²	32	58 Å²	58	15%	0.15	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.8	173.8	178.1	-176.8	-10.8	0	0	109	C389 L390 Y391 W424 T425 V427	C389-Q416 HydrophobicContact CB-CG 3.93Å; C389-Q416 PolarHBondContact SG-NE2 3.32Å; L390-Q416 CarbonylContact O-C 3.59Å; L390-Q416 WeakPolarHBondContact O-CA 3.5Å; Y391-Q416 HydrophobicContact CD1-CB 3.97Å; Y391-Q416 HydrophobicContact CD1-CG 4.3Å; Y391-Q416 HydrophobicContact CD2-CG 4.46Å; Y391-Q416 HydrophobicContact CE1-CB 3.66Å; Y391-Q416 HydrophobicContact CE1-CG 3.77Å; Y391-Q416 HydrophobicContact CE2-CG 3.96Å; Y391-Q416 PolarHBondContact OH-NE2 2.83Å; Y391-Q416 PolarHBondContact OH-OE1 2.92Å; Q416-W424 CarbonylContact O-C 3.33Å; Q416-W424 WeakPolarHBondContact O-CA 3.35Å; Q416-T425 PolarHBondContact N-O 3.41Å; Q416-T425 PolarHBondContact O-N 3.02Å; Q416-T425 PolarHBondContact O-OG1 2.99Å; Q416-V427 HydrophobicContact CB-CG1 3.76Å
417	Y	91.3	Very high	82.5	Confident	8 Å²	8	55.8 Å²	55.8	3%	0.031	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.7	170.5	173.6	-103.9	0	0	0	110.1	Y343 A372 C389 L390 P419 N422 K423 W424	Y343-Y417 HydrophobicContact CD1-CE1 4.17Å; Y343-Y417 HydrophobicContact CE1-CD1 4.42Å; Y343-Y417 AromaticContact CE1-CE1 3.66Å; Y343-Y417 HydrophobicContact CE1-CE1 3.66Å; A372-Y417 HydrophobicContact CB-CE2 4.34Å; C389-Y417 WeakPolarHBondContact CA-O 3.24Å; C389-Y417 WeakPolarHBondContact CB-O 3.34Å; L390-Y417 HydrophobicContact CB-CD1 4.15Å; L390-Y417 HydrophobicContact CD2-CD1 4.49Å; L390-Y417 PolarHBondContact N-O 2.95Å; L390-Y417 PolarHBondContact O-N 3.16Å; Y417-P419 HydrophobicContact CD1-CG 4.09Å; Y417-P419 HydrophobicContact CE1-CB 4.04Å; Y417-P419 HydrophobicContact CE1-CG 3.92Å; Y417-P419 WeakPolarHBondContact O-CD 3.45Å; Y417-N422 WeakPolarHBondContact CE2-OD1 3.45Å; Y417-N422 PolarHBondContact OH-OD1 2.91Å; Y417-K423 WeakPolarHBondContact CA-O 3.23Å; Y417-W424 VanDerWaalsContact CB-CH2 3.49Å; Y417-W424 AromaticContact CD2-CD1 3.71Å; Y417-W424 AromaticContact CD2-CD2 3.94Å; Y417-W424 HydrophobicContact CD2-CD2 3.94Å; Y417-W424 AromaticContact CD2-CE2 3.52Å; Y417-W424 HydrophobicContact CD2-CG 4.04Å; Y417-W424 AromaticContact CD2-CZ2 3.98Å; Y417-W424 HydrophobicContact CD2-CZ2 3.98Å; Y417-W424 AromaticContact CD2-NE1 3.36Å; Y417-W424 AromaticContact CE2-NE1 3.95Å; Y417-W424 HydrophobicContact CG-CD2 4.2Å; Y417-W424 AromaticContact CG-CE2 3.79Å; Y417-W424 HydrophobicContact CG-CH2 4.26Å; Y417-W424 AromaticContact CG-CZ2 3.81Å; Y417-W424 HydrophobicContact CG-CZ2 3.81Å
418	D	86.9	Confident	84.4	Confident	43 Å²	43	51.3 Å²	51.3	23%	0.23	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.9	170.3	173.6	10.6	0	0	0	109.1	V420 T421 N422 K423	D418-V420 PolarHBondContact O-N 2.94Å; D418-V420 WeakPolarHBondContact OD1-CB 3.34Å; D418-V420 PolarHBondContact OD1-N 2.93Å; D418-T421 WeakPolarHBondContact CB-OG1 3.35Å; D418-T421 VanDerWaalsContact CG-OG1 3.25Å; D418-T421 WeakPolarHBondContact OD2-CB 3.37Å; D418-T421 VanDerWaalsContact OD2-CG2 3.25Å; D418-T421 WeakPolarHBondContact OD2-CG2 3.47Å; D418-T421 PolarHBondContact OD2-OG1 2.82Å; D418-N422 WeakPolarHBondContact O-CA 3.45Å; D418-N422 PolarHBondContact O-N 3.16Å; D418-K423 PolarHBondContact N-O 3.2Å; D418-K423 VanDerWaalsContact N-O 3.07Å; D418-K423 PolarHBondContact O-N 2.83Å
419	P	82.6	Confident	85.8	Confident	23 Å²	23	52.1 Å²	52.1	15%	0.149	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.4	177.6	-23.2	34.3	0	0	0	114.4	V282 I338 H388 Y417	V282-P419 HydrophobicContact CG2-CB 4.32Å; V282-P419 HydrophobicContact CG2-CG 4.45Å; I338-P419 HydrophobicContact CD1-CG 4.13Å; H388-P419 WeakPolarHBondContact O-CD 3.36Å; H388-P419 WeakPolarHBondContact O-CG 3.36Å; Y417-P419 HydrophobicContact CD1-CG 4.09Å; Y417-P419 HydrophobicContact CE1-CB 4.04Å; Y417-P419 HydrophobicContact CE1-CG 3.92Å; Y417-P419 WeakPolarHBondContact O-CD 3.45Å
420	V	80.3	Confident	86.9	Confident	97 Å²	97	48.1 Å²	48.1	59%	0.588	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-44.8	-177.2	-178.6	0	0	0	0	110.5	D418	D418-V420 PolarHBondContact O-N 2.94Å; D418-V420 WeakPolarHBondContact OD1-CB 3.34Å; D418-V420 PolarHBondContact OD1-N 2.93Å
421	T	82.6	Confident	87.4	Confident	74 Å²	74	54 Å²	54	45%	0.454	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-7.9	178.8	58.5	0	0	0	0	113.4	D418 K423	D418-T421 WeakPolarHBondContact CB-OG1 3.35Å; D418-T421 VanDerWaalsContact CG-OG1 3.25Å; D418-T421 WeakPolarHBondContact OD2-CB 3.37Å; D418-T421 VanDerWaalsContact OD2-CG2 3.25Å; D418-T421 WeakPolarHBondContact OD2-CG2 3.47Å; D418-T421 PolarHBondContact OD2-OG1 2.82Å; T421-K423 VanDerWaalsContact C-N 3.27Å; T421-K423 WeakPolarHBondContact O-CG 3.22Å; T421-K423 PolarHBondContact O-N 2.79Å
422	N	86.8	Confident	87.5	Confident	74 Å²	74	55.8 Å²	55.8	40%	0.396	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	46.6	-174.8	-171.5	19.8	0	0	0	111.6	A372 Y417 D418	A372-N422 WeakPolarHBondContact CB-O 3.42Å; A372-N422 VanDerWaalsContact CB-OD1 3.25Å; A372-N422 WeakPolarHBondContact CB-OD1 3.4Å; A372-N422 PolarHBondContact N-OD1 3.15Å; Y417-N422 WeakPolarHBondContact CE2-OD1 3.45Å; Y417-N422 PolarHBondContact OH-OD1 2.91Å; D418-N422 WeakPolarHBondContact O-CA 3.45Å; D418-N422 PolarHBondContact O-N 3.16Å
423	K	89.3	Confident	87.2	Confident	139 Å²	139	51 Å²	51	60%	0.604	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	142.9	-175.8	-76.9	175.5	-174.6	179.7	0	111.8	Y417 D418 T421	Y417-K423 WeakPolarHBondContact CA-O 3.23Å; D418-K423 PolarHBondContact N-O 3.2Å; D418-K423 VanDerWaalsContact N-O 3.07Å; D418-K423 PolarHBondContact O-N 2.83Å; T421-K423 VanDerWaalsContact C-N 3.27Å; T421-K423 WeakPolarHBondContact O-CG 3.22Å; T421-K423 PolarHBondContact O-N 2.79Å
424	W	92.6	Very high	86.8	Confident	21 Å²	21	47.9 Å²	47.9	8%	0.08	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.2	172.1	-70.4	90.4	0	0	0	110.6	T345 V358 A372 M374 L375 L390 V392 E415 Q416 Y417	T345-W424 HydrophobicContact CG2-CH2 4.2Å; T345-W424 HydrophobicContact CG2-CZ2 4.38Å; V358-W424 HydrophobicContact CG1-CZ2 4.45Å; V358-W424 HydrophobicContact CG2-CZ2 3.66Å; A372-W424 PolarHBondContact O-NE1 3.38Å; M374-W424 HydrophobicContact CG-CD2 4.31Å; M374-W424 HydrophobicContact CG-CH2 3.95Å; M374-W424 HydrophobicContact CG-CZ2 3.68Å; M374-W424 HydrophobicContact CG-CZ3 4.37Å; M374-W424 HydrophobicContact SD-CH2 4.4Å; L375-W424 HydrophobicContact CD1-CB 4.23Å; L375-W424 HydrophobicContact CD2-CB 4.18Å; L375-W424 HydrophobicContact CG-CB 3.82Å; L390-W424 HydrophobicContact CD2-CH2 3.99Å; L390-W424 HydrophobicContact CD2-CZ2 4.43Å; L390-W424 HydrophobicContact CG-CH2 4.4Å; V392-W424 HydrophobicContact CB-CH2 4.42Å; V392-W424 HydrophobicContact CB-CZ3 4.09Å; V392-W424 HydrophobicContact CG2-CH2 3.6Å; V392-W424 HydrophobicContact CG2-CZ3 3.75Å; E415-W424 HydrophobicContact CB-CE3 3.67Å; E415-W424 HydrophobicContact CB-CZ3 3.96Å; Q416-W424 CarbonylContact O-C 3.33Å; Q416-W424 WeakPolarHBondContact O-CA 3.35Å; Y417-W424 VanDerWaalsContact CB-CH2 3.49Å; Y417-W424 AromaticContact CD2-CD1 3.71Å; Y417-W424 AromaticContact CD2-CD2 3.94Å; Y417-W424 HydrophobicContact CD2-CD2 3.94Å; Y417-W424 AromaticContact CD2-CE2 3.52Å; Y417-W424 HydrophobicContact CD2-CG 4.04Å; Y417-W424 AromaticContact CD2-CZ2 3.98Å; Y417-W424 HydrophobicContact CD2-CZ2 3.98Å; Y417-W424 AromaticContact CD2-NE1 3.36Å; Y417-W424 AromaticContact CE2-NE1 3.95Å; Y417-W424 HydrophobicContact CG-CD2 4.2Å; Y417-W424 AromaticContact CG-CE2 3.79Å; Y417-W424 HydrophobicContact CG-CH2 4.26Å; Y417-W424 AromaticContact CG-CZ2 3.81Å; Y417-W424 HydrophobicContact CG-CZ2 3.81Å
425	T	92	Very high	86.4	Confident	72 Å²	72	47.9 Å²	47.9	44%	0.442	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	144.1	177.1	55.9	0	0	0	0	110	E415 Q416	E415-T425 WeakPolarHBondContact CA-O 3.19Å; Q416-T425 PolarHBondContact N-O 3.41Å; Q416-T425 PolarHBondContact O-N 3.02Å; Q416-T425 PolarHBondContact O-OG1 2.99Å
426	M	90.2	Very high	85.8	Confident	89 Å²	89	49.2 Å²	49.2	44%	0.438	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.8	174.7	-67.4	-62.4	-55.8	0	0	109.5	L375 Q413 E415	L375-M426 HydrophobicContact CB-SD 4.5Å; L375-M426 HydrophobicContact CD1-CG 3.67Å; L375-M426 HydrophobicContact CD1-SD 3.66Å; Q413-M426 HydrophobicContact CB-CE 3.9Å; Q413-M426 HydrophobicContact CG-CE 3.84Å; E415-M426 HydrophobicContact CG-CE 4.45Å; E415-M426 HydrophobicContact CG-SD 3.63Å
427	V	91.8	Very high	85.3	Confident	17 Å²	17	48.3 Å²	48.3	10%	0.103	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	177.6	171.4	-59	0	0	0	0	110.3	Y391 V414 Q416	Y391-V427 HydrophobicContact CD1-CG2 4.4Å; Y391-V427 HydrophobicContact CE1-CG1 4.22Å; Y391-V427 HydrophobicContact CE1-CG2 4.31Å; V414-V427 HydrophobicContact CB-CG2 3.62Å; V414-V427 HydrophobicContact CG1-CG2 3.38Å; V414-V427 PolarHBondContact O-N 2.94Å; V414-V427 VanDerWaalsContact O-N 3.09Å; Q416-V427 HydrophobicContact CB-CG1 3.76Å
428	A	88.5	Confident	85	Confident	19 Å²	19	48.3 Å²	48.3	16%	0.157	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-53.9	134.5	-178.3	0	0	0	0	0	111.6	Y465 N470 W472	A428-Y465 HydrophobicContact CB-CE2 4.31Å; A428-N470 WeakPolarHBondContact CB-O 3.49Å; A428-N470 WeakPolarHBondContact CB-OD1 3.36Å; A428-N470 PolarHBondContact N-OD1 2.83Å; A428-W472 PolarHBondContact O-NE1 2.85Å
429	P	87.8	Confident	85.1	Confident	79 Å²	79	47 Å²	47	51%	0.513	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-72.3	154.6	-179.6	30.6	-35.1	0	0	0	111.1	K412	K412-P429 HydrophobicContact CB-CB 4.16Å; K412-P429 CarbonylContact O-C 3.59Å; K412-P429 VanDerWaalsContact O-CA 3.27Å; K412-P429 WeakPolarHBondContact O-CA 3.25Å; K412-P429 WeakPolarHBondContact O-CB 3.44Å
430	L	86.1	Confident	85.5	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.026	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-55.2	149.9	169.8	-68.8	161.8	0	0	0	111.1	V393 K412 V414 E432 V434 Q463 W472	V393-L430 HydrophobicContact CG1-CD1 3.75Å; V393-L430 HydrophobicContact CG1-CD2 3.85Å; V393-L430 HydrophobicContact CG1-CG 4.1Å; K412-L430 HydrophobicContact CB-CB 4.4Å; K412-L430 PolarHBondContact O-N 2.99Å; V414-L430 HydrophobicContact CG2-CD1 4.36Å; V414-L430 HydrophobicContact CG2-CG 3.84Å; L430-E432 WeakPolarHBondContact CB-O 3.49Å; L430-V434 HydrophobicContact CD1-CG2 3.84Å; L430-Q463 HydrophobicContact CD2-CB 4.29Å; L430-W472 HydrophobicContact CD2-CD2 3.77Å; L430-W472 HydrophobicContact CD2-CE3 3.72Å; L430-W472 HydrophobicContact CD2-CH2 3.72Å; L430-W472 HydrophobicContact CD2-CZ2 3.77Å; L430-W472 HydrophobicContact CD2-CZ3 3.69Å; L430-W472 HydrophobicContact CG-CZ2 4.48Å
431	R	83.4	Confident	85.9	Confident	140 Å²	140	43.6 Å²	43.6	53%	0.528	23%	0.233	S	C	.	.	S	Bend	trans	-65.4	-46.2	173.3	-65	-69.3	-172.9	154.5	1.5	110.1	K412 W472 V474	K412-R431 PolarHBondContact NZ-O 3.36Å; R431-W472 HydrophobicContact CG-CB 4.2Å; R431-W472 PolarHBondContact NE-O 3.17Å; R431-W472 PolarHBondContact NH2-O 3.49Å; R431-V474 HydrophobicContact CB-CG2 4.46Å; R431-V474 HydrophobicContact CG-CG2 4.29Å
432	E	80.1	Confident	86.1	Confident	56 Å²	56	40.4 Å²	40.4	26%	0.262	21%	0.214	S	C	.	.	S	Bend	trans	-121.7	132.6	177.9	-67.8	180	-170.9	0	0	109.6	L430 V434 K461 Q463	L430-E432 WeakPolarHBondContact CB-O 3.49Å; E432-V434 PolarHBondContact O-N 3.27Å; E432-K461 WeakPolarHBondContact OE1-CD 3.21Å; E432-K461 WeakPolarHBondContact OE1-CE 3.44Å; E432-K461 IonicContact OE1-NZ 3.87Å; E432-K461 PolarHBondContact OE1-NZ 3.39Å; E432-Q463 VanDerWaalsContact N-OE1 3.15Å; E432-Q463 PolarHBondContact O-NE2 3.27Å
433	G	77.6	Confident	85.8	Confident	8 Å²	8	40.4 Å²	40.4	8%	0.082	21%	0.21	C	C	.	.			trans	-72.4	124.9	-179.5	0	0	0	0	0	109	L411	L411-G433 WeakPolarHBondContact O-CA 3.38Å
434	V	79.4	Confident	85.5	Confident	9 Å²	9	39.2 Å²	39.2	6%	0.055	21%	0.21	C	C	.	.			trans	-128	144.6	-176.9	-66.1	0	0	0	0	110.5	G394 G395 L430 E432 A437	G394-V434 WeakPolarHBondContact CA-O 3.5Å; G395-V434 PolarHBondContact N-O 3.44Å; L430-V434 HydrophobicContact CD1-CG2 3.84Å; E432-V434 PolarHBondContact O-N 3.27Å; V434-A437 HydrophobicContact CB-CB 4.09Å; V434-A437 HydrophobicContact CG2-CB 3.77Å
435	S	80.4	Confident	85.3	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-129.7	150.9	172.9	50	0	0	0	0	110	H396 A437 G451 T452	H396-S435 WeakPolarHBondContact CE1-CB 2.76Å; H396-S435 PolarHBondContact CE1-OG 2.99Å; H396-S435 WeakPolarHBondContact ND1-CB 3.26Å; H396-S435 PolarHBondContact NE2-OG 2.78Å; H396-S435 VanDerWaalsContact NE2-OG 3.12Å; S435-A437 PolarHBondContact O-N 3.2Å; S435-G451 CarbonylContact O-C 3.57Å; S435-G451 WeakPolarHBondContact O-CA 3.47Å; S435-T452 PolarHBondContact N-O 3.11Å; S435-T452 VanDerWaalsContact N-O 3.16Å; S435-T452 PolarHBondContact O-N 2.77Å; S435-T452 PolarHBondContact O-OG1 2.77Å; S435-T452 PolarHBondContact OG-O 2.66Å; S435-T452 PolarHBondContact OG-OG1 2.82Å
436	N	78.3	Confident	85.2	Confident	28 Å²	28	37.9 Å²	37.9	15%	0.15	20%	0.198	C	C	.	.	S	Bend	trans	53.4	34.2	-174.4	-53.9	-40.5	0	0	0	112.3	G380 Y484	G380-N436 WeakPolarHBondContact CA-OD1 3.42Å; G380-N436 PolarHBondContact O-N 3.24Å; N436-Y484 HydrophobicContact CB-CD1 3.84Å; N436-Y484 HydrophobicContact CB-CE1 3.84Å; N436-Y484 WeakPolarHBondContact ND2-CE1 3.37Å
