A0A077ZHW8_TRITR Loading...

Caseinolytic peptidase B protein

AlphaFold DB , UniProt , Accession A0A077ZHW8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 553 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	29.5	Very low	236 Å²	236	135.6 Å²	135.6	100%	1.163	81%	0.812	S	S	*	*				0	120.4	0	-84.7	-180	171.3	0	0	107.8	L3	M1-L3 PolarHBondContact O-N 3.35Å
2	H	29.5	Very low	29.6	Very low	173 Å²	173	133 Å²	133	80%	0.801	82%	0.816	S	S	*	*			trans	-59	124.2	174	-75.8	-72.9	0	0	0	110.4	F4	H2-F4 AromaticContact ND1-CD2 3.98Å
3	L	30.4	Very low	29.3	Very low	165 Å²	165	131 Å²	131	86%	0.864	80%	0.803	S	S	*	*			trans	-128.3	68.1	161.3	-99.9	145.2	0	0	0	107	M1 A5	M1-L3 PolarHBondContact O-N 3.35Å; L3-A5 VanDerWaalsContact C-N 3.26Å; L3-A5 PolarHBondContact O-N 3.31Å; L3-A5 VanDerWaalsContact O-N 3.12Å
4	F	28.4	Very low	29.3	Very low	176 Å²	176	131.7 Å²	131.7	77%	0.772	80%	0.798	S	S	*	*			trans	-69.9	92.4	155.1	-86.9	-83.2	0	0	0	106.4	H2 T6	H2-F4 AromaticContact ND1-CD2 3.98Å; F4-T6 VanDerWaalsContact C-N 3.25Å; F4-T6 PolarHBondContact O-N 3.04Å
5	A	31.6	Very low	29	Very low	83 Å²	83	136.7 Å²	136.7	69%	0.686	80%	0.799	S	S	*	*			trans	-75.7	86.5	165.7	0	0	0	0	0	107.9	L3 L7	L3-A5 VanDerWaalsContact C-N 3.26Å; L3-A5 PolarHBondContact O-N 3.31Å; L3-A5 VanDerWaalsContact O-N 3.12Å; A5-L7 PolarHBondContact O-N 3.12Å
6	T	25.5	Very low	29	Very low	129 Å²	129	138.7 Å²	138.7	79%	0.791	80%	0.795	S	S	*	*			trans	-68.3	106.3	155.8	48.7	0	0	0	0	107.7	F4	F4-T6 VanDerWaalsContact C-N 3.25Å; F4-T6 PolarHBondContact O-N 3.04Å
7	L	28.6	Very low	28.9	Very low	157 Å²	157	135.8 Å²	135.8	82%	0.822	79%	0.785	S	S	*	*			trans	-130.7	141	161.9	-95.9	146.9	0	0	0	109	A5	A5-L7 PolarHBondContact O-N 3.12Å
8	P	32.3	Very low	28.7	Very low	103 Å²	103	136.7 Å²	136.7	67%	0.669	79%	0.787	S	S	*	*			trans	-93.7	158.2	-139.2	35.7	-37	0	0	0	114	A10	P8-A10 VanDerWaalsContact C-N 3.34Å; P8-A10 PolarHBondContact O-N 2.9Å
9	A	31.2	Very low	28.5	Very low	113 Å²	113	136.9 Å²	136.9	93%	0.934	79%	0.785	S	S	*	*	S	Bend	trans	-61.2	89.2	165.1	0	0	0	0	0	110.8
10	A	27.5	Very low	28.7	Very low	93 Å²	93	135.4 Å²	135.4	77%	0.769	78%	0.783	S	S	*	*			trans	-156.2	114.8	163.7	0	0	0	0	0	109.2	P8	P8-A10 VanDerWaalsContact C-N 3.34Å; P8-A10 PolarHBondContact O-N 2.9Å
11	G	25.6	Very low	28.5	Very low	64 Å²	64	136.2 Å²	136.2	66%	0.66	78%	0.784	S	S	*	*			trans	116.5	45.5	162.5	0	0	0	0	0	117	V13	G11-V13 PolarHBondContact O-N 2.93Å
12	A	30.3	Very low	28.2	Very low	104 Å²	104	129.1 Å²	129.1	86%	0.86	76%	0.764	S	S	*	*			trans	-69.2	81.7	143.7	0	0	0	0	0	106.7	L14	A12-L14 VanDerWaalsContact C-N 3.35Å; A12-L14 PolarHBondContact O-N 2.94Å
13	V	26.5	Very low	28.4	Very low	107 Å²	107	127.9 Å²	127.9	65%	0.648	77%	0.769	S	S	*	*			trans	-61.7	101.5	172.1	174.2	0	0	0	0	106.2	G11 Y15	G11-V13 PolarHBondContact O-N 2.93Å; V13-Y15 VanDerWaalsContact C-N 3.28Å; V13-Y15 HydrophobicContact CG1-CD2 3.99Å; V13-Y15 HydrophobicContact CG1-CE2 4.22Å; V13-Y15 PolarHBondContact O-N 2.81Å
14	L	28.5	Very low	28.2	Very low	141 Å²	141	127.5 Å²	127.5	74%	0.738	77%	0.767	S	S	*	*			trans	-58.3	97.4	162.2	-73.4	166.6	0	0	0	106.7	A12 F16	A12-L14 VanDerWaalsContact C-N 3.35Å; A12-L14 PolarHBondContact O-N 2.94Å; L14-F16 HydrophobicContact CB-CD2 4.04Å; L14-F16 HydrophobicContact CB-CE2 4.39Å; L14-F16 HydrophobicContact CD2-CE2 4.29Å; L14-F16 PolarHBondContact O-N 2.9Å
15	Y	24.7	Very low	28.1	Very low	206 Å²	206	123.1 Å²	123.1	81%	0.808	77%	0.772	S	S	*	*			trans	-67.1	73.2	164.5	-99.6	-90.1	0	0	0	108.4	V13 S17	V13-Y15 VanDerWaalsContact C-N 3.28Å; V13-Y15 HydrophobicContact CG1-CD2 3.99Å; V13-Y15 HydrophobicContact CG1-CE2 4.22Å; V13-Y15 PolarHBondContact O-N 2.81Å; Y15-S17 VanDerWaalsContact C-N 3.25Å; Y15-S17 PolarHBondContact O-N 3.38Å
16	F	29.7	Very low	28	Very low	169 Å²	169	122.2 Å²	122.2	74%	0.741	77%	0.77	S	S	*	*			trans	-82.4	86.7	150.7	-77.9	-73	0	0	0	105.9	L14 N18	L14-F16 HydrophobicContact CB-CD2 4.04Å; L14-F16 HydrophobicContact CB-CE2 4.39Å; L14-F16 HydrophobicContact CD2-CE2 4.29Å; L14-F16 PolarHBondContact O-N 2.9Å; F16-N18 VanDerWaalsContact C-N 3.34Å; F16-N18 PolarHBondContact O-N 3.29Å
17	S	27	Very low	28.7	Very low	89 Å²	89	119.4 Å²	119.4	62%	0.622	76%	0.756	S	S	*	*			trans	-63.9	102.4	167.6	-152.8	0	0	0	0	106.8	Y15 N19	Y15-S17 VanDerWaalsContact C-N 3.25Å; Y15-S17 PolarHBondContact O-N 3.38Å; S17-N19 PolarHBondContact O-N 3.49Å
18	N	24.8	Very low	29.2	Very low	153 Å²	153	119.3 Å²	119.3	82%	0.818	76%	0.756	S	S	*	*			trans	-64.5	76.2	164.2	-82.2	-23.8	0	0	0	108.3	F16	F16-N18 VanDerWaalsContact C-N 3.34Å; F16-N18 PolarHBondContact O-N 3.29Å