437	A	82.5	Confident	85.2	Confident	12 Å²	12	33.7 Å²	33.7	10%	0.099	18%	0.178	C	C	.	.			trans	-86.6	145.1	174	0	0	0	0	0	109.5	V434 S435 F449	V434-A437 HydrophobicContact CB-CB 4.09Å; V434-A437 HydrophobicContact CG2-CB 3.77Å; S435-A437 PolarHBondContact O-N 3.2Å; A437-F449 WeakPolarHBondContact CA-O 3.31Å
438	A	86.2	Confident	85.1	Confident	8 Å²	8	33 Å²	33	7%	0.066	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	122.7	172.8	0	0	0	0	0	108.8	A448 F449 A487	A438-A448 WeakPolarHBondContact O-CA 3.39Å; A438-F449 HydrophobicContact CB-CB 4.43Å; A438-F449 PolarHBondContact N-O 3.28Å; A438-F449 PolarHBondContact O-N 2.91Å; A438-A487 HydrophobicContact CB-CB 3.56Å
439	V	89.1	Confident	85	Confident	15 Å²	15	32.1 Å²	32.1	9%	0.091	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.7	-175.7	-179.1	0	0	0	0	109	A384 V393 F447 A448	A384-V439 HydrophobicContact CB-CG1 3.96Å; V393-V439 HydrophobicContact CB-CG1 4.15Å; V393-V439 HydrophobicContact CB-CG2 4.02Å; V393-V439 HydrophobicContact CG1-CG2 4.16Å; V393-V439 HydrophobicContact CG2-CG1 3.91Å; V439-F447 WeakPolarHBondContact CA-O 3.19Å; V439-A448 HydrophobicContact CG2-CB 4.18Å
440	V	90.1	Very high	84.6	Confident	15 Å²	15	28.4 Å²	28.4	9%	0.091	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.2	-177.8	-68.9	0	0	0	0	111.1	F447 F449 A487 V489 I494	V440-F447 HydrophobicContact CG2-CB 4.45Å; V440-F447 PolarHBondContact N-O 2.61Å; V440-F447 PolarHBondContact O-N 2.82Å; V440-F449 HydrophobicContact CG2-CD2 4.13Å; V440-F449 HydrophobicContact CG2-CE2 3.64Å; V440-A487 HydrophobicContact CG1-CB 3.67Å; V440-A487 WeakPolarHBondContact CG1-O 3Å; V440-A487 HydrophobicContact CG2-CB 4.26Å; V440-V489 HydrophobicContact CB-CG2 3.72Å; V440-V489 HydrophobicContact CG1-CG2 4.23Å; V440-V489 HydrophobicContact CG2-CG2 3.97Å; V440-I494 HydrophobicContact CG2-CD1 4.25Å; V440-I494 HydrophobicContact CG2-CG2 3.72Å
441	S	89	Confident	84.1	Confident	35 Å²	35	28.6 Å²	28.6	25%	0.245	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.6	173.8	55.2	0	0	0	0	111.1	E385 K445 V489	E385-S441 WeakPolarHBondContact O-CB 3.25Å; E385-S441 PolarHBondContact O-OG 2.91Å; S441-K445 WeakPolarHBondContact CA-O 3.48Å; S441-V489 WeakPolarHBondContact O-CG2 3.41Å
442	A	86.1	Confident	83.5	Confident	6 Å²	6	23.1 Å²	23.1	5%	0.05	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	139.2	173.5	0	0	0	0	0	109.8	L444 K445 F447 V489 I494	A442-L444 VanDerWaalsContact C-N 3.27Å; A442-L444 PolarHBondContact O-N 2.95Å; A442-K445 PolarHBondContact N-O 2.92Å; A442-K445 PolarHBondContact O-N 2.93Å; A442-K445 VanDerWaalsContact O-O 3.11Å; A442-F447 HydrophobicContact CB-CD2 4.29Å; A442-F447 HydrophobicContact CB-CE2 4.14Å; A442-V489 HydrophobicContact CB-CG1 4.13Å; A442-V489 HydrophobicContact CB-CG2 4.44Å; A442-I494 HydrophobicContact CB-CD1 3.68Å; A442-I494 HydrophobicContact CB-CG1 3.82Å
443	K	81.7	Confident	83	Confident	74 Å²	74	21.8 Å²	21.8	32%	0.322	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.7	46.9	179.1	-63.6	-170.4	176.3	176.6	0	113.9	K445 E514	K443-K445 PolarHBondContact O-N 3.33Å; K443-E514 HydrophobicContact CD-CG 4.32Å; K443-E514 VanDerWaalsContact NZ-CG 3.28Å; K443-E514 IonicContact NZ-OE1 3.71Å; K443-E514 PolarHBondContact NZ-OE1 3.21Å; K443-E514 IonicContact NZ-OE2 2.79Å; K443-E514 PolarHBondContact NZ-OE2 2.68Å
444	L	83.3	Confident	82.3	Confident	114 Å²	114	27.2 Å²	27.2	60%	0.597	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	19.7	179.7	-52.2	174.5	0	0	0	115.2	L386 K387 A442	L386-L444 VanDerWaalsContact CD1-C 3.42Å; K387-L444 HydrophobicContact CD-CD2 4.47Å; K387-L444 HydrophobicContact CG-CD2 3.95Å; A442-L444 VanDerWaalsContact C-N 3.27Å; A442-L444 PolarHBondContact O-N 2.95Å
445	K	88.3	Confident	81.3	Confident	65 Å²	65	29.5 Å²	29.5	28%	0.283	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	153.6	172.8	-59.9	-168.8	-172.6	-152.5	0	110.3	S441 A442 K443 F447 Y465 D466	S441-K445 WeakPolarHBondContact CA-O 3.48Å; A442-K445 PolarHBondContact N-O 2.92Å; A442-K445 PolarHBondContact O-N 2.93Å; A442-K445 VanDerWaalsContact O-O 3.11Å; K443-K445 PolarHBondContact O-N 3.33Å; K445-F447 HydrophobicContact CB-CE2 3.87Å; K445-F447 HydrophobicContact CB-CZ 4.26Å; K445-Y465 WeakPolarHBondContact CA-O 3.31Å; K445-Y465 WeakPolarHBondContact CB-O 3.35Å; K445-D466 VanDerWaalsContact CE-OD2 3.25Å; K445-D466 WeakPolarHBondContact CE-OD2 3.33Å; K445-D466 IonicContact NZ-OD2 3.78Å; K445-D466 PolarHBondContact NZ-OD2 2.88Å
446	L	90.3	Very high	80.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.5	170	-66.5	158.4	0	0	0	109.7	A384 L386 Y391 C464 Y465 W472	A384-L446 HydrophobicContact CB-CD2 3.63Å; L386-L446 HydrophobicContact CB-CD1 4.39Å; L386-L446 HydrophobicContact CB-CD2 4.1Å; L386-L446 HydrophobicContact CB-CG 4.17Å; L386-L446 HydrophobicContact CD2-CD1 4.07Å; L386-L446 HydrophobicContact CD2-CG 3.99Å; Y391-L446 HydrophobicContact CD1-CD1 3.59Å; Y391-L446 HydrophobicContact CD2-CD1 3.85Å; Y391-L446 HydrophobicContact CE1-CD1 4.18Å; Y391-L446 HydrophobicContact CE2-CD1 4.4Å; Y391-L446 HydrophobicContact CG-CD1 3.39Å; L446-C464 CarbonylContact O-C 3.28Å; L446-C464 VanDerWaalsContact O-CA 3.29Å; L446-C464 WeakPolarHBondContact O-CA 3.49Å; L446-Y465 HydrophobicContact CD1-CD1 3.91Å; L446-Y465 PolarHBondContact N-O 3.4Å; L446-Y465 PolarHBondContact O-N 3.04Å; L446-W472 HydrophobicContact CB-CH2 4.39Å
447	F	89.8	Confident	78.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.009	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.2	175.1	-65.4	-92.5	0	0	0	109.2	V439 V440 A442 K445 F449 V462 Q463 C464 I494 F511 Y516	V439-F447 WeakPolarHBondContact CA-O 3.19Å; V440-F447 HydrophobicContact CG2-CB 4.45Å; V440-F447 PolarHBondContact N-O 2.61Å; V440-F447 PolarHBondContact O-N 2.82Å; A442-F447 HydrophobicContact CB-CD2 4.29Å; A442-F447 HydrophobicContact CB-CE2 4.14Å; K445-F447 HydrophobicContact CB-CE2 3.87Å; K445-F447 HydrophobicContact CB-CZ 4.26Å; F447-F449 HydrophobicContact CB-CD2 4.14Å; F447-F449 HydrophobicContact CB-CE2 3.31Å; F447-F449 HydrophobicContact CB-CZ 3.54Å; F447-F449 HydrophobicContact CD1-CZ 4.21Å; F447-F449 HydrophobicContact CG-CE2 4.25Å; F447-F449 HydrophobicContact CG-CZ 4.06Å; F447-V462 HydrophobicContact CD1-CG1 4.14Å; F447-Q463 CarbonylContact C-O 3.51Å; F447-Q463 WeakPolarHBondContact CA-O 3.16Å; F447-C464 HydrophobicContact CD1-CB 3.89Å; F447-C464 HydrophobicContact CE1-CB 3.78Å; F447-C464 WeakPolarHBondContact CE1-SG 3.24Å; F447-I494 HydrophobicContact CB-CD1 4.3Å; F447-I494 HydrophobicContact CD2-CD1 3.71Å; F447-I494 HydrophobicContact CE2-CD1 4.15Å; F447-I494 HydrophobicContact CG-CD1 3.97Å; F447-F511 HydrophobicContact CD1-CE1 4.24Å; F447-F511 HydrophobicContact CE1-CE1 4.13Å; F447-Y516 HydrophobicContact CE1-CE1 4.15Å
448	A	88.6	Confident	77.9	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.4	169.6	0	0	0	0	0	108.6	V393 A438 V439 Q463 W472	V393-A448 HydrophobicContact CG1-CB 4.45Å; A438-A448 WeakPolarHBondContact O-CA 3.39Å; V439-A448 HydrophobicContact CG2-CB 4.18Å; A448-Q463 HydrophobicContact CB-CB 4.37Å; A448-Q463 PolarHBondContact N-O 3.21Å; A448-Q463 PolarHBondContact O-N 2.98Å; A448-W472 HydrophobicContact CB-CZ3 4.24Å
449	F	86.3	Confident	76.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.8	-178.2	-61.2	-82.1	0	0	0	110.6	A437 A438 V440 F447 V462 A487 I494 I496 F511 W518	A437-F449 WeakPolarHBondContact CA-O 3.31Å; A438-F449 HydrophobicContact CB-CB 4.43Å; A438-F449 PolarHBondContact N-O 3.28Å; A438-F449 PolarHBondContact O-N 2.91Å; V440-F449 HydrophobicContact CG2-CD2 4.13Å; V440-F449 HydrophobicContact CG2-CE2 3.64Å; F447-F449 HydrophobicContact CB-CD2 4.14Å; F447-F449 HydrophobicContact CB-CE2 3.31Å; F447-F449 HydrophobicContact CB-CZ 3.54Å; F447-F449 HydrophobicContact CD1-CZ 4.21Å; F447-F449 HydrophobicContact CG-CE2 4.25Å; F447-F449 HydrophobicContact CG-CZ 4.06Å; F449-V462 HydrophobicContact CD1-CB 4.4Å; F449-V462 HydrophobicContact CD1-CG1 3.84Å; F449-V462 HydrophobicContact CD1-CG2 3.84Å; F449-V462 HydrophobicContact CE1-CB 4.39Å; F449-V462 HydrophobicContact CE1-CG1 3.5Å; F449-V462 HydrophobicContact CE1-CG2 3.97Å; F449-V462 HydrophobicContact CZ-CG1 4.21Å; F449-A487 HydrophobicContact CD2-CB 4.49Å; F449-I494 HydrophobicContact CE2-CD1 3.98Å; F449-I494 HydrophobicContact CE2-CG2 3.77Å; F449-I494 HydrophobicContact CZ-CB 4.48Å; F449-I494 HydrophobicContact CZ-CD1 3.76Å; F449-I494 HydrophobicContact CZ-CG2 4.05Å; F449-I496 HydrophobicContact CB-CG1 4.5Å; F449-I496 HydrophobicContact CD1-CD1 4.13Å; F449-I496 HydrophobicContact CD1-CG1 4.38Å; F449-I496 HydrophobicContact CD2-CD1 4.39Å; F449-I496 HydrophobicContact CD2-CG1 4.24Å; F449-I496 HydrophobicContact CE1-CD1 4.05Å; F449-I496 HydrophobicContact CE2-CD1 4.31Å; F449-I496 HydrophobicContact CG-CD1 4.3Å; F449-I496 HydrophobicContact CG-CG1 4.13Å; F449-I496 HydrophobicContact CZ-CD1 4.15Å; F449-F511 AromaticContact CE1-CD1 3.8Å; F449-F511 HydrophobicContact CE1-CD1 3.8Å; F449-F511 AromaticContact CE1-CE1 4Å; F449-F511 HydrophobicContact CE1-CE1 4Å; F449-F511 HydrophobicContact CE1-CG 4.06Å; F449-F511 HydrophobicContact CE1-CZ 4.43Å; F449-F511 AromaticContact CZ-CD1 3.74Å; F449-F511 HydrophobicContact CZ-CD1 3.74Å; F449-F511 HydrophobicContact CZ-CE1 4.05Å; F449-F511 HydrophobicContact CZ-CG 4.34Å; F449-W518 AromaticContact CD1-CH2 3.8Å; F449-W518 HydrophobicContact CD1-CH2 3.8Å; F449-W518 HydrophobicContact CD1-CZ2 4.32Å; F449-W518 AromaticContact CE1-CH2 3.85Å; F449-W518 HydrophobicContact CE1-CH2 3.85Å; F449-W518 HydrophobicContact CE1-CZ2 4.32Å
450	G	79.6	Confident	75.8	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	28%	0.283	C	S	.	.			trans	68	-150.9	172.4	0	0	0	0	0	113.7	W482	G450-W482 VanDerWaalsContact CA-O 3.25Å; G450-W482 WeakPolarHBondContact CA-O 3.13Å
451	G	75.2	Confident	75.4	Confident	9 Å²	9	55.1 Å²	55.1	9%	0.093	29%	0.291	C	S	.	.			trans	102.3	163.8	176.3	0	0	0	0	0	113.2	S435 W482	S435-G451 CarbonylContact O-C 3.57Å; S435-G451 WeakPolarHBondContact O-CA 3.47Å; G451-W482 PolarHBondContact N-O 2.87Å
452	T	71.2	Confident	75.2	Confident	25 Å²	25	53.5 Å²	53.5	15%	0.153	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-86.4	127.3	172	51.8	0	0	0	0	109.3	S435 R483	S435-T452 PolarHBondContact N-O 3.11Å; S435-T452 VanDerWaalsContact N-O 3.16Å; S435-T452 PolarHBondContact O-N 2.77Å; S435-T452 PolarHBondContact O-OG1 2.77Å; S435-T452 PolarHBondContact OG-O 2.66Å; S435-T452 PolarHBondContact OG-OG1 2.82Å; T452-R483 HydrophobicContact CG2-CB 4.46Å; T452-R483 HydrophobicContact CG2-CG 4.01Å
453	S	69.5	Low	75.4	Confident	29 Å²	29	53.3 Å²	53.3	20%	0.203	28%	0.278	C	S	.	.			trans	-118.5	160	171.9	175.6	0	0	0	0	108.4	S455	S453-S455 PolarHBondContact O-N 2.97Å
454	V	62.9	Low	75.8	Confident	121 Å²	121	49.8 Å²	49.8	73%	0.733	26%	0.263	S	S	*	.	S	Bend	trans	-59.6	-26.5	179.9	-175.8	0	0	0	0	111.9	H456	V454-H456 PolarHBondContact O-N 2.79Å
455	S	58.6	Low	76.2	Confident	57 Å²	57	44.6 Å²	44.6	40%	0.399	24%	0.235	S	C	.	.			trans	-91.4	98	173.7	61.2	0	0	0	0	111.1	S453 D457	S453-S455 PolarHBondContact O-N 2.97Å; S455-D457 PolarHBondContact O-N 2.81Å
456	H	57.5	Low	76.2	Confident	134 Å²	134	42.8 Å²	42.8	62%	0.62	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.6	-180	-72.4	-81.4	0	0	0	114.8	V454	V454-H456 PolarHBondContact O-N 2.79Å
457	D	50.7	Low	75.9	Confident	164 Å²	164	45 Å²	45	88%	0.877	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-3.3	-168.9	-96.9	-7.1	0	0	0	116.2	S455	S455-D457 PolarHBondContact O-N 2.81Å
458	K	61.5	Low	75.7	Confident	149 Å²	149	50.3 Å²	50.3	65%	0.648	28%	0.275	S	S	*	.	S	Bend	trans	-117.1	142.1	-177.5	-67.7	-176.6	-178.2	177.5	0	111.5
459	L	61.2	Low	75.5	Confident	89 Å²	89	55.1 Å²	55.1	47%	0.466	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-55.3	136.7	168.3	-71.8	173.2	0	0	0	109.3
460	P	70.6	Confident	75.6	Confident	19 Å²	19	59 Å²	59	12%	0.123	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-62.2	142.8	-179.8	19.3	-24.8	0	0	0	110.5	C478	P460-C478 HydrophobicContact CG-CB 3.91Å; P460-C478 WeakPolarHBondContact O-CB 3.36Å; P460-C478 PolarHBondContact O-N 2.7Å; P460-C478 PolarHBondContact O-SG 3.07Å
461	K	81	Confident	76.1	Confident	63 Å²	63	64.6 Å²	64.6	27%	0.274	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	143.2	179.4	-73.9	169.4	179.8	177.5	0	109.9	E432 Q463 V474 T477	E432-K461 WeakPolarHBondContact OE1-CD 3.21Å; E432-K461 WeakPolarHBondContact OE1-CE 3.44Å; E432-K461 IonicContact OE1-NZ 3.87Å; E432-K461 PolarHBondContact OE1-NZ 3.39Å; K461-Q463 PolarHBondContact O-N 2.88Å; K461-V474 HydrophobicContact CB-CG1 3.79Å; K461-V474 HydrophobicContact CD-CG1 3.98Å; K461-V474 HydrophobicContact CG-CG1 3.97Å; K461-T477 HydrophobicContact CG-CG2 4.27Å