19	N	26	Very low	30.4	Very low	140 Å²	140	116.5 Å²	116.5	75%	0.749	73%	0.734	S	S	*	*			trans	-92.7	88.8	157.5	-91.8	0.5	0	0	0	107.1	S17 D21	S17-N19 PolarHBondContact O-N 3.49Å; N19-D21 PolarHBondContact O-N 2.81Å
20	S	31.6	Very low	32.1	Very low	106 Å²	106	115.9 Å²	115.9	74%	0.741	72%	0.715	S	S	*	*			trans	-66.3	83	154.1	52.2	0	0	0	0	107.7
21	D	25.1	Very low	34.3	Very low	153 Å²	153	114.8 Å²	114.8	82%	0.818	71%	0.706	S	S	*	*			trans	-170.7	135.4	156.2	-92.6	-27.9	0	0	0	111	N19	N19-D21 PolarHBondContact O-N 2.81Å
22	A	27.9	Very low	36.6	Very low	88 Å²	88	115.1 Å²	115.1	73%	0.727	70%	0.695	S	S	*	*			trans	67.5	105.7	162	0	0	0	0	0	118.7	D24	A22-D24 PolarHBondContact O-N 3.12Å
23	T	32.7	Very low	38.9	Very low	147 Å²	147	110.6 Å²	110.6	90%	0.902	66%	0.658	S	S	*	*			trans	-15.8	93.5	140.8	53.8	0	0	0	0	114.8
24	D	26.4	Very low	41.7	Very low	156 Å²	156	108 Å²	108	83%	0.834	64%	0.641	S	S	*	*			trans	-141.5	130.8	156.6	-132.1	-9.3	0	0	0	108	A22 G26	A22-D24 PolarHBondContact O-N 3.12Å; D24-G26 PolarHBondContact O-N 2.53Å
25	G	26	Very low	44.6	Very low	84 Å²	84	106.3 Å²	106.3	87%	0.866	63%	0.629	S	S	*	*			trans	-69.7	51.2	-168.5	0	0	0	0	0	115	S27	G25-S27 PolarHBondContact O-N 3.35Å
26	G	29.9	Very low	47.8	Very low	64 Å²	64	96.6 Å²	96.6	66%	0.66	59%	0.591	S	S	*	*			trans	-64.5	114.5	164.7	0	0	0	0	0	108.7	D24 N28	D24-G26 PolarHBondContact O-N 2.53Å; G26-N28 PolarHBondContact O-N 2.62Å
27	S	39.9	Very low	50.8	Low	71 Å²	71	88.6 Å²	88.6	50%	0.497	56%	0.556	S	S	.	*			trans	-52	101	176.8	42.9	0	0	0	0	110.6	G25 F29	G25-S27 PolarHBondContact O-N 3.35Å; S27-F29 PolarHBondContact O-N 2.82Å
28	N	40.4	Very low	53.9	Low	154 Å²	154	88 Å²	88	82%	0.824	54%	0.541	S	S	*	.			trans	-60.4	90.3	159.7	-98.9	-8.6	0	0	0	106	G26 D30	G26-N28 PolarHBondContact O-N 2.62Å; N28-D30 PolarHBondContact O-N 2.95Å
29	F	56.5	Low	57.2	Low	44 Å²	44	81.1 Å²	81.1	19%	0.193	51%	0.505	C	S	.	.			trans	-57.8	114.4	161.7	-177.3	-111.8	0	0	0	106.2	S27 A31 L34 F37 P63	S27-F29 PolarHBondContact O-N 2.82Å; F29-A31 PolarHBondContact O-N 3.3Å; F29-L34 HydrophobicContact CD1-CB 3.83Å; F29-L34 HydrophobicContact CD1-CD1 4.03Å; F29-L34 HydrophobicContact CD1-CG 4.42Å; F29-L34 VanDerWaalsContact CE1-CA 3.46Å; F29-L34 HydrophobicContact CE1-CB 3.52Å; F29-L34 HydrophobicContact CE1-CD1 3.58Å; F29-L34 HydrophobicContact