462	V	85.6	Confident	76.8	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	119.3	166.6	-176	0	0	0	0	107.1	F447 F449 V474 P475 A476 F511 W518	F447-V462 HydrophobicContact CD1-CG1 4.14Å; F449-V462 HydrophobicContact CD1-CB 4.4Å; F449-V462 HydrophobicContact CD1-CG1 3.84Å; F449-V462 HydrophobicContact CD1-CG2 3.84Å; F449-V462 HydrophobicContact CE1-CB 4.39Å; F449-V462 HydrophobicContact CE1-CG1 3.5Å; F449-V462 HydrophobicContact CE1-CG2 3.97Å; F449-V462 HydrophobicContact CZ-CG1 4.21Å; V462-V474 WeakPolarHBondContact O-CA 3.43Å; V462-P475 HydrophobicContact CG1-CG 4.32Å; V462-P475 VanDerWaalsContact O-CD 3.32Å; V462-P475 WeakPolarHBondContact O-CD 3.37Å; V462-A476 HydrophobicContact CB-CB 4.36Å; V462-A476 WeakPolarHBondContact CB-O 3.39Å; V462-A476 HydrophobicContact CG2-CB 4.15Å; V462-A476 PolarHBondContact N-O 3.47Å; V462-F511 HydrophobicContact CG1-CZ 4.25Å; V462-W518 HydrophobicContact CG2-CH2 4.48Å; V462-W518 HydrophobicContact CG2-CZ2 3.69Å
463	Q	89.4	Confident	77.7	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.009	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.2	174.2	-60.3	-173.8	75	0	0	108.7	L430 E432 F447 A448 K461 W472 T473 V474	L430-Q463 HydrophobicContact CD2-CB 4.29Å; E432-Q463 VanDerWaalsContact N-OE1 3.15Å; E432-Q463 PolarHBondContact O-NE2 3.27Å; F447-Q463 CarbonylContact C-O 3.51Å; F447-Q463 WeakPolarHBondContact CA-O 3.16Å; A448-Q463 HydrophobicContact CB-CB 4.37Å; A448-Q463 PolarHBondContact N-O 3.21Å; A448-Q463 PolarHBondContact O-N 2.98Å; K461-Q463 PolarHBondContact O-N 2.88Å; Q463-W472 HydrophobicContact CB-CE3 3.74Å; Q463-W472 HydrophobicContact CB-CZ3 4.02Å; Q463-T473 WeakPolarHBondContact CA-O 3.44Å; Q463-V474 HydrophobicContact CG-CG2 4.39Å
464	C	90.9	Very high	78.6	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.007	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.2	-179.7	-179.7	0	0	0	0	110.1	L446 F447 W472 T473 P475	L446-C464 CarbonylContact O-C 3.28Å; L446-C464 VanDerWaalsContact O-CA 3.29Å; L446-C464 WeakPolarHBondContact O-CA 3.49Å; F447-C464 HydrophobicContact CD1-CB 3.89Å; F447-C464 HydrophobicContact CE1-CB 3.78Å; F447-C464 WeakPolarHBondContact CE1-SG 3.24Å; C464-W472 CarbonylContact O-C 3.54Å; C464-W472 WeakPolarHBondContact O-CA 3.28Å; C464-T473 PolarHBondContact N-O 2.87Å; C464-T473 PolarHBondContact O-N 3.46Å; C464-T473 PolarHBondContact O-OG1 2.78Å; C464-P475 HydrophobicContact CB-CG 3.85Å
465	Y	91.1	Very high	79.6	Confident	4 Å²	4	63.2 Å²	63.2	2%	0.016	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.4	175.8	179.6	-111.1	0	0	0	110.5	Y391 A428 K445 L446 Q467 N470 W472	Y391-Y465 AromaticContact CE1-CE1 3.94Å; Y391-Y465 HydrophobicContact CE1-CE1 3.94Å; A428-Y465 HydrophobicContact CB-CE2 4.31Å; K445-Y465 WeakPolarHBondContact CA-O 3.31Å; K445-Y465 WeakPolarHBondContact CB-O 3.35Å; L446-Y465 HydrophobicContact CD1-CD1 3.91Å; L446-Y465 PolarHBondContact N-O 3.4Å; L446-Y465 PolarHBondContact O-N 3.04Å; Y465-Q467 HydrophobicContact CE1-CB 4.01Å; Y465-Q467 HydrophobicContact CE1-CG 4.33Å; Y465-N470 PolarHBondContact OH-OD1 2.83Å; Y465-W472 AromaticContact CD2-CD1 3.69Å; Y465-W472 HydrophobicContact CD2-CD2 4.04Å; Y465-W472 AromaticContact CD2-CE2 3.66Å; Y465-W472 HydrophobicContact CD2-CG 4.07Å; Y465-W472 HydrophobicContact CD2-CZ2 4.23Å; Y465-W472 AromaticContact CD2-NE1 3.41Å; Y465-W472 HydrophobicContact CG-CD2 4.29Å; Y465-W472 AromaticContact CG-CE2 3.9Å; Y465-W472 HydrophobicContact CG-CZ2 4.05Å
466	D	88.1	Confident	80.8	Confident	27 Å²	27	61.4 Å²	61.4	14%	0.144	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.4	168.2	-157.6	-46.8	0	0	0	109.4	K445 C468 E469 N470 R471	K445-D466 VanDerWaalsContact CE-OD2 3.25Å; K445-D466 WeakPolarHBondContact CE-OD2 3.33Å; K445-D466 IonicContact NZ-OD2 3.78Å; K445-D466 PolarHBondContact NZ-OD2 2.88Å; D466-C468 VanDerWaalsContact C-N 3.35Å; D466-C468 WeakPolarHBondContact OD1-CB 3.37Å; D466-C468 PolarHBondContact OD1-N 2.82Å; D466-E469 HydrophobicContact CB-CB 4.34Å; D466-E469 HydrophobicContact CB-CG 4.48Å; D466-N470 WeakPolarHBondContact O-CA 3.46Å; D466-N470 PolarHBondContact O-N 3.35Å; D466-R471 PolarHBondContact N-O 3.17Å; D466-R471 PolarHBondContact O-N 2.71Å; D466-R471 VanDerWaalsContact O-N 3.16Å
467	Q	85.1	Confident	82	Confident	47 Å²	47	58.9 Å²	58.9	22%	0.22	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.5	-179.3	-168.8	-169.2	25.6	0	0	111.9	L386 Y391 Y465 E469 N470	L386-Q467 HydrophobicContact CD2-CB 4.1Å; L386-Q467 HydrophobicContact CD2-CG 4.48Å; Y391-Q467 PolarHBondContact OH-NE2 2.95Å; Y465-Q467 HydrophobicContact CE1-CB 4.01Å; Y465-Q467 HydrophobicContact CE1-CG 4.33Å; Q467-E469 VanDerWaalsContact C-N 3.29Å; Q467-E469 PolarHBondContact O-N 3.34Å; Q467-N470 PolarHBondContact O-N 2.81Å
468	C	84.4	Confident	83.4	Confident	113 Å²	113	51.1 Å²	51.1	76%	0.764	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-34.8	-179	-65.5	0	0	0	0	111.2	D466	D466-C468 VanDerWaalsContact C-N 3.35Å; D466-C468 WeakPolarHBondContact OD1-CB 3.37Å; D466-C468 PolarHBondContact OD1-N 2.82Å
469	E	85	Confident	84	Confident	104 Å²	104	46.7 Å²	46.7	49%	0.486	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-8.6	176.9	-58	-171.2	159.6	0	0	113.4	D466 Q467 R471	D466-E469 HydrophobicContact CB-CB 4.34Å; D466-E469 HydrophobicContact CB-CG 4.48Å; Q467-E469 VanDerWaalsContact C-N 3.29Å; Q467-E469 PolarHBondContact O-N 3.34Å; E469-R471 VanDerWaalsContact C-N 3.29Å; E469-R471 HydrophobicContact CB-CB 4.06Å; E469-R471 PolarHBondContact O-N 3.28Å; E469-R471 IonicContact OE1-NH2 3.19Å; E469-R471 IonicContact OE2-CZ 3.84Å; E469-R471 VanDerWaalsContact OE2-CZ 3.24Å; E469-R471 IonicContact OE2-NE 2.72Å; E469-R471 PolarHBondContact OE2-NE 2.97Å; E469-R471 VanDerWaalsContact OE2-NE 3.12Å; E469-R471 IonicContact OE2-NH2 3.21Å; E469-R471 PolarHBondContact OE2-NH2 2.81Å
470	N	88.7	Confident	84.4	Confident	80 Å²	80	44.5 Å²	44.5	43%	0.428	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.7	55.5	-168	-175.5	18	0	0	0	111.2	A428 Y465 D466 Q467	A428-N470 WeakPolarHBondContact CB-O 3.49Å; A428-N470 WeakPolarHBondContact CB-OD1 3.36Å; A428-N470 PolarHBondContact N-OD1 2.83Å; Y465-N470 PolarHBondContact OH-OD1 2.83Å; D466-N470 WeakPolarHBondContact O-CA 3.46Å; D466-N470 PolarHBondContact O-N 3.35Å; Q467-N470 PolarHBondContact O-N 2.81Å
471	R	90.1	Very high	84.4	Confident	120 Å²	120	46.4 Å²	46.4	45%	0.453	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	139.4	-171.7	-172.4	170.9	64.7	172	1.5	112.7	D466 E469	D466-R471 PolarHBondContact N-O 3.17Å; D466-R471 PolarHBondContact O-N 2.71Å; D466-R471 VanDerWaalsContact O-N 3.16Å; E469-R471 VanDerWaalsContact C-N 3.29Å; E469-R471 HydrophobicContact CB-CB 4.06Å; E469-R471 PolarHBondContact O-N 3.28Å; E469-R471 IonicContact OE1-NH2 3.19Å; E469-R471 IonicContact OE2-CZ 3.84Å; E469-R471 VanDerWaalsContact OE2-CZ 3.24Å; E469-R471 IonicContact OE2-NE 2.72Å; E469-R471 PolarHBondContact OE2-NE 2.97Å; E469-R471 VanDerWaalsContact OE2-NE 3.12Å; E469-R471 IonicContact OE2-NH2 3.21Å; E469-R471 PolarHBondContact OE2-NH2 2.81Å
472	W	89.9	Confident	84	Confident	3 Å²	3	43.6 Å²	43.6	1%	0.011	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.4	170.3	-68.8	88.8	0	0	0	111.8	V393 V414 A428 L430 R431 L446 A448 Q463 C464 Y465	V393-W472 HydrophobicContact CG1-CH2 4.04Å; V393-W472 HydrophobicContact CG1-CZ2 4.26Å; V393-W472 HydrophobicContact CG2-CH2 4.2Å; V393-W472 HydrophobicContact CG2-CZ2 4.22Å; V414-W472 HydrophobicContact CG1-CZ2 4.26Å; V414-W472 HydrophobicContact CG2-CZ2 3.83Å; A428-W472 PolarHBondContact O-NE1 2.85Å; L430-W472 HydrophobicContact CD2-CD2 3.77Å; L430-W472 HydrophobicContact CD2-CE3 3.72Å; L430-W472 HydrophobicContact CD2-CH2 3.72Å; L430-W472 HydrophobicContact CD2-CZ2 3.77Å; L430-W472 HydrophobicContact CD2-CZ3 3.69Å; L430-W472 HydrophobicContact CG-CZ2 4.48Å; R431-W472 HydrophobicContact CG-CB 4.2Å; R431-W472 PolarHBondContact NE-O 3.17Å; R431-W472 PolarHBondContact NH2-O 3.49Å; L446-W472 HydrophobicContact CB-CH2 4.39Å; A448-W472 HydrophobicContact CB-CZ3 4.24Å; Q463-W472 HydrophobicContact CB-CE3 3.74Å; Q463-W472 HydrophobicContact CB-CZ3 4.02Å; C464-W472 CarbonylContact O-C 3.54Å; C464-W472 WeakPolarHBondContact O-CA 3.28Å; Y465-W472 AromaticContact CD2-CD1 3.69Å; Y465-W472 HydrophobicContact CD2-CD2 4.04Å; Y465-W472 AromaticContact CD2-CE2 3.66Å; Y465-W472 HydrophobicContact CD2-CG 4.07Å; Y465-W472 HydrophobicContact CD2-CZ2 4.23Å; Y465-W472 AromaticContact CD2-NE1 3.41Å; Y465-W472 HydrophobicContact CG-CD2 4.29Å; Y465-W472 AromaticContact CG-CE2 3.9Å; Y465-W472 HydrophobicContact CG-CZ2 4.05Å
473	T	89.5	Confident	83.3	Confident	49 Å²	49	47.1 Å²	47.1	30%	0.301	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	163	173.7	62.2	0	0	0	0	110.1	Q463 C464 P475	Q463-T473 WeakPolarHBondContact CA-O 3.44Å; C464-T473 PolarHBondContact N-O 2.87Å; C464-T473 PolarHBondContact O-N 3.46Å; C464-T473 PolarHBondContact O-OG1 2.78Å; T473-P475 WeakPolarHBondContact O-CD 3.13Å
474	V	88.3	Confident	82.5	Confident	63 Å²	63	50.7 Å²	50.7	38%	0.382	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	88.5	177.2	179.6	0	0	0	0	108.2	R431 K461 V462 Q463	R431-V474 HydrophobicContact CB-CG2 4.46Å; R431-V474 HydrophobicContact CG-CG2 4.29Å; K461-V474 HydrophobicContact CB-CG1 3.79Å; K461-V474 HydrophobicContact CD-CG1 3.98Å; K461-V474 HydrophobicContact CG-CG1 3.97Å; V462-V474 WeakPolarHBondContact O-CA 3.43Å; Q463-V474 HydrophobicContact CG-CG2 4.39Å
475	P	83.8	Confident	81.9	Confident	39 Å²	39	51.2 Å²	51.2	25%	0.253	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-27.1	-175.8	27.4	-36.5	0	0	0	114	V462 C464 T473 Y516	V462-P475 HydrophobicContact CG1-CG 4.32Å; V462-P475 VanDerWaalsContact O-CD 3.32Å; V462-P475 WeakPolarHBondContact O-CD 3.37Å; C464-P475 HydrophobicContact CB-CG 3.85Å; T473-P475 WeakPolarHBondContact O-CD 3.13Å; P475-Y516 HydrophobicContact CB-CD1 3.7Å; P475-Y516 HydrophobicContact CB-CD2 3.81Å; P475-Y516 HydrophobicContact CB-CE1 3.69Å; P475-Y516 HydrophobicContact CB-CE2 3.81Å; P475-Y516 HydrophobicContact CB-CG 3.74Å; P475-Y516 HydrophobicContact CG-CD1 4.06Å; P475-Y516 HydrophobicContact CG-CE1 3.96Å
476	A	84.1	Confident	81.4	Confident	19 Å²	19	51.2 Å²	51.2	16%	0.157	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	165.5	-173.9	0	0	0	0	0	112.7	V462 F511	V462-A476 HydrophobicContact CB-CB 4.36Å; V462-A476 WeakPolarHBondContact CB-O 3.39Å; V462-A476 HydrophobicContact CG2-CB 4.15Å; V462-A476 PolarHBondContact N-O 3.47Å; A476-F511 HydrophobicContact CB-CE2 4.22Å; A476-F511 HydrophobicContact CB-CZ 4.46Å
477	T	83.8	Confident	81.4	Confident	82 Å²	82	50.6 Å²	50.6	50%	0.503	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.7	167.9	44.3	0	0	0	0	110.3	K461 W518	K461-T477 HydrophobicContact CG-CG2 4.27Å; T477-W518 PolarHBondContact O-NE1 3.13Å; T477-W518 VanDerWaalsContact O-NE1 3.12Å
478	C	78.6	Confident	81.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.007	26%	0.264	C	S	.	.			trans	-68.6	143.8	174.2	-65.7	0	0	0	0	110.1	P460 Q480 W482	P460-C478 HydrophobicContact CG-CB 3.91Å; P460-C478 WeakPolarHBondContact O-CB 3.36Å; P460-C478 PolarHBondContact O-N 2.7Å; P460-C478 PolarHBondContact O-SG 3.07Å; C478-Q480 PolarHBondContact O-N 3.35Å; C478-W482 HydrophobicContact CB-CE3 4.2Å
479	P	74	Confident	81.5	Confident	55 Å²	55	45 Å²	45	36%	0.357	24%	0.238	S	C	.	.	S	Bend	trans	-69.4	-17.7	-179.1	28.5	-35.3	0	0	0	113	W482 Y509 W518	P479-W482 HydrophobicContact CG-CH2 3.63Å; P479-W482 HydrophobicContact CG-CZ2 3.5Å; P479-W482 VanDerWaalsContact CG-CZ2 3.5Å; P479-Y509 HydrophobicContact CG-CD1 4.3Å; P479-Y509 HydrophobicContact CG-CE1 4.19Å; P479-W518 HydrophobicContact CG-CD2 4.25Å; P479-W518 HydrophobicContact CG-CE3 4.5Å; P479-W518 HydrophobicContact CG-CG 4.38Å
480	Q	71.7	Confident	81.3	Confident	44 Å²	44	40.7 Å²	40.7	21%	0.206	22%	0.219	C	C	.	.	S	Bend	trans	-144.7	161.8	-177	-72.2	-172.5	-0.7	0	0	110.7	C478 W482 T501 Y509	C478-Q480 PolarHBondContact O-N 3.35Å; Q480-W482 PolarHBondContact O-N 3.12Å; Q480-T501 HydrophobicContact CB-CG2 4.37Å; Q480-Y509 PolarHBondContact NE2-OH 2.82Å
481	P	68.6	Low	80.7	Confident	59 Å²	59	39.8 Å²	39.8	38%	0.383	23%	0.229	S	C	.	.			trans	-72.8	75.5	176.9	31.4	-35.6	0	0	0	111.1	R483	P481-R483 PolarHBondContact O-N 2.98Å
482	W	73.2	Confident	79.9	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.015	23%	0.232	C	C	.	.			trans	-76.3	109.5	-177.3	-76.1	-14	0	0	0	113.2	G450 G451 C478 P479 Q480 T485 I496 Y509 W518	G450-W482 VanDerWaalsContact CA-O 3.25Å; G450-W482 WeakPolarHBondContact CA-O 3.13Å; G451-W482 PolarHBondContact N-O 2.87Å; C478-W482 HydrophobicContact CB-CE3 4.2Å; P479-W482 HydrophobicContact CG-CH2 3.63Å; P479-W482 HydrophobicContact CG-CZ2 3.5Å; P479-W482 VanDerWaalsContact CG-CZ2 3.5Å; Q480-W482 PolarHBondContact O-N 3.12Å; W482-T485 HydrophobicContact CB-CG2 3.52Å; W482-T485 HydrophobicContact CD2-CG2 4.35Å; W482-T485 HydrophobicContact CG-CG2 3.75Å; W482-I496 HydrophobicContact CD2-CG2 4.21Å; W482-I496 HydrophobicContact CE3-CB 4.38Å; W482-I496 HydrophobicContact CE3-CG2 3.56Å; W482-I496 HydrophobicContact CH2-CB 4.35Å; W482-I496 HydrophobicContact CH2-CG2 4.27Å; W482-I496 HydrophobicContact CZ3-CB 3.85Å; W482-I496 HydrophobicContact CZ3-CG1 4.39Å; W482-I496 HydrophobicContact CZ3-CG2 3.54Å; W482-Y509 HydrophobicContact CH2-CD1 4.5Å; W482-Y509 AromaticContact CH2-CD2 3.74Å; W482-Y509 HydrophobicContact CH2-CD2 3.74Å; W482-Y509 HydrophobicContact CH2-CE2 4.44Å; W482-Y509 AromaticContact CH2-CG 3.74Å; W482-Y509 HydrophobicContact CH2-CG 3.74Å; W482-Y509 HydrophobicContact CZ2-CD1 4.36Å; W482-Y509 AromaticContact CZ2-CD2 3.17Å; W482-Y509 HydrophobicContact CZ2-CD2 3.17Å; W482-Y509 AromaticContact CZ2-CE2 3.51Å; W482-Y509 HydrophobicContact CZ2-CE2 3.51Å; W482-Y509 AromaticContact CZ2-CG 3.62Å; W482-Y509 HydrophobicContact CZ2-CG 3.62Å; W482-W518 HydrophobicContact CE3-CH2 4.42Å; W482-W518 AromaticContact CH2-CE3 3.78Å; W482-W518 HydrophobicContact CH2-CE3 3.78Å; W482-W518 AromaticContact CH2-CH2 3.79Å; W482-W518 HydrophobicContact CH2-CH2 3.79Å; W482-W518 AromaticContact CH2-CZ3 3.32Å; W482-W518 HydrophobicContact CH2-CZ3 3.32Å; W482-W518 HydrophobicContact CZ3-CE3 4.2Å; W482-W518 AromaticContact CZ3-CH2 3.32Å; W482-W518 HydrophobicContact CZ3-CH2 3.32Å; W482-W518 HydrophobicContact CZ3-CZ2 4.14Å; W482-W518 AromaticContact CZ3-CZ3 3.32Å; W482-W518 HydrophobicContact CZ3-CZ3 3.32Å