CE1-CG 4.12Å; F29-L34 VanDerWaalsContact CE1-N 3.33Å; F29-F37 HydrophobicContact CE1-CD2 4.47Å; F29-F37 HydrophobicContact CE1-CE2 4.44Å; F29-F37 HydrophobicContact CZ-CD2 4.07Å; F29-F37 AromaticContact CZ-CE2 3.63Å; F29-F37 HydrophobicContact CZ-CE2 3.63Å; F29-F37 HydrophobicContact CZ-CZ 4.5Å; F29-P63 HydrophobicContact CB-CG 4.06Å; F29-P63 HydrophobicContact CD2-CG 3.52Å; F29-P63 HydrophobicContact CE2-CG 4.08Å; F29-P63 HydrophobicContact CG-CG 3.83Å
30	D	66.3	Low	60.4	Low	100 Å²	100	74.4 Å²	74.4	54%	0.535	47%	0.469	S	S	.	.			trans	-51.7	129.7	-172.7	-71.1	-38.8	0	0	0	109.9	N28 T32 G33 L34	N28-D30 PolarHBondContact O-N 2.95Å; D30-T32 WeakPolarHBondContact CB-OG1 3.26Å; D30-T32 PolarHBondContact O-N 3.4Å; D30-G33 WeakPolarHBondContact O-CA 3.39Å; D30-G33 PolarHBondContact O-N 3.28Å; D30-L34 PolarHBondContact O-N 3.31Å; D30-L34 VanDerWaalsContact O-N 3.13Å
31	A	75.4	Confident	63.3	Low	70 Å²	70	73.4 Å²	73.4	58%	0.579	45%	0.449	S	S	*	.	H	α-helix	trans	-54.5	-31	178.1	0	0	0	0	0	111.6	F29 L34 Q35	F29-A31 PolarHBondContact O-N 3.3Å; A31-L34 PolarHBondContact O-N 3.22Å; A31-Q35 VanDerWaalsContact O-CG 3.24Å; A31-Q35 WeakPolarHBondContact O-CG 3.22Å; A31-Q35 PolarHBondContact O-N 3.15Å
32	T	73.8	Confident	66.5	Low	71 Å²	71	71.5 Å²	71.5	44%	0.436	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-42.5	173.7	54.1	0	0	0	0	112.4	D30 Q35 L36	D30-T32 WeakPolarHBondContact CB-OG1 3.26Å; D30-T32 PolarHBondContact O-N 3.4Å; T32-Q35 PolarHBondContact O-N 3.02Å; T32-L36 PolarHBondContact O-N 3.45Å
33	G	78.2	Confident	69.6	Low	9 Å²	9	69.8 Å²	69.8	9%	0.093	42%	0.417	C	S	.	.	H	α-helix	trans	-59.7	-47.3	174.5	0	0	0	0	0	111	D30 Q35 L36 F37	D30-G33 WeakPolarHBondContact O-CA 3.39Å; D30-G33 PolarHBondContact O-N 3.28Å; G33-Q35 PolarHBondContact O-N 3.38Å; G33-L36 WeakPolarHBondContact O-CB 3.36Å; G33-L36 PolarHBondContact O-N 3.21Å; G33-F37 WeakPolarHBondContact O-CD2 3.37Å; G33-F37 WeakPolarHBondContact O-CE2 3.48Å