483	R	71.6	Confident	79.5	Confident	74 Å²	74	41.9 Å²	41.9	28%	0.279	25%	0.247	S	C	.	.			trans	-117.5	145.5	170.2	-58.9	174	-179.6	160.9	3.3	109.3	T452 P481 T485 G499 D500	T452-R483 HydrophobicContact CG2-CB 4.46Å; T452-R483 HydrophobicContact CG2-CG 4.01Å; P481-R483 PolarHBondContact O-N 2.98Å; R483-T485 VanDerWaalsContact C-N 3.25Å; R483-T485 PolarHBondContact O-N 3.27Å; R483-G499 CarbonylContact O-C 3.46Å; R483-G499 WeakPolarHBondContact O-CA 3.46Å; R483-D500 HydrophobicContact CB-CB 4.29Å; R483-D500 PolarHBondContact O-N 3Å
484	Y	72	Confident	79.4	Confident	76 Å²	76	39.5 Å²	39.5	30%	0.298	23%	0.233	S	C	.	.	S	Bend	trans	54.5	41.1	178.3	-54.6	-80.4	0	0	0	113.5	N436 S530	N436-Y484 HydrophobicContact CB-CD1 3.84Å; N436-Y484 HydrophobicContact CB-CE1 3.84Å; N436-Y484 WeakPolarHBondContact ND2-CE1 3.37Å; Y484-S530 WeakPolarHBondContact CB-OG 3.42Å; Y484-S530 WeakPolarHBondContact CD1-OG 3.35Å; Y484-S530 PolarHBondContact O-N 3.39Å
485	T	77.4	Confident	79.3	Confident	12 Å²	12	36.8 Å²	36.8	7%	0.074	22%	0.216	C	C	.	.			trans	-87.7	154.6	179.7	47.8	0	0	0	0	111.5	W482 R483 I496 G498	W482-T485 HydrophobicContact CB-CG2 3.52Å; W482-T485 HydrophobicContact CD2-CG2 4.35Å; W482-T485 HydrophobicContact CG-CG2 3.75Å; R483-T485 VanDerWaalsContact C-N 3.25Å; R483-T485 PolarHBondContact O-N 3.27Å; T485-I496 HydrophobicContact CG2-CG2 4.37Å; T485-G498 WeakPolarHBondContact CG2-O 3.42Å
486	A	82.2	Confident	79.4	Confident	5 Å²	5	35 Å²	35	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	144.8	166.3	0	0	0	0	0	109.5	I496 M497 C531 A533	A486-I496 WeakPolarHBondContact O-CA 3.47Å; A486-M497 HydrophobicContact CB-CG 4.22Å; A486-M497 PolarHBondContact N-O 3.23Å; A486-M497 PolarHBondContact O-N 3.29Å; A486-C531 WeakPolarHBondContact CB-O 3.16Å; A486-A533 HydrophobicContact CB-CB 3.63Å
487	A	86.7	Confident	79.4	Confident	14 Å²	14	34.3 Å²	34.3	12%	0.116	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144	169.1	0	0	0	0	0	110.3	A438 V440 F449 F495 I496	A438-A487 HydrophobicContact CB-CB 3.56Å; V440-A487 HydrophobicContact CG1-CB 3.67Å; V440-A487 WeakPolarHBondContact CG1-O 3Å; V440-A487 HydrophobicContact CG2-CB 4.26Å; F449-A487 HydrophobicContact CD2-CB 4.49Å; A487-F495 CarbonylContact C-O 3.51Å; A487-F495 VanDerWaalsContact CA-O 3.22Å; A487-F495 WeakPolarHBondContact CA-O 3.43Å; A487-I496 HydrophobicContact CB-CG1 3.94Å
488	A	87.2	Confident	79	Confident	4 Å²	4	30.7 Å²	30.7	3%	0.033	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	153	176	0	0	0	0	0	109.8	F495 A533 L540	A488-F495 PolarHBondContact N-O 2.96Å; A488-F495 PolarHBondContact O-N 3Å; A488-A533 HydrophobicContact CB-CB 3.86Å; A488-L540 HydrophobicContact CB-CD2 3.52Å
489	V	85.3	Confident	78.6	Confident	37 Å²	37	30.6 Å²	30.6	22%	0.224	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.1	-175.5	-178.3	0	0	0	0	109.4	V440 S441 A442 I494 A535	V440-V489 HydrophobicContact CB-CG2 3.72Å; V440-V489 HydrophobicContact CG1-CG2 4.23Å; V440-V489 HydrophobicContact CG2-CG2 3.97Å; S441-V489 WeakPolarHBondContact O-CG2 3.41Å; A442-V489 HydrophobicContact CB-CG1 4.13Å; A442-V489 HydrophobicContact CB-CG2 4.44Å; V489-I494 HydrophobicContact CG2-CG1 4.16Å; V489-I494 HydrophobicContact CG2-CG2 4.32Å; V489-A535 WeakPolarHBondContact O-CB 3.12Å
490	L	80.8	Confident	78.3	Confident	14 Å²	14	31.4 Å²	31.4	7%	0.073	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	111.4	178.4	-168	70.5	0	0	0	109.2	N492 Q493 F495 A535 L540 P560	L490-N492 PolarHBondContact O-N 2.58Å; L490-N492 VanDerWaalsContact O-N 3.15Å; L490-Q493 PolarHBondContact N-O 3.25Å; L490-Q493 PolarHBondContact O-N 3.48Å; L490-Q493 VanDerWaalsContact O-N 3.09Å; L490-F495 HydrophobicContact CB-CD2 4.04Å; L490-F495 HydrophobicContact CB-CE2 3.84Å; L490-F495 HydrophobicContact CD2-CE2 4.32Å; L490-A535 HydrophobicContact CD1-CB 4Å; L490-L540 HydrophobicContact CB-CD1 4.37Å; L490-L540 HydrophobicContact CB-CD2 4.08Å; L490-L540 HydrophobicContact CB-CG 4.18Å; L490-L540 HydrophobicContact CD1-CG 4.44Å; L490-L540 HydrophobicContact CD2-CD1 4.26Å; L490-L540 HydrophobicContact CD2-CG 4.04Å; L490-L540 HydrophobicContact CG-CG 4.47Å; L490-P560 HydrophobicContact CD2-CB 3.87Å; L490-P560 HydrophobicContact CD2-CG 3.64Å
491	G	75	Confident	77.9	Confident	62 Å²	62	29.9 Å²	29.9	64%	0.639	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.6	-116.3	-171.1	0	0	0	0	0	111.1
492	N	73.9	Confident	77.1	Confident	99 Å²	99	35.2 Å²	35.2	53%	0.529	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	4.3	-179.6	-81.8	-14.2	0	0	0	114.2	L490 S513	L490-N492 PolarHBondContact O-N 2.58Å; L490-N492 VanDerWaalsContact O-N 3.15Å; N492-S513 PolarHBondContact O-OG 2.68Å
493	Q	82.3	Confident	75.9	Confident	67 Å²	67	43.8 Å²	43.8	31%	0.313	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.5	-171.3	-66.6	168.9	8.2	0	0	110.2	L490 F495 K510	L490-Q493 PolarHBondContact N-O 3.25Å; L490-Q493 PolarHBondContact O-N 3.48Å; L490-Q493 VanDerWaalsContact O-N 3.09Å; Q493-F495 HydrophobicContact CB-CD2 4.43Å; Q493-F495 HydrophobicContact CB-CE2 3.79Å; Q493-K510 HydrophobicContact CB-CD 4.46Å; Q493-K510 HydrophobicContact CB-CG 4.34Å; Q493-K510 HydrophobicContact CG-CD 4.46Å; Q493-K510 VanDerWaalsContact OE1-CD 3.25Å
494	I	88.1	Confident	75.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.2	179	-50.8	178.8	0	0	0	107.8	V440 A442 F447 F449 V489 I496 K510 F511	V440-I494 HydrophobicContact CG2-CD1 4.25Å; V440-I494 HydrophobicContact CG2-CG2 3.72Å; A442-I494 HydrophobicContact CB-CD1 3.68Å; A442-I494 HydrophobicContact CB-CG1 3.82Å; F447-I494 HydrophobicContact CB-CD1 4.3Å; F447-I494 HydrophobicContact CD2-CD1 3.71Å; F447-I494 HydrophobicContact CE2-CD1 4.15Å; F447-I494 HydrophobicContact CG-CD1 3.97Å; F449-I494 HydrophobicContact CE2-CD1 3.98Å; F449-I494 HydrophobicContact CE2-CG2 3.77Å; F449-I494 HydrophobicContact CZ-CB 4.48Å; F449-I494 HydrophobicContact CZ-CD1 3.76Å; F449-I494 HydrophobicContact CZ-CG2 4.05Å; V489-I494 HydrophobicContact CG2-CG1 4.16Å; V489-I494 HydrophobicContact CG2-CG2 4.32Å; I494-I496 HydrophobicContact CB-CD1 4.34Å; I494-I496 HydrophobicContact CG2-CD1 3.73Å; I494-I496 HydrophobicContact CG2-CG1 4.33Å; I494-K510 CarbonylContact O-C 3.54Å; I494-K510 WeakPolarHBondContact O-CA 3.42Å; I494-F511 HydrophobicContact CB-CB 4.3Å; I494-F511 HydrophobicContact CD1-CD1 4.17Å; I494-F511 PolarHBondContact N-O 3.14Å; I494-F511 VanDerWaalsContact N-O 3.14Å; I494-F511 PolarHBondContact O-N 3.27Å
495	F	85.9	Confident	74.4	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.8	176.4	-70	-103.6	0	0	0	108.4	A487 A488 L490 Q493 Y509 K510 V521 L540 Y558	A487-F495 CarbonylContact C-O 3.51Å; A487-F495 VanDerWaalsContact CA-O 3.22Å; A487-F495 WeakPolarHBondContact CA-O 3.43Å; A488-F495 PolarHBondContact N-O 2.96Å; A488-F495 PolarHBondContact O-N 3Å; L490-F495 HydrophobicContact CB-CD2 4.04Å; L490-F495 HydrophobicContact CB-CE2 3.84Å; L490-F495 HydrophobicContact CD2-CE2 4.32Å; Q493-F495 HydrophobicContact CB-CD2 4.43Å; Q493-F495 HydrophobicContact CB-CE2 3.79Å; F495-Y509 CarbonylContact C-O 3.5Å; F495-Y509 WeakPolarHBondContact CA-O 3.07Å; F495-K510 HydrophobicContact CD1-CB 4.31Å; F495-K510 HydrophobicContact CE1-CB 4.13Å; F495-K510 HydrophobicContact CE1-CD 4.21Å; F495-K510 HydrophobicContact CE1-CG 4.42Å; F495-K510 HydrophobicContact CZ-CD 3.95Å; F495-K510 HydrophobicContact CZ-CG 4.33Å; F495-V521 HydrophobicContact CD1-CG2 4.39Å; F495-V521 HydrophobicContact CE1-CG1 4.25Å; F495-L540 HydrophobicContact CB-CD1 3.58Å; F495-L540 HydrophobicContact CD1-CD1 3.67Å; F495-L540 HydrophobicContact CD2-CD1 3.57Å; F495-L540 HydrophobicContact CE1-CD1 4.18Å; F495-L540 HydrophobicContact CE2-CD1 4.11Å; F495-L540 HydrophobicContact CG-CD1 3.31Å; F495-L540 HydrophobicContact CZ-CD1 4.38Å; F495-Y558 HydrophobicContact CD1-CE1 4.37Å; F495-Y558 AromaticContact CE1-CE1 3.73Å; F495-Y558 HydrophobicContact CE1-CE1 3.73Å; F495-Y558 HydrophobicContact CZ-CE1 4.29Å
496	I	85.8	Confident	73.5	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	134.7	177.4	-60.6	97.3	0	0	0	108.2	F449 W482 T485 A486 A487 I494 A508 Y509 F511 W518	F449-I496 HydrophobicContact CB-CG1 4.5Å; F449-I496 HydrophobicContact CD1-CD1 4.13Å; F449-I496 HydrophobicContact CD1-CG1 4.38Å; F449-I496 HydrophobicContact CD2-CD1 4.39Å; F449-I496 HydrophobicContact CD2-CG1 4.24Å; F449-I496 HydrophobicContact CE1-CD1 4.05Å; F449-I496 HydrophobicContact CE2-CD1 4.31Å; F449-I496 HydrophobicContact CG-CD1 4.3Å; F449-I496 HydrophobicContact CG-CG1 4.13Å; F449-I496 HydrophobicContact CZ-CD1 4.15Å; W482-I496 HydrophobicContact CD2-CG2 4.21Å; W482-I496 HydrophobicContact CE3-CB 4.38Å; W482-I496 HydrophobicContact CE3-CG2 3.56Å; W482-I496 HydrophobicContact CH2-CB 4.35Å; W482-I496 HydrophobicContact CH2-CG2 4.27Å; W482-I496 HydrophobicContact CZ3-CB 3.85Å; W482-I496 HydrophobicContact CZ3-CG1 4.39Å; W482-I496 HydrophobicContact CZ3-CG2 3.54Å; T485-I496 HydrophobicContact CG2-CG2 4.37Å; A486-I496 WeakPolarHBondContact O-CA 3.47Å; A487-I496 HydrophobicContact CB-CG1 3.94Å; I494-I496 HydrophobicContact CB-CD1 4.34Å; I494-I496 HydrophobicContact CG2-CD1 3.73Å; I494-I496 HydrophobicContact CG2-CG1 4.33Å; I496-A508 WeakPolarHBondContact O-CA 3.24Å; I496-Y509 PolarHBondContact N-O 2.91Å; I496-Y509 PolarHBondContact O-N 2.91Å; I496-F511 HydrophobicContact CD1-CB 3.88Å; I496-W518 HydrophobicContact CD1-CH2 3.85Å; I496-W518 HydrophobicContact CD1-CZ3 3.62Å
497	M	83.8	Confident	73	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	155.9	-169.9	57.2	-163.2	-56.2	0	0	113.9	A486 A508 V524 A533 V542 W565	A486-M497 HydrophobicContact CB-CG 4.22Å; A486-M497 PolarHBondContact N-O 3.23Å; A486-M497 PolarHBondContact O-N 3.29Å; M497-A508 HydrophobicContact CB-CB 3.98Å; M497-V524 HydrophobicContact CB-CG2 4.3Å; M497-V524 HydrophobicContact CE-CB 4.49Å; M497-V524 HydrophobicContact CE-CG1 4.22Å; M497-V524 HydrophobicContact CE-CG2 3.4Å; M497-A533 HydrophobicContact CG-CB 4.44Å; M497-A533 HydrophobicContact SD-CB 4.13Å; M497-V542 HydrophobicContact CE-CB 4.12Å; M497-V542 HydrophobicContact CE-CG1 4.29Å; M497-V542 HydrophobicContact CE-CG2 3.26Å; M497-V542 HydrophobicContact CG-CG2 4.3Å; M497-V542 HydrophobicContact SD-CG2 3.23Å; M497-V542 WeakPolarHBondContact SD-CG2 3.28Å; M497-W565 HydrophobicContact CE-CE3 4.48Å; M497-W565 HydrophobicContact CE-CH2 2.96Å; M497-W565 HydrophobicContact CE-CZ2 3.27Å; M497-W565 HydrophobicContact CE-CZ3 3.62Å; M497-W565 HydrophobicContact SD-CH2 3.63Å; M497-W565 HydrophobicContact SD-CZ2 4.1Å
498	G	74.8	Confident	72.6	Confident	5 Å²	5	38.3 Å²	38.3	5%	0.052	21%	0.212	C	C	.	.			trans	70.9	-156.4	-175.6	0	0	0	0	0	112.4	T485 S507 R528	T485-G498 WeakPolarHBondContact CG2-O 3.42Å; G498-S507 PolarHBondContact N-O 3.33Å; G498-R528 CarbonylContact C-O 3.6Å; G498-R528 WeakPolarHBondContact CA-O 3.5Å
499	G	71.1	Confident	72.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.			trans	103.1	166	176.7	0	0	0	0	0	114.4	R483 T501 R528	R483-G499 CarbonylContact O-C 3.46Å; R483-G499 WeakPolarHBondContact O-CA 3.46Å; G499-T501 PolarHBondContact O-N 3.18Å; G499-R528 PolarHBondContact N-O 2.96Å
500	D	67.7	Low	72.5	Confident	71 Å²	71	40.3 Å²	40.3	38%	0.38	22%	0.216	S	C	.	.			trans	-80.2	97	176.6	-175.4	23.4	0	0	0	109.5	R483 M529	R483-D500 HydrophobicContact CB-CB 4.29Å; R483-D500 PolarHBondContact O-N 3Å; D500-M529 HydrophobicContact CB-CE 4.29Å
501	T	61.6	Low	72.8	Confident	12 Å²	12	39.7 Å²	39.7	7%	0.074	21%	0.213	C	C	.	.			trans	-126.5	136.7	172.7	62	0	0	0	0	108.8	Q480 G499 F503 S504 A505	Q480-T501 HydrophobicContact CB-CG2 4.37Å; G499-T501 PolarHBondContact O-N 3.18Å; T501-F503 PolarHBondContact O-N 3.01Å; T501-S504 WeakPolarHBondContact OG1-CA 3.34Å; T501-S504 PolarHBondContact OG1-N 3.32Å; T501-S504 PolarHBondContact OG1-O 2.82Å; T501-A505 PolarHBondContact OG1-N 3.04Å
502	E	53	Low	73.2	Confident	171 Å²	171	39 Å²	39	80%	0.799	20%	0.195	S	C	*	.	S	Bend	trans	-59.1	-21.6	-175.8	-70.2	-179.4	164.6	0	0	113.4
503	F	48.7	Very low	73.6	Confident	184 Å²	184	34.6 Å²	34.6	81%	0.807	17%	0.172	S	C	*	.	S	Bend	trans	-132.1	-11.2	-171.3	-59	-77.5	0	0	0	115.8	T501	T501-F503 PolarHBondContact O-N 3.01Å