34	L	85.4	Confident	72.6	Confident	54 Å²	54	65.9 Å²	65.9	28%	0.283	39%	0.391	S	S	.	.	H	α-helix	trans	-63.7	-39.5	178.4	-163.7	66.7	0	0	0	113	F29 D30 A31 L36 F37 Y38 F121	F29-L34 HydrophobicContact CD1-CB 3.83Å; F29-L34 HydrophobicContact CD1-CD1 4.03Å; F29-L34 HydrophobicContact CD1-CG 4.42Å; F29-L34 VanDerWaalsContact CE1-CA 3.46Å; F29-L34 HydrophobicContact CE1-CB 3.52Å; F29-L34 HydrophobicContact CE1-CD1 3.58Å; F29-L34 HydrophobicContact CE1-CG 4.12Å; F29-L34 VanDerWaalsContact CE1-N 3.33Å; D30-L34 PolarHBondContact O-N 3.31Å; D30-L34 VanDerWaalsContact O-N 3.13Å; A31-L34 PolarHBondContact O-N 3.22Å; L34-L36 PolarHBondContact O-N 2.85Å; L34-F37 PolarHBondContact O-N 3.43Å; L34-F37 VanDerWaalsContact O-N 3.15Å; L34-Y38 HydrophobicContact CD1-CE2 4.29Å; L34-Y38 HydrophobicContact CD2-CE2 3.89Å; L34-Y38 HydrophobicContact CG-CD2 4.17Å; L34-Y38 HydrophobicContact CG-CE2 3.63Å; L34-Y38 VanDerWaalsContact O-CD2 3.28Å; L34-Y38 WeakPolarHBondContact O-CD2 3.36Å; L34-Y38 PolarHBondContact O-N 2.99Å; L34-F121 HydrophobicContact CD1-CE2 4.33Å; L34-F121 HydrophobicContact CD1-CZ 3.73Å
35	Q	89.6	Confident	75.7	Confident	104 Å²	104	60.2 Å²	60.2	49%	0.486	36%	0.363	S	S	.	.	H	α-helix	trans	-57.9	-35.7	175.2	-76.2	171.1	5.7	0	0	112.3	A31 T32 G33 F37 Y38 A39 L51	A31-Q35 VanDerWaalsContact O-CG 3.24Å; A31-Q35 WeakPolarHBondContact O-CG 3.22Å; A31-Q35 PolarHBondContact O-N 3.15Å; T32-Q35 PolarHBondContact O-N 3.02Å; G33-Q35 PolarHBondContact O-N 3.38Å; Q35-F37 PolarHBondContact O-N 2.95Å; Q35-Y38 PolarHBondContact O-N 3.43Å; Q35-A39 WeakPolarHBondContact O-CB 3.35Å; Q35-A39 PolarHBondContact O-N 3.18Å; Q35-L51 HydrophobicContact CB-CD1 3.91Å; Q35-L51 HydrophobicContact CB-CD2 4.18Å
36	L	91.5	Very high	78.9	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-64.1	-38.6	177.9	-171.8	63.6	0	0	0	112.3	T32 G33 L34 A39 A40 I48 L51 P68 L84	T32-L36 PolarHBondContact O-N 3.45Å; G33-L36 WeakPolarHBondContact O-CB 3.36Å; G33-L36 PolarHBondContact O-N 3.21Å; L34-L36 PolarHBondContact O-N 2.85Å; L36-A39 PolarHBondContact O-N 3.35Å; L36-A40 VanDerWaalsContact O-CB 3.28Å; L36-A40 WeakPolarHBondContact O-CB 3.33Å; L36-A40 PolarHBondContact O-N 3.39Å; L36-I48 HydrophobicContact CD1-CB 4.33Å; L36-I48 HydrophobicContact CD1-CG1 4.17Å; L36-I48 HydrophobicContact CD1-CG2 3.99Å; L36-L51 HydrophobicContact CB-CD1 4.2Å; L36-L51 HydrophobicContact CD1-CB 4.3Å; L36-L51 HydrophobicContact CD1-CD1 4.19Å; L36-P68 HydrophobicContact CD2-CB 4.39Å; L36-P68 HydrophobicContact CD2-CG 3.75Å; L36-P68 HydrophobicContact CG-CB 4.28Å; L36-P68 HydrophobicContact CG-CG 4.06Å; L36-L84 HydrophobicContact CD1-CD2 4.19Å
37	F	92.3	Very high	81.9	Confident	1 Å²	1	60.7 Å²	60.7	0%	0.004	33%	0.328	C	S	.	.	H	α-helix	trans	-67.6	-39.3	176.4	-67.1	-90.7	0	0	0	112.2	F29 G33 L34 Q35 A40 R41 K60 H62 W66 P68 V71 F121	F29-F37 HydrophobicContact CE1-CD2 4.47Å; F29-F37 HydrophobicContact CE1-CE2 4.44Å; F29-F37 HydrophobicContact CZ-CD2 4.07Å; F29-F37 AromaticContact CZ-CE2 3.63Å; F29-F37 HydrophobicContact CZ-CE2 3.63Å; F29-F37 HydrophobicContact CZ-CZ 4.5Å; G33-F37 WeakPolarHBondContact O-CD2 3.37Å; G33-F37 WeakPolarHBondContact O-CE2 3.48Å; L34-F37 PolarHBondContact O-N 3.43Å; L34-F37 VanDerWaalsContact O-N 3.15Å; Q35-F37 PolarHBondContact O-N 2.95Å; F37-A40 PolarHBondContact O-N 3.17Å; F37-R41 WeakPolarHBondContact O-CB 3.44Å; F37-R41 PolarHBondContact O-N 3.38Å; F37-K60 WeakPolarHBondContact CZ-O 3.49Å; F37-H62 HydrophobicContact CE1-CB 3.83Å; F37-H62 HydrophobicContact CE2-CB 4.37Å; F37-H62 HydrophobicContact CZ-CB 3.74Å; F37-W66 AromaticContact CD1-CD1 3.83Å; F37-W66 AromaticContact CD1-NE1 3.74Å; F37-W66 AromaticContact CE1-CD1 3.53Å; F37-W66 AromaticContact CE1-NE1 3.75Å; F37-W66 WeakPolarHBondContact CE1-O 3.31Å; F37-P68 HydrophobicContact CD1-CB 4.44Å; F37-P68 HydrophobicContact CD1-CG 4.28Å; F37-P68 HydrophobicContact CE1-CB 4.39Å; F37-P68 HydrophobicContact CE1-CG 3.87Å; F37-P68 HydrophobicContact CE2-CG 4.2Å; F37-P68 HydrophobicContact CZ-CG 3.81Å; F37-V71 HydrophobicContact CD1-CG2 3.92Å; F37-F121 HydrophobicContact CB-CD1 3.83Å; F37-F121 HydrophobicContact CB-CE1 3.37Å; F37-F121 HydrophobicContact CB-CZ 3.94Å; F37-F121 HydrophobicContact CG-CE1 4.41Å
38	Y	93	Very high	84.4	Confident	78 Å²	78	57.3 Å²	57.3	31%	0.306	31%	0.305	S	S	.	.	H	α-helix	trans	-67.5	-41	174.6	-70.5	-64.5	0	0	0	112.1	L34 Q35 A40 R41 N42 E120 F121	L34-Y38 HydrophobicContact CD1-CE2 4.29Å; L34-Y38 HydrophobicContact CD2-CE2 3.89Å; L34-Y38 HydrophobicContact CG-CD2 4.17Å; L34-Y38 HydrophobicContact CG-CE2 3.63Å; L34-Y38 VanDerWaalsContact O-CD2 3.28Å; L34-Y38 WeakPolarHBondContact O-CD2 3.36Å; L34-Y38 PolarHBondContact O-N 2.99Å; Q35-Y38 PolarHBondContact O-N 3.43Å; Y38-A40 VanDerWaalsContact C-N 3.32Å; Y38-A40 PolarHBondContact O-N 3.46Å; Y38-R41 PolarHBondContact O-N 3.14Å; Y38-N42 WeakPolarHBondContact O-CB 3.48Å; Y38-N42 PolarHBondContact O-N 3.35Å; Y38-N42 PolarHBondContact