504	S	53.5	Low	73.6	Confident	27 Å²	27	37.7 Å²	37.7	19%	0.189	19%	0.186	C	C	.	.			trans	-153.4	57.1	-171.9	-150.9	0	0	0	0	116.4	T501 C506 S507	T501-S504 WeakPolarHBondContact OG1-CA 3.34Å; T501-S504 PolarHBondContact OG1-N 3.32Å; T501-S504 PolarHBondContact OG1-O 2.82Å; S504-C506 PolarHBondContact O-N 2.94Å; S504-S507 VanDerWaalsContact CB-OG 3.26Å; S504-S507 WeakPolarHBondContact CB-OG 3.15Å; S504-S507 PolarHBondContact O-N 3.43Å; S504-S507 PolarHBondContact OG-OG 2.96Å
505	A	57.7	Low	73.4	Confident	5 Å²	5	41 Å²	41	4%	0.041	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-1.7	173.9	0	0	0	0	0	115.1	T501 K527 R528 F547	T501-A505 PolarHBondContact OG1-N 3.04Å; A505-K527 HydrophobicContact CB-CB 3.8Å; A505-K527 HydrophobicContact CB-CD 4.3Å; A505-K527 HydrophobicContact CB-CG 3.95Å; A505-K527 WeakPolarHBondContact O-CA 3.28Å; A505-R528 PolarHBondContact O-N 2.86Å; A505-F547 HydrophobicContact CB-CD2 4.03Å; A505-F547 HydrophobicContact CB-CE2 3.98Å
506	C	58.9	Low	73.3	Confident	30 Å²	30	44.5 Å²	44.5	20%	0.203	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-8.4	170.7	-59.7	0	0	0	0	113.3	S504 A508 D523 V524 K527	S504-C506 PolarHBondContact O-N 2.94Å; C506-A508 PolarHBondContact O-N 3.02Å; C506-D523 HydrophobicContact CB-CB 4.1Å; C506-D523 CarbonylContact O-C 3.56Å; C506-D523 WeakPolarHBondContact O-CA 3.28Å; C506-V524 WeakPolarHBondContact O-CG2 3.31Å; C506-V524 PolarHBondContact O-N 3.31Å; C506-K527 WeakPolarHBondContact SG-CG 3.28Å
507	S	70.6	Confident	73.3	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.021	25%	0.248	C	C	.	.			trans	-67.4	136.6	-173.7	-72.5	0	0	0	0	111.9	G498 S504	G498-S507 PolarHBondContact N-O 3.33Å; S504-S507 VanDerWaalsContact CB-OG 3.26Å; S504-S507 WeakPolarHBondContact CB-OG 3.15Å; S504-S507 PolarHBondContact O-N 3.43Å; S504-S507 PolarHBondContact OG-OG 2.96Å
508	A	78.9	Confident	73.4	Confident	2 Å²	2	53 Å²	53	2%	0.017	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	141.5	161.7	0	0	0	0	0	109.4	I496 M497 C506 V521 V524 W565	I496-A508 WeakPolarHBondContact O-CA 3.24Å; M497-A508 HydrophobicContact CB-CB 3.98Å; C506-A508 PolarHBondContact O-N 3.02Å; A508-V521 VanDerWaalsContact C-CG2 3.48Å; A508-V521 HydrophobicContact CB-CG2 3.53Å; A508-V521 VanDerWaalsContact O-CG2 3.32Å; A508-V521 WeakPolarHBondContact O-CG2 3.02Å; A508-V521 PolarHBondContact O-N 2.97Å; A508-V524 HydrophobicContact CB-CG2 4Å; A508-W565 HydrophobicContact CB-CZ2 4.36Å
509	Y	83.9	Confident	73.9	Confident	27 Å²	27	56.5 Å²	56.5	11%	0.106	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	139.6	-179	-70.8	-95.1	0	0	0	110.2	P479 Q480 W482 F495 I496 T519 K520	P479-Y509 HydrophobicContact CG-CD1 4.3Å; P479-Y509 HydrophobicContact CG-CE1 4.19Å; Q480-Y509 PolarHBondContact NE2-OH 2.82Å; W482-Y509 HydrophobicContact CH2-CD1 4.5Å; W482-Y509 AromaticContact CH2-CD2 3.74Å; W482-Y509 HydrophobicContact CH2-CD2 3.74Å; W482-Y509 HydrophobicContact CH2-CE2 4.44Å; W482-Y509 AromaticContact CH2-CG 3.74Å; W482-Y509 HydrophobicContact CH2-CG 3.74Å; W482-Y509 HydrophobicContact CZ2-CD1 4.36Å; W482-Y509 AromaticContact CZ2-CD2 3.17Å; W482-Y509 HydrophobicContact CZ2-CD2 3.17Å; W482-Y509 AromaticContact CZ2-CE2 3.51Å; W482-Y509 HydrophobicContact CZ2-CE2 3.51Å; W482-Y509 AromaticContact CZ2-CG 3.62Å; W482-Y509 HydrophobicContact CZ2-CG 3.62Å; F495-Y509 CarbonylContact C-O 3.5Å; F495-Y509 WeakPolarHBondContact CA-O 3.07Å; I496-Y509 PolarHBondContact N-O 2.91Å; I496-Y509 PolarHBondContact O-N 2.91Å; Y509-T519 WeakPolarHBondContact CA-O 3.37Å; Y509-K520 HydrophobicContact CD1-CB 4.25Å; Y509-K520 HydrophobicContact CD1-CG 4.4Å; Y509-K520 HydrophobicContact CE1-CB 4.06Å; Y509-K520 HydrophobicContact CE1-CG 4.06Å
510	K	86.9	Confident	74.4	Confident	56 Å²	56	61.6 Å²	61.6	24%	0.243	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.7	171.1	171.1	172.4	146.1	172.7	0	109.1	Q493 I494 F495 T519 V521	Q493-K510 HydrophobicContact CB-CD 4.46Å; Q493-K510 HydrophobicContact CB-CG 4.34Å; Q493-K510 HydrophobicContact CG-CD 4.46Å; Q493-K510 VanDerWaalsContact OE1-CD 3.25Å; I494-K510 CarbonylContact O-C 3.54Å; I494-K510 WeakPolarHBondContact O-CA 3.42Å; F495-K510 HydrophobicContact CD1-CB 4.31Å; F495-K510 HydrophobicContact CE1-CB 4.13Å; F495-K510 HydrophobicContact CE1-CD 4.21Å; F495-K510 HydrophobicContact CE1-CG 4.42Å; F495-K510 HydrophobicContact CZ-CD 3.95Å; F495-K510 HydrophobicContact CZ-CG 4.33Å; K510-T519 PolarHBondContact N-O 2.84Å; K510-T519 PolarHBondContact O-N 2.76Å; K510-V521 HydrophobicContact CB-CG1 3.77Å; K510-V521 HydrophobicContact CD-CG1 4.46Å
511	F	86.2	Confident	75.1	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.4	176.1	-177.1	-107.2	0	0	0	109.7	F447 F449 V462 A476 I494 I496 Y516 W518	F447-F511 HydrophobicContact CD1-CE1 4.24Å; F447-F511 HydrophobicContact CE1-CE1 4.13Å; F449-F511 AromaticContact CE1-CD1 3.8Å; F449-F511 HydrophobicContact CE1-CD1 3.8Å; F449-F511 AromaticContact CE1-CE1 4Å; F449-F511 HydrophobicContact CE1-CE1 4Å; F449-F511 HydrophobicContact CE1-CG 4.06Å; F449-F511 HydrophobicContact CE1-CZ 4.43Å; F449-F511 AromaticContact CZ-CD1 3.74Å; F449-F511 HydrophobicContact CZ-CD1 3.74Å; F449-F511 HydrophobicContact CZ-CE1 4.05Å; F449-F511 HydrophobicContact CZ-CG 4.34Å; V462-F511 HydrophobicContact CG1-CZ 4.25Å; A476-F511 HydrophobicContact CB-CE2 4.22Å; A476-F511 HydrophobicContact CB-CZ 4.46Å; I494-F511 HydrophobicContact CB-CB 4.3Å; I494-F511 HydrophobicContact CD1-CD1 4.17Å; I494-F511 PolarHBondContact N-O 3.14Å; I494-F511 VanDerWaalsContact N-O 3.14Å; I494-F511 PolarHBondContact O-N 3.27Å; I496-F511 HydrophobicContact CD1-CB 3.88Å; F511-Y516 HydrophobicContact CE1-CD1 4.11Å; F511-Y516 AromaticContact CZ-CD1 3.66Å; F511-Y516 HydrophobicContact CZ-CD1 3.66Å; F511-Y516 HydrophobicContact CZ-CG 4.38Å; F511-W518 HydrophobicContact CB-CE3 3.92Å; F511-W518 HydrophobicContact CB-CH2 3.98Å; F511-W518 HydrophobicContact CB-CZ3 3.62Å; F511-W518 AromaticContact CD2-CD2 3.65Å; F511-W518 HydrophobicContact CD2-CD2 3.65Å; F511-W518 AromaticContact CD2-CE2 3.45Å; F511-W518 VanDerWaalsContact CD2-CE2 3.45Å; F511-W518 AromaticContact CD2-CE3 3.89Å; F511-W518 HydrophobicContact CD2-CE3 3.89Å; F511-W518 HydrophobicContact CD2-CG 4.3Å; F511-W518 AromaticContact CD2-CH2 3.72Å; F511-W518 HydrophobicContact CD2-CH2 3.72Å; F511-W518 AromaticContact CD2-CZ2 3.52Å; F511-W518 HydrophobicContact CD2-CZ2 3.52Å; F511-W518 AromaticContact CD2-CZ3 3.93Å; F511-W518 HydrophobicContact CD2-CZ3 3.93Å; F511-W518 HydrophobicContact CE2-CD2 4.39Å; F511-W518 AromaticContact CE2-CE2 3.81Å; F511-W518 HydrophobicContact CE2-CH2 4.43Å; F511-W518 AromaticContact CE2-CZ2 3.85Å; F511-W518 HydrophobicContact CE2-CZ2 3.85Å; F511-W518 HydrophobicContact CG-CE3 4.37Å; F511-W518 HydrophobicContact CG-CH2 4.02Å; F511-W518 HydrophobicContact CG-CZ2 4.26Å; F511-W518 HydrophobicContact CG-CZ3 4.11Å
512	N	84.6	Confident	75.4	Confident	48 Å²	48	59.6 Å²	59.6	26%	0.257	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	118.7	172.4	-171.7	-26	0	0	0	109.6	E514 T515 Y516 Q517	N512-E514 VanDerWaalsContact C-N 3.25Å; N512-E514 PolarHBondContact O-N 2.96Å; N512-E514 PolarHBondContact OD1-N 2.8Å; N512-T515 WeakPolarHBondContact CB-OG1 3.39Å; N512-T515 PolarHBondContact ND2-OG1 3.07Å; N512-Y516 VanDerWaalsContact O-CA 3.23Å; N512-Y516 WeakPolarHBondContact O-CA 3.43Å; N512-Y516 PolarHBondContact O-N 3.34Å; N512-Q517 PolarHBondContact N-O 2.94Å
513	S	82.3	Confident	76.5	Confident	7 Å²	7	55.2 Å²	55.2	5%	0.049	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-14.7	-178.3	53.6	0	0	0	0	114.6	N492 Y516	N492-S513 PolarHBondContact O-OG 2.68Å; S513-Y516 WeakPolarHBondContact O-CE1 3.35Å
514	E	81.4	Confident	77.4	Confident	131 Å²	131	46.8 Å²	46.8	61%	0.612	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-49.4	177.6	-74.6	173.1	170.3	0	0	112.7	K443 N512	K443-E514 HydrophobicContact CD-CG 4.32Å; K443-E514 VanDerWaalsContact NZ-CG 3.28Å; K443-E514 IonicContact NZ-OE1 3.71Å; K443-E514 PolarHBondContact NZ-OE1 3.21Å; K443-E514 IonicContact NZ-OE2 2.79Å; K443-E514 PolarHBondContact NZ-OE2 2.68Å; N512-E514 VanDerWaalsContact C-N 3.25Å; N512-E514 PolarHBondContact O-N 2.96Å; N512-E514 PolarHBondContact OD1-N 2.8Å
515	T	83.5	Confident	78.1	Confident	70 Å²	70	49.1 Å²	49.1	43%	0.429	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-11.3	-176.6	64	0	0	0	0	112.6	N512 Q517	N512-T515 WeakPolarHBondContact CB-OG1 3.39Å; N512-T515 PolarHBondContact ND2-OG1 3.07Å; T515-Q517 PolarHBondContact O-N 3Å
516	Y	84.6	Confident	78.5	Confident	79 Å²	79	50.1 Å²	50.1	31%	0.31	26%	0.262	S	S	.	.			trans	55.4	27.8	-173.9	-53.2	-56.9	0	0	0	113.7	F447 P475 F511 N512 S513	F447-Y516 HydrophobicContact CE1-CE1 4.15Å; P475-Y516 HydrophobicContact CB-CD1 3.7Å; P475-Y516 HydrophobicContact CB-CD2 3.81Å; P475-Y516 HydrophobicContact CB-CE1 3.69Å; P475-Y516 HydrophobicContact CB-CE2 3.81Å; P475-Y516 HydrophobicContact CB-CG 3.74Å; P475-Y516 HydrophobicContact CG-CD1 4.06Å; P475-Y516 HydrophobicContact CG-CE1 3.96Å; F511-Y516 HydrophobicContact CE1-CD1 4.11Å; F511-Y516 AromaticContact CZ-CD1 3.66Å; F511-Y516 HydrophobicContact CZ-CD1 3.66Å; F511-Y516 HydrophobicContact CZ-CG 4.38Å; N512-Y516 VanDerWaalsContact O-CA 3.23Å; N512-Y516 WeakPolarHBondContact O-CA 3.43Å; N512-Y516 PolarHBondContact O-N 3.34Å; S513-Y516 WeakPolarHBondContact O-CE1 3.35Å
517	Q	85.5	Confident	79	Confident	128 Å²	128	53.5 Å²	53.5	60%	0.598	27%	0.273	S	S	*	.			trans	-96.1	148	178.9	-69.2	178.6	-19	0	0	111.7	N512 T515	N512-Q517 PolarHBondContact N-O 2.94Å; T515-Q517 PolarHBondContact O-N 3Å
518	W	85.6	Confident	79.1	Confident	58 Å²	58	53.5 Å²	53.5	22%	0.22	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	135.7	177.6	-65.8	99.8	0	0	0	110.6	F449 V462 T477 P479 W482 I496 F511	F449-W518 AromaticContact CD1-CH2 3.8Å; F449-W518 HydrophobicContact CD1-CH2 3.8Å; F449-W518 HydrophobicContact CD1-CZ2 4.32Å; F449-W518 AromaticContact CE1-CH2 3.85Å; F449-W518 HydrophobicContact CE1-CH2 3.85Å; F449-W518 HydrophobicContact CE1-CZ2 4.32Å; V462-W518 HydrophobicContact CG2-CH2 4.48Å; V462-W518 HydrophobicContact CG2-CZ2 3.69Å; T477-W518 PolarHBondContact O-NE1 3.13Å; T477-W518 VanDerWaalsContact O-NE1 3.12Å; P479-W518 HydrophobicContact CG-CD2 4.25Å; P479-W518 HydrophobicContact CG-CE3 4.5Å; P479-W518 HydrophobicContact CG-CG 4.38Å; W482-W518 HydrophobicContact CE3-CH2 4.42Å; W482-W518 AromaticContact CH2-CE3 3.78Å; W482-W518 HydrophobicContact CH2-CE3 3.78Å; W482-W518 AromaticContact CH2-CH2 3.79Å; W482-W518 HydrophobicContact CH2-CH2 3.79Å; W482-W518 AromaticContact CH2-CZ3 3.32Å; W482-W518 HydrophobicContact CH2-CZ3 3.32Å; W482-W518 HydrophobicContact CZ3-CE3 4.2Å; W482-W518 AromaticContact CZ3-CH2 3.32Å; W482-W518 HydrophobicContact CZ3-CH2 3.32Å; W482-W518 HydrophobicContact CZ3-CZ2 4.14Å; W482-W518 AromaticContact CZ3-CZ3 3.32Å; W482-W518 HydrophobicContact CZ3-CZ3 3.32Å; I496-W518 HydrophobicContact CD1-CH2 3.85Å; I496-W518 HydrophobicContact CD1-CZ3 3.62Å; F511-W518 HydrophobicContact CB-CE3 3.92Å; F511-W518 HydrophobicContact CB-CH2 3.98Å; F511-W518 HydrophobicContact CB-CZ3 3.62Å; F511-W518 AromaticContact CD2-CD2 3.65Å; F511-W518 HydrophobicContact CD2-CD2 3.65Å; F511-W518 AromaticContact CD2-CE2 3.45Å; F511-W518 VanDerWaalsContact CD2-CE2 3.45Å; F511-W518 AromaticContact CD2-CE3 3.89Å; F511-W518 HydrophobicContact CD2-CE3 3.89Å; F511-W518 HydrophobicContact CD2-CG 4.3Å; F511-W518 AromaticContact CD2-CH2 3.72Å; F511-W518 HydrophobicContact CD2-CH2 3.72Å; F511-W518 AromaticContact CD2-CZ2 3.52Å; F511-W518 HydrophobicContact CD2-CZ2 3.52Å; F511-W518 AromaticContact CD2-CZ3 3.93Å; F511-W518 HydrophobicContact CD2-CZ3 3.93Å; F511-W518 HydrophobicContact CE2-CD2 4.39Å; F511-W518 AromaticContact CE2-CE2 3.81Å; F511-W518 HydrophobicContact CE2-CH2 4.43Å; F511-W518 AromaticContact CE2-CZ2 3.85Å; F511-W518 HydrophobicContact CE2-CZ2 3.85Å; F511-W518 HydrophobicContact CG-CE3 4.37Å; F511-W518 HydrophobicContact CG-CH2 4.02Å; F511-W518 HydrophobicContact CG-CZ2 4.26Å; F511-W518 HydrophobicContact CG-CZ3 4.11Å
519	T	86.3	Confident	78.7	Confident	77 Å²	77	54.8 Å²	54.8	47%	0.472	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.1	172.2	-48.6	0	0	0	0	108.5	Y509 K510	Y509-T519 WeakPolarHBondContact CA-O 3.37Å; K510-T519 PolarHBondContact N-O 2.84Å; K510-T519 PolarHBondContact O-N 2.76Å
520	K	81.9	Confident	78.2	Confident	107 Å²	107	54.9 Å²	54.9	47%	0.465	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.7	173.6	-164.2	-174.5	179	-158	0	108.7	Y509 D523	Y509-K520 HydrophobicContact CD1-CB 4.25Å; Y509-K520 HydrophobicContact CD1-CG 4.4Å; Y509-K520 HydrophobicContact CE1-CB 4.06Å; Y509-K520 HydrophobicContact CE1-CG 4.06Å; K520-D523 WeakPolarHBondContact CE-OD1 3.43Å; K520-D523 IonicContact NZ-OD1 3.92Å; K520-D523 PolarHBondContact NZ-OD1 3.18Å; K520-D523 IonicContact NZ-OD2 3.8Å; K520-D523 PolarHBondContact NZ-OD2 3.05Å
521	V	81.3	Confident	77.7	Confident	18 Å²	18	52.5 Å²	52.5	11%	0.109	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	175.8	174.3	-65.3	0	0	0	0	110	F495 A508 K510 D523	F495-V521 HydrophobicContact CD1-CG2 4.39Å; F495-V521 HydrophobicContact CE1-CG1 4.25Å; A508-V521 VanDerWaalsContact C-CG2 3.48Å; A508-V521 HydrophobicContact CB-CG2 3.53Å; A508-V521 VanDerWaalsContact O-CG2 3.32Å; A508-V521 WeakPolarHBondContact O-CG2 3.02Å; A508-V521 PolarHBondContact O-N 2.97Å; K510-V521 HydrophobicContact CB-CG1 3.77Å; K510-V521 HydrophobicContact CD-CG1 4.46Å; V521-D523 PolarHBondContact O-N 2.78Å
522	G	68.9	Low	77.4	Confident	23 Å²	23	55 Å²	55	24%	0.237	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-47.2	134.7	178.4	0	0	0	0	0	113	D563 W565	G522-D563 PolarHBondContact N-OD1 3.28Å; G522-W565 PolarHBondContact O-NE1 3.12Å
523	D	75.2	Confident	77.3	Confident	80 Å²	80	53.4 Å²	53.4	43%	0.428	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-66.3	139.8	-179	-69.3	-33.7	0	0	0	110.3	C506 K520 V521 W565	C506-D523 HydrophobicContact CB-CB 4.1Å; C506-D523 CarbonylContact O-C 3.56Å; C506-D523 WeakPolarHBondContact O-CA 3.28Å; K520-D523 WeakPolarHBondContact CE-OD1 3.43Å; K520-D523 IonicContact NZ-OD1 3.92Å; K520-D523 PolarHBondContact NZ-OD1 3.18Å; K520-D523 IonicContact NZ-OD2 3.8Å; K520-D523 PolarHBondContact NZ-OD2 3.05Å; V521-D523 PolarHBondContact O-N 2.78Å; D523-W565 VanDerWaalsContact O-CD1 3.26Å
524	V	68.3	Low	77.5	Confident	7 Å²	7	54 Å²	54	4%	0.042	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-62.7	144.8	178.2	-170.7	0	0	0	0	109.6	M497 C506 A508 A526 W565	M497-V524 HydrophobicContact CB-CG2 4.3Å; M497-V524 HydrophobicContact CE-CB 4.49Å; M497-V524 HydrophobicContact CE-CG1 4.22Å; M497-V524 HydrophobicContact CE-CG2 3.4Å; C506-V524 WeakPolarHBondContact O-CG2 3.31Å; C506-V524 PolarHBondContact O-N 3.31Å; A508-V524 HydrophobicContact CB-CG2 4Å; V524-A526 PolarHBondContact O-N 2.84Å; V524-W565 HydrophobicContact CG2-CZ2 4.29Å
525	T	67.5	Low	77.5	Confident	75 Å²	75	48.9 Å²	48.9	46%	0.46	26%	0.262	S	S	.	.	S	Bend	trans	-58.1	-24.5	-173.7	76.4	0	0	0	0	114.3	D556 W565	T525-D556 VanDerWaalsContact OG1-CG 3.29Å; T525-D556 PolarHBondContact OG1-OD1 2.79Å; T525-D556 PolarHBondContact OG1-OD2 2.97Å; T525-W565 HydrophobicContact CG2-CB 3.54Å
526	A	65.8	Low	77.2	Confident	27 Å²	27	45.9 Å²	45.9	22%	0.223	24%	0.244	C	C	.	.	S	Bend	trans	-141.2	147.7	179.9	0	0	0	0	0	111.7	V524 R528	V524-A526 PolarHBondContact O-N 2.84Å; A526-R528 WeakPolarHBondContact O-CG 3.41Å; A526-R528 PolarHBondContact O-N 2.83Å
527	K	70	Confident	76.4	Confident	101 Å²	101	43.5 Å²	43.5	44%	0.439	24%	0.244	S	C	.	.			trans	-62.8	121.6	170.3	-68.7	-176.3	-178.8	-177.4	0	109.5	A505 C506 F547 C552	A505-K527 HydrophobicContact CB-CB 3.8Å; A505-K527 HydrophobicContact CB-CD 4.3Å; A505-K527 HydrophobicContact CB-CG 3.95Å; A505-K527 WeakPolarHBondContact O-CA 3.28Å; C506-K527 WeakPolarHBondContact SG-CG 3.28Å; K527-F547 HydrophobicContact CB-CB 4.07Å; K527-F547 HydrophobicContact CB-CD1 4.16Å; K527-F547 HydrophobicContact CB-CD2 3.8Å; K527-F547 HydrophobicContact CB-CE2 4.31Å; K527-F547 HydrophobicContact CB-CG 3.72Å; K527-F547 HydrophobicContact CD-CD1 4.09Å; K527-F547 HydrophobicContact CD-CD2 4.24Å; K527-F547 HydrophobicContact CD-CE1 3.75Å; K527-F547 HydrophobicContact CD-CE2 3.91Å; K527-F547 HydrophobicContact CD-CG 4.33Å; K527-F547 HydrophobicContact CD-CZ 3.66Å; K527-C552 PolarHBondContact O-SG 2.83Å
528	R	72.1	Confident	75.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.008	23%	0.232	C	C	.	.			trans	-138.5	125.2	-176.2	-67.4	168.4	-167.3	-111.2	11.7	111.5	G498 G499 A505 A526 C531 G544 C552 T554 D556	G498-R528 CarbonylContact C-O 3.6Å; G498-R528 WeakPolarHBondContact CA-O 3.5Å; G499-R528 PolarHBondContact N-O 2.96Å; A505-R528 PolarHBondContact O-N 2.86Å; A526-R528 WeakPolarHBondContact O-CG 3.41Å; A526-R528 PolarHBondContact O-N 2.83Å; R528-C531 HydrophobicContact CB-CB 4.03Å; R528-G544 WeakPolarHBondContact CD-O 3.49Å; R528-G544 PolarHBondContact NH1-O 2.82Å; R528-C552 HydrophobicContact CG-CB 3.94Å; R528-C552 VanDerWaalsContact CG-SG 3.52Å; R528-T554 PolarHBondContact NH1-O 3.2Å; R528-T554 PolarHBondContact NH2-O 2.94Å; R528-T554 PolarHBondContact NH2-OG1 3.29Å; R528-D556 IonicContact CZ-OD2 3.72Å; R528-D556 IonicContact NE-OD2 3.96Å; R528-D556 IonicContact NH2-OD1 2.76Å; R528-D556 PolarHBondContact NH2-OD1 3.06Å; R528-D556 IonicContact NH2-OD2 2.96Å; R528-D556 PolarHBondContact NH2-OD2 3.36Å
529	M	71.8	Confident	75.5	Confident	29 Å²	29	41.5 Å²	41.5	14%	0.143	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-108.8	149	162.7	80	-156.2	-83.6	0	0	110	D500 C531 G545 Y546	D500-M529 HydrophobicContact CB-CE 4.29Å; M529-C531 PolarHBondContact O-N 3.21Å; M529-G545 CarbonylContact O-C 3.5Å; M529-G545 WeakPolarHBondContact O-CA 3.21Å; M529-Y546 HydrophobicContact CE-CD2 4.34Å; M529-Y546 HydrophobicContact CE-CE2 3.49Å; M529-Y546 VanDerWaalsContact CE-CE2 3.49Å; M529-Y546 HydrophobicContact CG-CD1 3.97Å; M529-Y546 HydrophobicContact CG-CD2 3.56Å; M529-Y546 HydrophobicContact CG-CE1 3.86Å; M529-Y546 HydrophobicContact CG-CE2 3.43Å; M529-Y546 VanDerWaalsContact CG-CE2 3.43Å; M529-Y546 HydrophobicContact CG-CG 3.82Å; M529-Y546 WeakPolarHBondContact CG-O 3.39Å; M529-Y546 PolarHBondContact N-O 3.04Å; M529-Y546 PolarHBondContact O-N 3.41Å; M529-Y546 HydrophobicContact SD-CD2 3.4Å; M529-Y546 WeakPolarHBondContact SD-CD2 3.2Å; M529-Y546 HydrophobicContact SD-CE2 3.16Å; M529-Y546 WeakPolarHBondContact SD-CE2 3.3Å; M529-Y546 HydrophobicContact SD-CG 4.25Å
530	S	72.9	Confident	75.4	Confident	30 Å²	30	37.8 Å²	37.8	21%	0.21	22%	0.215	C	C	.	.	S	Bend	trans	55.3	35.6	-177.3	-52	0	0	0	0	113.2	Y484 Y546	Y484-S530 WeakPolarHBondContact CB-OG 3.42Å; Y484-S530 WeakPolarHBondContact CD1-OG 3.35Å; Y484-S530 PolarHBondContact O-N 3.39Å; S530-Y546 WeakPolarHBondContact OG-CE1 3.45Å
531	C	75.6	Confident	75.4	Confident	5 Å²	5	33.4 Å²	33.4	3%	0.034	20%	0.196	C	C	.	.			trans	-77	164.7	169.8	53.9	0	0	0	0	110.7	A486 R528 M529 V542	A486-C531 WeakPolarHBondContact CB-O 3.16Å; R528-C531 HydrophobicContact CB-CB 4.03Å; M529-C531 PolarHBondContact O-N 3.21Å; C531-V542 HydrophobicContact CB-CG1 3.97Å
532	H	80.5	Confident	75.5	Confident	54 Å²	54	32.5 Å²	32.5	25%	0.25	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.8	172.4	-63.8	88.9	0	0	0	109.2	V542 V543 P577 T578 F580	H532-V542 WeakPolarHBondContact O-CA 3.13Å; H532-V543 HydrophobicContact CB-CG1 4.2Å; H532-V543 PolarHBondContact N-O 2.99Å; H532-V543 PolarHBondContact O-N 3.29Å; H532-P577 PolarHBondContact CE1-O 3.27Å; H532-P577 VanDerWaalsContact CE1-O 3.31Å; H532-P577 PolarHBondContact ND1-O 2.69Å; H532-T578 VanDerWaalsContact CE1-C 3.5Å; H532-T578 PolarHBondContact CE1-O 3.46Å; H532-T578 PolarHBondContact NE2-O 3.22Å; H532-F580 HydrophobicContact CB-CB 3.62Å
533	A	83.4	Confident	76	Confident	14 Å²	14	31.5 Å²	31.5	12%	0.116	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	142.3	-177.7	0	0	0	0	0	110	A486 A488 M497 Y541 V542	A486-A533 HydrophobicContact CB-CB 3.63Å; A488-A533 HydrophobicContact CB-CB 3.86Å; M497-A533 HydrophobicContact CG-CB 4.44Å; M497-A533 HydrophobicContact SD-CB 4.13Å; A533-Y541 CarbonylContact C-O 3.49Å; A533-Y541 VanDerWaalsContact CA-O 3.28Å; A533-Y541 WeakPolarHBondContact CA-O 3.48Å; A533-V542 HydrophobicContact CB-CG2 3.67Å
534	V	84.9	Confident	76.1	Confident	18 Å²	18	27.8 Å²	27.8	11%	0.109	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	148.2	173.5	80.6	0	0	0	0	110.3	L297 Y541 F580	L297-V534 HydrophobicContact CD2-CG1 3.49Å; L297-V534 VanDerWaalsContact CD2-CG1 3.49Å; V534-Y541 PolarHBondContact N-O 3.49Å; V534-Y541 PolarHBondContact O-N 2.97Å; V534-F580 HydrophobicContact CB-CD1 3.8Å; V534-F580 HydrophobicContact CB-CE1 4.07Å; V534-F580 HydrophobicContact CB-CG 4.42Å; V534-F580 HydrophobicContact CG1-CD1 3.41Å; V534-F580 VanDerWaalsContact CG1-CD1 3.41Å; V534-F580 HydrophobicContact CG1-CE1 3.17Å; V534-F580 HydrophobicContact CG1-CE2 4.33Å; V534-F580 HydrophobicContact CG1-CG 4.12Å; V534-F580 HydrophobicContact CG1-CZ 3.66Å
535	A	82.1	Confident	76.4	Confident	25 Å²	25	28 Å²	28	21%	0.207	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.5	171.3	0	0	0	0	0	110.5	V489 L490 K539 L540	V489-A535 WeakPolarHBondContact O-CB 3.12Å; L490-A535 HydrophobicContact CD1-CB 4Å; A535-K539 WeakPolarHBondContact CA-O 3.21Å; A535-L540 HydrophobicContact CB-CD2 3.72Å
536	S	78	Confident	76.5	Confident	7 Å²	7	28.7 Å²	28.7	5%	0.049	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	143.6	172.4	-175.3	0	0	0	0	109.6	H295 N538 K539 Y541	H295-S536 VanDerWaalsContact CB-OG 3.29Å; H295-S536 WeakPolarHBondContact CB-OG 3.34Å; S536-N538 VanDerWaalsContact C-N 3.29Å; S536-N538 PolarHBondContact O-N 3.03Å; S536-N538 VanDerWaalsContact O-N 3.15Å; S536-K539 PolarHBondContact N-O 2.79Å; S536-K539 CarbonylContact O-C 3.56Å; S536-K539 PolarHBondContact O-N 2.99Å; S536-Y541 WeakPolarHBondContact O-CE2 3.49Å
537	G	66.3	Low	76.7	Confident	29 Å²	29	31.8 Å²	31.8	30%	0.299	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	39	172.4	0	0	0	0	0	115.4	K292 K539	K292-G537 WeakPolarHBondContact O-CA 3.48Å; K292-G537 PolarHBondContact O-N 3.23Å; G537-K539 PolarHBondContact O-N 2.92Å; G537-K539 VanDerWaalsContact O-N 3.16Å
538	N	72.3	Confident	76.7	Confident	67 Å²	67	30 Å²	30	36%	0.358	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	16.6	-175.2	-152.8	35.8	0	0	0	115.7	S536 P560	S536-N538 VanDerWaalsContact C-N 3.29Å; S536-N538 PolarHBondContact O-N 3.03Å; S536-N538 VanDerWaalsContact O-N 3.15Å; N538-P560 WeakPolarHBondContact O-CD 3.45Å; N538-P560 WeakPolarHBondContact O-CG 3.2Å
539	K	80.3	Confident	76.3	Confident	76 Å²	76	37.9 Å²	37.9	33%	0.33	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	160	175.4	-60.4	-172	-173.5	-154.8	0	110.8	A535 S536 G537 Y541 D559	A535-K539 WeakPolarHBondContact CA-O 3.21Å; S536-K539 PolarHBondContact N-O 2.79Å; S536-K539 CarbonylContact O-C 3.56Å; S536-K539 PolarHBondContact O-N 2.99Å; G537-K539 PolarHBondContact O-N 2.92Å; G537-K539 VanDerWaalsContact O-N 3.16Å; K539-Y541 HydrophobicContact CB-CE2 3.94Å; K539-D559 WeakPolarHBondContact CE-OD2 3.48Å; K539-D559 IonicContact NZ-OD2 2.88Å; K539-D559 PolarHBondContact NZ-OD2 3.01Å
540	L	83.8	Confident	76	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.4	175.4	-73.1	170.9	0	0	0	109.6	A488 L490 F495 A535 C557 Y558 W565	A488-L540 HydrophobicContact CB-CD2 3.52Å; L490-L540 HydrophobicContact CB-CD1 4.37Å; L490-L540 HydrophobicContact CB-CD2 4.08Å; L490-L540 HydrophobicContact CB-CG 4.18Å; L490-L540 HydrophobicContact CD1-CG 4.44Å; L490-L540 HydrophobicContact CD2-CD1 4.26Å; L490-L540 HydrophobicContact CD2-CG 4.04Å; L490-L540 HydrophobicContact CG-CG 4.47Å; F495-L540 HydrophobicContact CB-CD1 3.58Å; F495-L540 HydrophobicContact CD1-CD1 3.67Å; F495-L540 HydrophobicContact CD2-CD1 3.57Å; F495-L540 HydrophobicContact CE1-CD1 4.18Å; F495-L540 HydrophobicContact CE2-CD1 4.11Å; F495-L540 HydrophobicContact CG-CD1 3.31Å; F495-L540 HydrophobicContact CZ-CD1 4.38Å; A535-L540 HydrophobicContact CB-CD2 3.72Å; L540-C557 CarbonylContact O-C 3.54Å; L540-C557 VanDerWaalsContact O-CA 3.22Å; L540-C557 WeakPolarHBondContact O-CA 3.06Å; L540-Y558 HydrophobicContact CB-CD1 4.4Å; L540-Y558 HydrophobicContact CD1-CD1 3.94Å; L540-Y558 HydrophobicContact CD1-CE1 4.5Å; L540-Y558 PolarHBondContact N-O 3.34Å; L540-Y558 VanDerWaalsContact N-O 3.16Å; L540-Y558 PolarHBondContact O-N 2.81Å; L540-W565 HydrophobicContact CB-CH2 4.47Å
541	Y	82.9	Confident	76	Confident	14 Å²	14	47.9 Å²	47.9	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.3	-180	-63	-95.4	0	0	0	109.5	L297 Q315 A533 V534 S536 K539 D556 C557 I568	L297-Y541 HydrophobicContact CD1-CD1 4.06Å; L297-Y541 HydrophobicContact CD1-CD2 3.97Å; L297-Y541 HydrophobicContact CD1-CE1 4.17Å; L297-Y541 HydrophobicContact CD1-CE2 4.12Å; L297-Y541 HydrophobicContact CD1-CG 3.95Å; Q315-Y541 PolarHBondContact NE2-OH 3.41Å; A533-Y541 CarbonylContact C-O 3.49Å; A533-Y541 VanDerWaalsContact CA-O 3.28Å; A533-Y541 WeakPolarHBondContact CA-O 3.48Å; V534-Y541 PolarHBondContact N-O 3.49Å; V534-Y541 PolarHBondContact O-N 2.97Å; S536-Y541 WeakPolarHBondContact O-CE2 3.49Å; K539-Y541 HydrophobicContact CB-CE2 3.94Å; Y541-D556 CarbonylContact C-O 3.56Å; Y541-D556 WeakPolarHBondContact CA-O 3.49Å; Y541-C557 HydrophobicContact CD1-CB 4.08Å; Y541-C557 HydrophobicContact CE1-CB 4.09Å; Y541-I568 HydrophobicContact CD1-CD1 3.89Å; Y541-I568 HydrophobicContact CE1-CD1 3.43Å; Y541-I568 VanDerWaalsContact CE1-CD1 3.43Å
542	V	82.1	Confident	75.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.5	177.7	174.9	0	0	0	0	111.1	M497 C531 H532 A533 L555 D556 W565	M497-V542 HydrophobicContact CE-CB 4.12Å; M497-V542 HydrophobicContact CE-CG1 4.29Å; M497-V542 HydrophobicContact CE-CG2 3.26Å; M497-V542 HydrophobicContact CG-CG2 4.3Å; M497-V542 HydrophobicContact SD-CG2 3.23Å; M497-V542 WeakPolarHBondContact SD-CG2 3.28Å; C531-V542 HydrophobicContact CB-CG1 3.97Å; H532-V542 WeakPolarHBondContact O-CA 3.13Å; A533-V542 HydrophobicContact CB-CG2 3.67Å; V542-L555 CarbonylContact O-C 3.57Å; V542-L555 WeakPolarHBondContact O-CA 3.4Å; V542-D556 PolarHBondContact N-O 2.8Å; V542-D556 PolarHBondContact O-N 2.66Å; V542-W565 HydrophobicContact CB-CZ3 4.31Å; V542-W565 HydrophobicContact CG2-CH2 4.06Å; V542-W565 HydrophobicContact CG2-CZ3 3.96Å