O-ND2 2.97Å; Y38-E120 HydrophobicContact CE1-CG 4.34Å; Y38-E120 VanDerWaalsContact CE1-OE1 3.22Å; Y38-E120 WeakPolarHBondContact CE1-OE1 3.26Å; Y38-E120 VanDerWaalsContact CZ-OE1 3.26Å; Y38-E120 PolarHBondContact OH-OE1 3.48Å; Y38-F121 AromaticContact CD1-CE1 3.97Å; Y38-F121 HydrophobicContact CD1-CE1 3.97Å; Y38-F121 AromaticContact CE1-CE1 3.91Å; Y38-F121 HydrophobicContact CE1-CE1 3.91Å; Y38-F121 HydrophobicContact CE1-CZ 4.18Å; Y38-F121 HydrophobicContact CE2-CZ 4.45Å; Y38-F121 HydrophobicContact CG-CE1 4.33Å
39	A	93.3	Very high	86.9	Confident	7 Å²	7	53 Å²	53	6%	0.058	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-42.1	175.2	0	0	0	0	0	111.3	Q35 L36 N42 N43 D44 A47 I48 L51	Q35-A39 WeakPolarHBondContact O-CB 3.35Å; Q35-A39 PolarHBondContact O-N 3.18Å; L36-A39 PolarHBondContact O-N 3.35Å; A39-N42 PolarHBondContact O-N 3.11Å; A39-N43 PolarHBondContact O-N 3.48Å; A39-D44 HydrophobicContact CB-CB 4.44Å; A39-D44 PolarHBondContact O-N 3.29Å; A39-A47 HydrophobicContact CB-CB 3.89Å; A39-I48 HydrophobicContact CB-CG1 3.72Å; A39-L51 HydrophobicContact CB-CD1 4.4Å
40	A	92.9	Very high	88.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-44.7	173.7	0	0	0	0	0	112.7	L36 F37 Y38 N43 P68 A72 C77 L84	L36-A40 VanDerWaalsContact O-CB 3.28Å; L36-A40 WeakPolarHBondContact O-CB 3.33Å; L36-A40 PolarHBondContact O-N 3.39Å; F37-A40 PolarHBondContact O-N 3.17Å; Y38-A40 VanDerWaalsContact C-N 3.32Å; Y38-A40 PolarHBondContact O-N 3.46Å; A40-N43 PolarHBondContact O-N 3.21Å; A40-P68 HydrophobicContact CB-CB 4.28Å; A40-A72 HydrophobicContact CB-CB 4.2Å; A40-C77 WeakPolarHBondContact O-CB 3.48Å; A40-C77 PolarHBondContact O-SG 3.48Å; A40-L84 HydrophobicContact CB-CD1 4.3Å
41	R	92.8	Very high	89.8	Confident	85 Å²	85	55 Å²	55	32%	0.321	28%	0.28	S	S	.	.	H	α-helix	trans	-64	-37.3	176.9	-177.7	-179.1	170.8	-158.8	-2.2	113	F37 Y38 N43 V71 C77 E120	F37-R41 WeakPolarHBondContact O-CB 3.44Å; F37-R41 PolarHBondContact O-N 3.38Å; Y38-R41 PolarHBondContact O-N 3.14Å; R41-N43 VanDerWaalsContact C-N 3.33Å; R41-V71 HydrophobicContact CB-CG1 3.68Å; R41-V71 HydrophobicContact CG-CG1 4.37Å; R41-C77 PolarHBondContact O-SG 3.01Å; R41-E120 WeakPolarHBondContact CD-O 3.48Å; R41-E120 PolarHBondContact NE-O 3.17Å; R41-E120 VanDerWaalsContact NE-O 3.12Å; R41-E120 PolarHBondContact NH1-O 3.35Å; R41-E120 PolarHBondContact NH2-O 2.9Å