543	V	80.6	Confident	75.4	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.2	-173.2	71.8	0	0	0	0	111.3	L299 H532 L555 V571 P577 F580	L299-V543 HydrophobicContact CD1-CB 4.21Å; L299-V543 HydrophobicContact CD1-CG1 3.46Å; L299-V543 VanDerWaalsContact CD1-CG1 3.46Å; L299-V543 HydrophobicContact CD1-CG2 3.84Å; L299-V543 HydrophobicContact CD2-CG2 4.22Å; H532-V543 HydrophobicContact CB-CG1 4.2Å; H532-V543 PolarHBondContact N-O 2.99Å; H532-V543 PolarHBondContact O-N 3.29Å; V543-L555 HydrophobicContact CB-CD1 3.72Å; V543-L555 HydrophobicContact CG2-CD1 3.97Å; V543-V571 HydrophobicContact CG2-CG2 3.57Å; V543-P577 HydrophobicContact CG1-CB 4.28Å; V543-P577 HydrophobicContact CG1-CG 4.25Å; V543-P577 HydrophobicContact CG2-CG 4.41Å; V543-F580 HydrophobicContact CB-CD1 4.45Å; V543-F580 HydrophobicContact CG1-CB 3.86Å; V543-F580 HydrophobicContact CG1-CD1 3.71Å; V543-F580 HydrophobicContact CG1-CD2 4.18Å; V543-F580 HydrophobicContact CG1-CE1 4.22Å; V543-F580 HydrophobicContact CG1-CG 3.69Å
544	G	76.2	Confident	75	Confident	2 Å²	2	51.7 Å²	51.7	2%	0.021	28%	0.275	C	S	.	.			trans	66.9	-150.9	172.4	0	0	0	0	0	114.3	R528 C552	R528-G544 WeakPolarHBondContact CD-O 3.49Å; R528-G544 PolarHBondContact NH1-O 2.82Å; G544-C552 WeakPolarHBondContact CA-O 3.16Å; G544-C552 WeakPolarHBondContact O-CB 3.08Å
545	G	75.3	Confident	74.8	Confident	13 Å²	13	51 Å²	51	13%	0.134	27%	0.27	C	S	.	.			trans	94.6	171.3	-171.2	0	0	0	0	0	113.1	M529 C552	M529-G545 CarbonylContact O-C 3.5Å; M529-G545 WeakPolarHBondContact O-CA 3.21Å; G545-C552 PolarHBondContact O-N 3.29Å
546	Y	69.7	Low	74.8	Confident	89 Å²	89	49.8 Å²	49.8	35%	0.349	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	164.4	176.7	58.7	-82.3	0	0	0	111.2	M529 S530 Q550	M529-Y546 HydrophobicContact CE-CD2 4.34Å; M529-Y546 HydrophobicContact CE-CE2 3.49Å; M529-Y546 VanDerWaalsContact CE-CE2 3.49Å; M529-Y546 HydrophobicContact CG-CD1 3.97Å; M529-Y546 HydrophobicContact CG-CD2 3.56Å; M529-Y546 HydrophobicContact CG-CE1 3.86Å; M529-Y546 HydrophobicContact CG-CE2 3.43Å; M529-Y546 VanDerWaalsContact CG-CE2 3.43Å; M529-Y546 HydrophobicContact CG-CG 3.82Å; M529-Y546 WeakPolarHBondContact CG-O 3.39Å; M529-Y546 PolarHBondContact N-O 3.04Å; M529-Y546 PolarHBondContact O-N 3.41Å; M529-Y546 HydrophobicContact SD-CD2 3.4Å; M529-Y546 WeakPolarHBondContact SD-CD2 3.2Å; M529-Y546 HydrophobicContact SD-CE2 3.16Å; M529-Y546 WeakPolarHBondContact SD-CE2 3.3Å; M529-Y546 HydrophobicContact SD-CG 4.25Å; S530-Y546 WeakPolarHBondContact OG-CE1 3.45Å; Y546-Q550 CarbonylContact C-O 3.34Å; Y546-Q550 WeakPolarHBondContact CA-O 3.29Å
547	F	70.6	Confident	75.1	Confident	92 Å²	92	49.9 Å²	49.9	40%	0.404	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	110	169.2	-177.2	-101.8	0	0	0	108.2	A505 K527 I549 Q550	A505-F547 HydrophobicContact CB-CD2 4.03Å; A505-F547 HydrophobicContact CB-CE2 3.98Å; K527-F547 HydrophobicContact CB-CB 4.07Å; K527-F547 HydrophobicContact CB-CD1 4.16Å; K527-F547 HydrophobicContact CB-CD2 3.8Å; K527-F547 HydrophobicContact CB-CE2 4.31Å; K527-F547 HydrophobicContact CB-CG 3.72Å; K527-F547 HydrophobicContact CD-CD1 4.09Å; K527-F547 HydrophobicContact CD-CD2 4.24Å; K527-F547 HydrophobicContact CD-CE1 3.75Å; K527-F547 HydrophobicContact CD-CE2 3.91Å; K527-F547 HydrophobicContact CD-CG 4.33Å; K527-F547 HydrophobicContact CD-CZ 3.66Å; F547-I549 PolarHBondContact O-N 3.36Å; F547-Q550 PolarHBondContact N-O 2.75Å; F547-Q550 PolarHBondContact O-N 3.31Å; F547-Q550 VanDerWaalsContact O-N 3.09Å
548	G	69.2	Low	75.8	Confident	64 Å²	64	48.9 Å²	48.9	66%	0.66	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	-119.6	-169.5	0	0	0	0	0	111.6
549	I	64.4	Low	76.1	Confident	167 Å²	167	46.8 Å²	46.8	86%	0.856	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-17.1	179.6	-53.9	169.6	0	0	0	111.3	F547	F547-I549 PolarHBondContact O-N 3.36Å
550	Q	65.7	Low	75.8	Confident	152 Å²	152	45.2 Å²	45.2	71%	0.71	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84	134.8	-177.3	-67.8	-173.6	-8.9	0	0	111.1	Y546 F547	Y546-Q550 CarbonylContact C-O 3.34Å; Y546-Q550 WeakPolarHBondContact CA-O 3.29Å; F547-Q550 PolarHBondContact N-O 2.75Å; F547-Q550 PolarHBondContact O-N 3.31Å; F547-Q550 VanDerWaalsContact O-N 3.09Å
551	R	71.7	Confident	75.4	Confident	116 Å²	116	49.9 Å²	49.9	44%	0.438	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.2	176.3	-63.2	-176.1	178.9	95.3	1.1	109.5	K553	R551-K553 PolarHBondContact O-N 2.87Å
552	C	71	Confident	75	Confident	23 Å²	23	55 Å²	55	16%	0.155	29%	0.291	C	S	.	.			trans	-81.1	118.6	178.6	-64.5	0	0	0	0	109.3	K527 R528 G544 G545	K527-C552 PolarHBondContact O-SG 2.83Å; R528-C552 HydrophobicContact CG-CB 3.94Å; R528-C552 VanDerWaalsContact CG-SG 3.52Å; G544-C552 WeakPolarHBondContact CA-O 3.16Å; G544-C552 WeakPolarHBondContact O-CB 3.08Å; G545-C552 PolarHBondContact O-N 3.29Å
553	K	72.9	Confident	74.8	Confident	95 Å²	95	58.7 Å²	58.7	41%	0.413	31%	0.311	S	S	.	.			trans	-103.6	12.1	-176.7	-49.2	-175.1	-155	-172.5	0	112.5	R551 T570 V571 Y573	R551-K553 PolarHBondContact O-N 2.87Å; K553-T570 CarbonylContact O-C 3.6Å; K553-T570 WeakPolarHBondContact O-CA 3.38Å; K553-V571 PolarHBondContact O-N 2.88Å; K553-Y573 HydrophobicContact CD-CD2 3.75Å; K553-Y573 HydrophobicContact CD-CE2 4.49Å; K553-Y573 VanDerWaalsContact CE-CE2 3.48Å; K553-Y573 HydrophobicContact CG-CD2 4.48Å
554	T	75.1	Confident	74.7	Confident	35 Å²	35	61.9 Å²	61.9	22%	0.215	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	140	-174.2	46.8	0	0	0	0	110.4	R528 D556 T570	R528-T554 PolarHBondContact NH1-O 3.2Å; R528-T554 PolarHBondContact NH2-O 2.94Å; R528-T554 PolarHBondContact NH2-OG1 3.29Å; T554-D556 WeakPolarHBondContact CB-OD1 3.43Å; T554-D556 PolarHBondContact OG1-OD1 2.78Å; T554-T570 HydrophobicContact CG2-CG2 4.29Å
555	L	80.7	Confident	74.9	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.016	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	107.4	162.7	177.7	70.5	0	0	0	107	V313 V542 V543 I568 T569 F580	V313-L555 HydrophobicContact CG1-CD2 3.71Å; V542-L555 CarbonylContact O-C 3.57Å; V542-L555 WeakPolarHBondContact O-CA 3.4Å; V543-L555 HydrophobicContact CB-CD1 3.72Å; V543-L555 HydrophobicContact CG2-CD1 3.97Å; L555-I568 PolarHBondContact O-N 3.13Å; L555-T569 HydrophobicContact CB-CG2 3.88Å; L555-T569 HydrophobicContact CD2-CG2 3.85Å; L555-T569 HydrophobicContact CG-CG2 4.5Å; L555-T569 PolarHBondContact N-O 2.9Å; L555-F580 HydrophobicContact CD1-CE1 4.28Å; L555-F580 HydrophobicContact CD1-CZ 4.1Å
556	D	81.6	Confident	75.1	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	146.6	178.2	-62.8	-5	0	0	0	109.9	T525 R528 Y541 V542 T554 W565 N566	T525-D556 VanDerWaalsContact OG1-CG 3.29Å; T525-D556 PolarHBondContact OG1-OD1 2.79Å; T525-D556 PolarHBondContact OG1-OD2 2.97Å; R528-D556 IonicContact CZ-OD2 3.72Å; R528-D556 IonicContact NE-OD2 3.96Å; R528-D556 IonicContact NH2-OD1 2.76Å; R528-D556 PolarHBondContact NH2-OD1 3.06Å; R528-D556 IonicContact NH2-OD2 2.96Å; R528-D556 PolarHBondContact NH2-OD2 3.36Å; Y541-D556 CarbonylContact C-O 3.56Å; Y541-D556 WeakPolarHBondContact CA-O 3.49Å; V542-D556 PolarHBondContact N-O 2.8Å; V542-D556 PolarHBondContact O-N 2.66Å; T554-D556 WeakPolarHBondContact CB-OD1 3.43Å; T554-D556 PolarHBondContact OG1-OD1 2.78Å; D556-W565 HydrophobicContact CB-CE3 3.93Å; D556-W565 HydrophobicContact CB-CZ3 4.4Å; D556-N566 CarbonylContact C-O 3.49Å; D556-N566 WeakPolarHBondContact CA-O 3.31Å
557	C	84.8	Confident	75.5	Confident	9 Å²	9	65.3 Å²	65.3	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	129.5	174.9	175.6	0	0	0	0	109.9	L540 Y541 N566 I568	L540-C557 CarbonylContact O-C 3.54Å; L540-C557 VanDerWaalsContact O-CA 3.22Å; L540-C557 WeakPolarHBondContact O-CA 3.06Å; Y541-C557 HydrophobicContact CD1-CB 4.08Å; Y541-C557 HydrophobicContact CE1-CB 4.09Å; C557-N566 PolarHBondContact N-O 3.48Å; C557-N566 PolarHBondContact O-N 3.17Å; C557-I568 HydrophobicContact CB-CD1 3.23Å; C557-I568 HydrophobicContact CB-CG1 3.6Å
558	Y	81.6	Confident	75.8	Confident	8 Å²	8	63.2 Å²	63.2	3%	0.031	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.6	173.4	173.7	-103.2	0	0	0	110.5	F495 L540 P560 D563 W565	F495-Y558 HydrophobicContact CD1-CE1 4.37Å; F495-Y558 AromaticContact CE1-CE1 3.73Å; F495-Y558 HydrophobicContact CE1-CE1 3.73Å; F495-Y558 HydrophobicContact CZ-CE1 4.29Å; L540-Y558 HydrophobicContact CB-CD1 4.4Å; L540-Y558 HydrophobicContact CD1-CD1 3.94Å; L540-Y558 HydrophobicContact CD1-CE1 4.5Å; L540-Y558 PolarHBondContact N-O 3.34Å; L540-Y558 VanDerWaalsContact N-O 3.16Å; L540-Y558 PolarHBondContact O-N 2.81Å; Y558-P560 HydrophobicContact CE1-CB 3.99Å; Y558-D563 VanDerWaalsContact CE2-OD1 3.27Å; Y558-D563 WeakPolarHBondContact CE2-OD1 3.29Å; Y558-D563 VanDerWaalsContact CZ-OD1 3.3Å; Y558-D563 PolarHBondContact OH-OD1 3.15Å; Y558-W565 VanDerWaalsContact CB-CZ2 3.44Å; Y558-W565 HydrophobicContact CD1-CZ2 4.44Å; Y558-W565 AromaticContact CD2-CD1 3.74Å; Y558-W565 AromaticContact CD2-CD2 3.89Å; Y558-W565 HydrophobicContact CD2-CD2 3.89Å; Y558-W565 AromaticContact CD2-CE2 3.46Å; Y558-W565 VanDerWaalsContact CD2-CE2 3.46Å; Y558-W565 AromaticContact CD2-CG 4Å; Y558-W565 HydrophobicContact CD2-CG 4Å; Y558-W565 AromaticContact CD2-CZ2 3.82Å; Y558-W565 HydrophobicContact CD2-CZ2 3.82Å; Y558-W565 AromaticContact CD2-NE1 3.43Å; Y558-W565 AromaticContact CE2-NE1 3.94Å; Y558-W565 HydrophobicContact CG-CD2 4.17Å; Y558-W565 AromaticContact CG-CE2 3.77Å; Y558-W565 AromaticContact CG-CH2 4Å; Y558-W565 HydrophobicContact CG-CH2 4Å; Y558-W565 AromaticContact CG-CZ2 3.68Å; Y558-W565 HydrophobicContact CG-CZ2 3.68Å; Y558-W565 HydrophobicContact CG-CZ3 4.47Å
559	D	78.7	Confident	75.9	Confident	23 Å²	23	61.6 Å²	61.6	12%	0.123	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	110	172.4	-158.8	-46.7	0	0	0	109	K539 T561 L562 D563 V564	K539-D559 WeakPolarHBondContact CE-OD2 3.48Å; K539-D559 IonicContact NZ-OD2 2.88Å; K539-D559 PolarHBondContact NZ-OD2 3.01Å; D559-T561 PolarHBondContact O-N 3.05Å; D559-T561 WeakPolarHBondContact OD1-CB 3.22Å; D559-T561 PolarHBondContact OD1-N 3.4Å; D559-T561 VanDerWaalsContact OD1-N 3.09Å; D559-T561 PolarHBondContact OD1-OG1 3.22Å; D559-L562 PolarHBondContact O-N 2.84Å; D559-D563 PolarHBondContact O-N 3.31Å; D559-V564 PolarHBondContact N-O 3.44Å; D559-V564 PolarHBondContact O-N 2.75Å
560	P	73.4	Confident	76.2	Confident	43 Å²	43	58.2 Å²	58.2	28%	0.279	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-19.2	-178.1	32.5	-40.6	0	0	0	112.9	L490 N538 Y558	L490-P560 HydrophobicContact CD2-CB 3.87Å; L490-P560 HydrophobicContact CD2-CG 3.64Å; N538-P560 WeakPolarHBondContact O-CD 3.45Å; N538-P560 WeakPolarHBondContact O-CG 3.2Å; Y558-P560 HydrophobicContact CE1-CB 3.99Å
561	T	74.8	Confident	76.4	Confident	98 Å²	98	51.3 Å²	51.3	60%	0.601	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-31.6	-178.7	65.8	0	0	0	0	112	D559	D559-T561 PolarHBondContact O-N 3.05Å; D559-T561 WeakPolarHBondContact OD1-CB 3.22Å; D559-T561 PolarHBondContact OD1-N 3.4Å; D559-T561 VanDerWaalsContact OD1-N 3.09Å; D559-T561 PolarHBondContact OD1-OG1 3.22Å
562	L	74.7	Confident	76	Confident	121 Å²	121	48.9 Å²	48.9	63%	0.634	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-13.4	179.6	-60.4	176.2	0	0	0	112.5	D559 V564	D559-L562 PolarHBondContact O-N 2.84Å; L562-V564 VanDerWaalsContact C-N 3.26Å; L562-V564 HydrophobicContact CB-CB 4.4Å; L562-V564 HydrophobicContact CB-CG2 4.35Å; L562-V564 WeakPolarHBondContact O-CG2 3.41Å; L562-V564 PolarHBondContact O-N 3.35Å
563	D	78.7	Confident	75.2	Confident	79 Å²	79	55.3 Å²	55.3	42%	0.422	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	38.6	-171	-164.9	29.3	0	0	0	112.9	G522 Y558 D559	G522-D563 PolarHBondContact N-OD1 3.28Å; Y558-D563 VanDerWaalsContact CE2-OD1 3.27Å; Y558-D563 WeakPolarHBondContact CE2-OD1 3.29Å; Y558-D563 VanDerWaalsContact CZ-OD1 3.3Å; Y558-D563 PolarHBondContact OH-OD1 3.15Å; D559-D563 PolarHBondContact O-N 3.31Å
564	V	78.5	Confident	74.2	Confident	68 Å²	68	52.8 Å²	52.8	41%	0.412	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.5	-176.6	176.7	0	0	0	0	111.5	D559 L562	D559-V564 PolarHBondContact N-O 3.44Å; D559-V564 PolarHBondContact O-N 2.75Å; L562-V564 VanDerWaalsContact C-N 3.26Å; L562-V564 HydrophobicContact CB-CB 4.4Å; L562-V564 HydrophobicContact CB-CG2 4.35Å; L562-V564 WeakPolarHBondContact O-CG2 3.41Å; L562-V564 PolarHBondContact O-N 3.35Å
565	W	79.3	Confident	73.4	Confident	19 Å²	19	51.7 Å²	51.7	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128.6	169.8	-69.5	90.7	0	0	0	111.3	M497 A508 G522 D523 V524 T525 L540 V542 D556 Y558	M497-W565 HydrophobicContact CE-CE3 4.48Å; M497-W565 HydrophobicContact CE-CH2 2.96Å; M497-W565 HydrophobicContact CE-CZ2 3.27Å; M497-W565 HydrophobicContact CE-CZ3 3.62Å; M497-W565 HydrophobicContact SD-CH2 3.63Å; M497-W565 HydrophobicContact SD-CZ2 4.1Å; A508-W565 HydrophobicContact CB-CZ2 4.36Å; G522-W565 PolarHBondContact O-NE1 3.12Å; D523-W565 VanDerWaalsContact O-CD1 3.26Å; V524-W565 HydrophobicContact CG2-CZ2 4.29Å; T525-W565 HydrophobicContact CG2-CB 3.54Å; L540-W565 HydrophobicContact CB-CH2 4.47Å; V542-W565 HydrophobicContact CB-CZ3 4.31Å; V542-W565 HydrophobicContact CG2-CH2 4.06Å; V542-W565 HydrophobicContact CG2-CZ3 3.96Å; D556-W565 HydrophobicContact CB-CE3 3.93Å; D556-W565 HydrophobicContact CB-CZ3 4.4Å; Y558-W565 VanDerWaalsContact CB-CZ2 3.44Å; Y558-W565 HydrophobicContact CD1-CZ2 4.44Å; Y558-W565 AromaticContact CD2-CD1 3.74Å; Y558-W565 AromaticContact CD2-CD2 3.89Å; Y558-W565 HydrophobicContact CD2-CD2 3.89Å; Y558-W565 AromaticContact CD2-CE2 3.46Å; Y558-W565 VanDerWaalsContact CD2-CE2 3.46Å; Y558-W565 AromaticContact CD2-CG 4Å; Y558-W565 HydrophobicContact CD2-CG 4Å; Y558-W565 AromaticContact CD2-CZ2 3.82Å; Y558-W565 HydrophobicContact CD2-CZ2 3.82Å; Y558-W565 AromaticContact CD2-NE1 3.43Å; Y558-W565 AromaticContact CE2-NE1 3.94Å; Y558-W565 HydrophobicContact CG-CD2 4.17Å; Y558-W565 AromaticContact CG-CE2 3.77Å; Y558-W565 AromaticContact CG-CH2 4Å; Y558-W565 HydrophobicContact CG-CH2 4Å; Y558-W565 AromaticContact CG-CZ2 3.68Å; Y558-W565 HydrophobicContact CG-CZ2 3.68Å; Y558-W565 HydrophobicContact CG-CZ3 4.47Å
566	N	80.3	Confident	72.5	Confident	89 Å²	89	53.5 Å²	53.5	48%	0.476	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.7	176.8	-69.1	-44.9	0	0	0	110.9	D556 C557 I568	D556-N566 CarbonylContact C-O 3.49Å; D556-N566 WeakPolarHBondContact CA-O 3.31Å; C557-N566 PolarHBondContact N-O 3.48Å; C557-N566 PolarHBondContact O-N 3.17Å; N566-I568 PolarHBondContact O-N 3.43Å
567	S	78.3	Confident	71.6	Confident	68 Å²	68	54.1 Å²	54.1	48%	0.476	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	118.7	172.6	175.6	0	0	0	0	109.9
568	I	75.5	Confident	70.8	Confident	48 Å²	48	54.6 Å²	54.6	25%	0.246	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-53.4	-179.9	-65.4	-175.9	0	0	0	111	K318 Y541 L555 C557 N566	K318-I568 HydrophobicContact CB-CG2 4.29Å; K318-I568 HydrophobicContact CD-CG2 4.14Å; K318-I568 HydrophobicContact CG-CG2 3.93Å; Y541-I568 HydrophobicContact CD1-CD1 3.89Å; Y541-I568 HydrophobicContact CE1-CD1 3.43Å; Y541-I568 VanDerWaalsContact CE1-CD1 3.43Å; L555-I568 PolarHBondContact O-N 3.13Å; C557-I568 HydrophobicContact CB-CD1 3.23Å; C557-I568 HydrophobicContact CB-CG1 3.6Å; N566-I568 PolarHBondContact O-N 3.43Å
569	T	72.9	Confident	70.3	Confident	29 Å²	29	54.4 Å²	54.4	18%	0.178	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	168.8	-173	-167.2	0	0	0	0	111	K318 L555	K318-T569 WeakPolarHBondContact O-CB 3.32Å; K318-T569 PolarHBondContact O-OG1 2.77Å; L555-T569 HydrophobicContact CB-CG2 3.88Å; L555-T569 HydrophobicContact CD2-CG2 3.85Å; L555-T569 HydrophobicContact CG-CG2 4.5Å; L555-T569 PolarHBondContact N-O 2.9Å
570	T	70.8	Confident	70.3	Confident	97 Å²	97	54 Å²	54	60%	0.595	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.1	174.7	56.4	0	0	0	0	111.8	K553 T554	K553-T570 CarbonylContact O-C 3.6Å; K553-T570 WeakPolarHBondContact O-CA 3.38Å; T554-T570 HydrophobicContact CG2-CG2 4.29Å
571	V	69.7	Low	70.6	Confident	6 Å²	6	52.2 Å²	52.2	4%	0.036	29%	0.29	C	S	.	.			trans	-73.1	132.7	170.6	-170.8	0	0	0	0	109.5	L299 I320 V543 K553 L575	L299-V571 HydrophobicContact CD2-CG1 4.24Å; I320-V571 HydrophobicContact CD1-CB 4.23Å; I320-V571 HydrophobicContact CD1-CG1 4.19Å; I320-V571 HydrophobicContact CD1-CG2 3.97Å; V543-V571 HydrophobicContact CG2-CG2 3.57Å; K553-V571 PolarHBondContact O-N 2.88Å; V571-L575 HydrophobicContact CG1-CB 3.87Å; V571-L575 HydrophobicContact CG1-CD1 4.39Å; V571-L575 HydrophobicContact CG1-CD2 3.9Å; V571-L575 HydrophobicContact CG1-CG 4.29Å
572	P	62.9	Low	70.8	Confident	66 Å²	66	48.5 Å²	48.5	43%	0.429	27%	0.268	S	S	.	.			trans	-54.2	140.3	176.7	-24.7	32.5	0	0	0	111.9	S574 L575	P572-S574 PolarHBondContact O-N 2.93Å; P572-L575 PolarHBondContact O-N 3.17Å
573	Y	53.1	Low	70.7	Confident	157 Å²	157	42.8 Å²	42.8	62%	0.616	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.4	-171.4	-171.9	-119.6	0	0	0	115.1	K553	K553-Y573 HydrophobicContact CD-CD2 3.75Å; K553-Y573 HydrophobicContact CD-CE2 4.49Å; K553-Y573 VanDerWaalsContact CE-CE2 3.48Å; K553-Y573 HydrophobicContact CG-CD2 4.48Å
574	S	52.2	Low	70.1	Confident	43 Å²	43	41.1 Å²	41.1	30%	0.301	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-31.3	175.4	42.2	0	0	0	0	112.8	Q303 P572 I576	Q303-S574 CarbonylContact C-O 3.1Å; Q303-S574 WeakPolarHBondContact CA-O 3.25Å; Q303-S574 VanDerWaalsContact O-O 3.08Å; P572-S574 PolarHBondContact O-N 2.93Å; S574-I576 PolarHBondContact O-N 3.01Å
575	L	57.9	Low	69.3	Low	11 Å²	11	41.2 Å²	41.2	6%	0.058	22%	0.221	C	C	.	.			trans	-90.4	103.5	-160.6	-160.5	163.4	0	0	0	110.9	L299 G302 Y311 I320 V571 P572 P577	L299-L575 HydrophobicContact CD2-CD1 4.35Å; L299-L575 HydrophobicContact CD2-CD2 3.39Å; L299-L575 HydrophobicContact CG-CD2 3.94Å; G302-L575 WeakPolarHBondContact O-CA 3.4Å; Y311-L575 HydrophobicContact CD1-CD1 3.8Å; Y311-L575 HydrophobicContact CD2-CD1 3.51Å; Y311-L575 HydrophobicContact CD2-CD2 4.49Å; Y311-L575 HydrophobicContact CD2-CG 4.19Å; Y311-L575 HydrophobicContact CE1-CD1 3.59Å; Y311-L575 HydrophobicContact CE2-CD1 3.28Å; Y311-L575 HydrophobicContact CE2-CD2 4.46Å; Y311-L575 HydrophobicContact CE2-CG 3.76Å; Y311-L575 HydrophobicContact CG-CD1 3.76Å; I320-L575 HydrophobicContact CG2-CD1 4.48Å; V571-L575 HydrophobicContact CG1-CB 3.87Å; V571-L575 HydrophobicContact CG1-CD1 4.39Å; V571-L575 HydrophobicContact CG1-CD2 3.9Å; V571-L575 HydrophobicContact CG1-CG 4.29Å; P572-L575 PolarHBondContact O-N 3.17Å; L575-P577 HydrophobicContact CD2-CB 4.5Å; L575-P577 WeakPolarHBondContact O-CD 3.37Å
576	I	63	Low	68.1	Low	42 Å²	42	43.1 Å²	43.1	22%	0.215	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.6	173	-57.9	177.2	0	0	0	107.5	G301 G302 F305 S574 T578	G301-I576 VanDerWaalsContact CA-O 3.29Å; G301-I576 WeakPolarHBondContact CA-O 3.1Å; G302-I576 PolarHBondContact N-O 3.31Å; G302-I576 PolarHBondContact O-N 3.49Å; F305-I576 HydrophobicContact CD1-CD1 4.23Å; F305-I576 HydrophobicContact CE1-CD1 4.43Å; F305-I576 HydrophobicContact CG-CD1 4.33Å; S574-I576 PolarHBondContact O-N 3.01Å; I576-T578 PolarHBondContact O-N 2.91Å
577	P	63.3	Low	66.4	Low	12 Å²	12	40.8 Å²	40.8	8%	0.078	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	128.7	-178.9	30.7	-34.3	0	0	0	110.3	L299 L300 H532 V543 L575	L299-P577 HydrophobicContact CD1-CB 3.44Å; L299-P577 VanDerWaalsContact CD1-CB 3.44Å; L299-P577 HydrophobicContact CD1-CG 4.38Å; L299-P577 HydrophobicContact CG-CB 4.06Å; L300-P577 WeakPolarHBondContact O-CA 3.45Å; H532-P577 PolarHBondContact CE1-O 3.27Å; H532-P577 VanDerWaalsContact CE1-O 3.31Å; H532-P577 PolarHBondContact ND1-O 2.69Å; V543-P577 HydrophobicContact CG1-CB 4.28Å; V543-P577 HydrophobicContact CG1-CG 4.25Å; V543-P577 HydrophobicContact CG2-CG 4.41Å; L575-P577 HydrophobicContact CD2-CB 4.5Å; L575-P577 WeakPolarHBondContact O-CD 3.37Å
578	T	66.9	Low	64.5	Low	19 Å²	19	42.3 Å²	42.3	12%	0.117	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-20.6	178.3	47.5	0	0	0	0	112.1	L300 C307 F333 H532 I576	L300-T578 PolarHBondContact O-N 2.69Å; L300-T578 PolarHBondContact O-OG1 3.01Å; L300-T578 VanDerWaalsContact O-OG1 3.04Å; C307-T578 HydrophobicContact CB-CG2 4.12Å; C307-T578 VanDerWaalsContact CB-OG1 3.31Å; C307-T578 WeakPolarHBondContact CB-OG1 3.4Å; C307-T578 PolarHBondContact SG-OG1 3.15Å; C307-T578 VanDerWaalsContact SG-OG1 3.35Å; F333-T578 HydrophobicContact CE1-CG2 4.32Å; F333-T578 WeakPolarHBondContact CE1-OG1 3.34Å; F333-T578 WeakPolarHBondContact CZ-OG1 3.49Å; H532-T578 VanDerWaalsContact CE1-C 3.5Å; H532-T578 PolarHBondContact CE1-O 3.46Å; H532-T578 PolarHBondContact NE2-O 3.22Å; I576-T578 PolarHBondContact O-N 2.91Å
579	A	71.8	Confident	62.5	Low	4 Å²	4	45.9 Å²	45.9	3%	0.033	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	156.9	166.8	0	0	0	0	0	110.6	L300 F333 A335	L300-A579 HydrophobicContact CB-CB 4.33Å; L300-A579 HydrophobicContact CD1-CB 3.96Å; L300-A579 PolarHBondContact N-O 3.46Å; L300-A579 PolarHBondContact O-N 3.09Å; F333-A579 HydrophobicContact CE2-CB 4.08Å; A335-A579 HydrophobicContact CB-CB 3.51Å
580	F	78	Confident	62	Low	14 Å²	14	46.7 Å²	46.7	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	122.2	176.7	-172.4	-143.2	0	0	0	108.8	L297 F298 L299 V313 H532 V534 V543 L555	L297-F580 HydrophobicContact CB-CE2 4.07Å; L297-F580 HydrophobicContact CB-CZ 4.26Å; L297-F580 HydrophobicContact CD1-CZ 4.17Å; L297-F580 HydrophobicContact CD2-CE2 4.48Å; L297-F580 HydrophobicContact CD2-CZ 4.16Å; L297-F580 HydrophobicContact CG-CZ 4.44Å; F298-F580 VanDerWaalsContact O-CD2 3.28Å; F298-F580 WeakPolarHBondContact O-CD2 3.35Å; L299-F580 HydrophobicContact CB-CD2 4.37Å; L299-F580 HydrophobicContact CD1-CB 4.35Å; L299-F580 HydrophobicContact CD1-CD2 3.76Å; L299-F580 HydrophobicContact CD1-CE2 4.4Å; L299-F580 HydrophobicContact CD1-CG 4.27Å; V313-F580 HydrophobicContact CG2-CE2 4.27Å; H532-F580 HydrophobicContact CB-CB 3.62Å; V534-F580 HydrophobicContact CB-CD1 3.8Å; V534-F580 HydrophobicContact CB-CE1 4.07Å; V534-F580 HydrophobicContact CB-CG 4.42Å; V534-F580 HydrophobicContact CG1-CD1 3.41Å; V534-F580 VanDerWaalsContact CG1-CD1 3.41Å; V534-F580 HydrophobicContact CG1-CE1 3.17Å; V534-F580 HydrophobicContact CG1-CE2 4.33Å; V534-F580 HydrophobicContact CG1-CG 4.12Å; V534-F580 HydrophobicContact CG1-CZ 3.66Å; V543-F580 HydrophobicContact CB-CD1 4.45Å; V543-F580 HydrophobicContact CG1-CB 3.86Å; V543-F580 HydrophobicContact CG1-CD1 3.71Å; V543-F580 HydrophobicContact CG1-CD2 4.18Å; V543-F580 HydrophobicContact CG1-CE1 4.22Å; V543-F580 HydrophobicContact CG1-CG 3.69Å; L555-F580 HydrophobicContact CD1-CE1 4.28Å; L555-F580 HydrophobicContact CD1-CZ 4.1Å
581	V	80.6	Confident	61.5	Low	6 Å²	6	44.1 Å²	44.1	4%	0.036	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	148.2	-172.1	-60.5	0	0	0	0	111.1	F298 L300 A335 A337 V342 T583	F298-V581 HydrophobicContact CB-CG2 3.78Å; F298-V581 PolarHBondContact N-O 2.94Å; F298-V581 PolarHBondContact O-N 2.84Å; L300-V581 HydrophobicContact CD1-CG1 4.31Å; L300-V581 HydrophobicContact CD1-CG2 3.95Å; A335-V581 HydrophobicContact CB-CG1 3.79Å; A337-V581 HydrophobicContact CB-CB 4.28Å; V342-V581 HydrophobicContact CG1-CG2 3.93Å; V342-V581 HydrophobicContact CG2-CG2 4Å; V581-T583 HydrophobicContact CG2-CG2 4.42Å
582	S	77.6	Confident	61	Low	20 Å²	20	46.2 Å²	46.2	14%	0.14	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.1	174.5	179.3	0	0	0	0	107.5	H295 A337	H295-S582 PolarHBondContact ND1-OG 3.14Å; A337-S582 WeakPolarHBondContact CB-O 3.47Å
583	T	72.7	Confident	60.9	Low	2 Å²	2	45 Å²	45	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	165.9	-177.1	58.7	0	0	0	0	109.7	H295 S296 F298 A337 V342 V581 K585	H295-T583 CarbonylContact C-O 3.58Å; H295-T583 VanDerWaalsContact CA-O 3.23Å; H295-T583 WeakPolarHBondContact CA-O 3.31Å; S296-T583 PolarHBondContact N-O 2.8Å; S296-T583 PolarHBondContact O-N 2.96Å; S296-T583 PolarHBondContact O-OG1 3.33Å; S296-T583 VanDerWaalsContact O-OG1 3.07Å; F298-T583 HydrophobicContact CD2-CG2 3.92Å; F298-T583 VanDerWaalsContact CD2-OG1 3.24Å; F298-T583 WeakPolarHBondContact CD2-OG1 3.12Å; F298-T583 HydrophobicContact CE2-CG2 4.34Å; F298-T583 WeakPolarHBondContact CE2-OG1 3.5Å; A337-T583 HydrophobicContact CB-CG2 3.53Å; V342-T583 HydrophobicContact CG2-CG2 3.28Å; V581-T583 HydrophobicContact CG2-CG2 4.42Å; T583-K585 PolarHBondContact O-N 2.88Å
584	W	66.9	Low	61.4	Low	44 Å²	44	38 Å²	38	17%	0.167	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.1	169.2	-69	-1	0	0	0	110.4	A288 R289 P290 H295 G339 H586	A288-W584 WeakPolarHBondContact O-CZ3 3.34Å; R289-W584 HydrophobicContact CB-CZ2 4.46Å; R289-W584 HydrophobicContact CG-CH2 4.49Å; R289-W584 HydrophobicContact CG-CZ2 3.98Å; P290-W584 HydrophobicContact CG-CB 3.66Å; P290-W584 HydrophobicContact CG-CD2 3.87Å; P290-W584 HydrophobicContact CG-CE3 4.25Å; P290-W584 HydrophobicContact CG-CG 3.58Å; H295-W584 AromaticContact CE1-CD1 3.76Å; G339-W584 PolarHBondContact O-N 3.35Å; G339-W584 VanDerWaalsContact O-N 3.11Å; W584-H586 PolarHBondContact O-N 2.98Å
585	K	61.5	Low	62	Low	70 Å²	70	37.7 Å²	37.7	30%	0.304	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-69.9	119	172.4	-174.8	172.6	178.1	177.5	0	107.4	E205 G294 S296 T583	E205-K585 IonicContact OE1-NZ 2.93Å; E205-K585 PolarHBondContact OE1-NZ 2.99Å; G294-K585 VanDerWaalsContact C-CB 3.44Å; G294-K585 WeakPolarHBondContact O-CA 2.97Å; G294-K585 WeakPolarHBondContact O-CB 3.29Å; G294-K585 PolarHBondContact O-N 3.19Å; S296-K585 WeakPolarHBondContact OG-CB 3.11Å; S296-K585 WeakPolarHBondContact OG-CG 2.95Å; T583-K585 PolarHBondContact O-N 2.88Å
586	H	53.7	Low	62.3	Low	59 Å²	59	39.6 Å²	39.6	27%	0.273	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-78.2	130.4	170.9	-175	-119.1	0	0	0	109.5	L364 W584	L364-H586 HydrophobicContact CD2-CB 3.8Å; L364-H586 WeakPolarHBondContact CD2-CD2 3.31Å; W584-H586 PolarHBondContact O-N 2.98Å
587	L	45.5	Very low	62.3	Low	40 Å²	40	39.4 Å²	39.4	21%	0.209	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-82.8	126.1	163.9	-74.4	163.8	0	0	0	107.9	E205	E205-L587 WeakPolarHBondContact O-CD1 3.1Å; E205-L587 WeakPolarHBondContact O-CD2 3.37Å
588	P	37.9	Very low	62.2	Low	99 Å²	99	41.7 Å²	41.7	64%	0.643	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-57.2	151.5	-176.7	22.5	-31.2	0	0	0	112.2
589	S	33	Very low	61.7	Low	123 Å²	123	43.7 Å²	43.7	86%	0.86	25%	0.249	S	C	*	.			trans	-52	0	177.4	53.6	0	0	0	0	114.1

Retrieved 589 of 589 residues in 208.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).