42	N	92.9	Very high	90.5	Very high	113 Å²	113	52.8 Å²	52.8	60%	0.604	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	5.3	-175.6	-66.7	-21.6	0	0	0	113.4	Y38 A39 D44	Y38-N42 WeakPolarHBondContact O-CB 3.48Å; Y38-N42 PolarHBondContact O-N 3.35Å; Y38-N42 PolarHBondContact O-ND2 2.97Å; A39-N42 PolarHBondContact O-N 3.11Å; N42-D44 PolarHBondContact O-N 3.06Å
43	N	93.3	Very high	91.3	Very high	52 Å²	52	55 Å²	55	28%	0.278	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	28.8	-175.5	-153.7	26.3	0	0	0	114.1	A39 A40 R41 S45 C77 K79 A80	A39-N43 PolarHBondContact O-N 3.48Å; A40-N43 PolarHBondContact O-N 3.21Å; R41-N43 VanDerWaalsContact C-N 3.33Å; N43-S45 PolarHBondContact O-N 2.9Å; N43-S45 VanDerWaalsContact O-N 3.15Å; N43-C77 HydrophobicContact CB-CB 3.75Å; N43-C77 VanDerWaalsContact OD1-CA 3.31Å; N43-C77 WeakPolarHBondContact OD1-CA 3.3Å; N43-C77 WeakPolarHBondContact OD1-CB 3.4Å; N43-C77 PolarHBondContact OD1-O 3.36Å; N43-K79 WeakPolarHBondContact OD1-CB 3.11Å; N43-K79 PolarHBondContact OD1-N 3.22Å; N43-K79 VanDerWaalsContact OD1-N 3.09Å; N43-A80 PolarHBondContact OD1-N 2.95Å
44	D	94.2	Very high	91.9	Very high	65 Å²	65	58.6 Å²	58.6	35%	0.348	30%	0.297	S	S	.	.			trans	-86.5	82.6	-177.1	-170.9	-14.4	0	0	0	110.7	A39 N42 E46 A47 I48	A39-D44 HydrophobicContact CB-CB 4.44Å; A39-D44 PolarHBondContact O-N 3.29Å; N42-D44 PolarHBondContact O-N 3.06Å; D44-E46 PolarHBondContact O-N 3.46Å; D44-E46 PolarHBondContact OD1-N 2.86Å; D44-A47 HydrophobicContact CB-CB 4.02Å; D44-A47 PolarHBondContact O-N 3.17Å; D44-A47 WeakPolarHBondContact OD1-CB 3.12Å; D44-A47 PolarHBondContact OD1-N 3.46Å; D44-A47 VanDerWaalsContact OD2-CB 3.26Å; D44-A47 WeakPolarHBondContact OD2-CB 3.46Å; D44-I48 VanDerWaalsContact O-CG1 3.3Å; D44-I48 WeakPolarHBondContact O-CG1 3.4Å; D44-I48 PolarHBondContact O-N 2.94Å
45	S	92.7	Very high	92	Very high	36 Å²	36	59.2 Å²	59.2	25%	0.252	32%	0.317	S	S	.	.	H	α-helix	trans	-58.9	-32.6	178.8	47.9	0	0	0	0	113.5	N43 Q49	N43-S45 PolarHBondContact O-N 2.9Å; N43-S45 VanDerWaalsContact O-N 3.15Å; S45-Q49 PolarHBondContact O-N 3.48Å
46	E	93.5	Very high	91.9	Very high	146 Å²	146	55 Å²	55	68%	0.682	30%	0.3	S	S	*	.	H	α-helix	trans	-74.9	-39.1	-178.9	-66	-178.1	-174	0	0	111.5	D44 R50	D44-E46 PolarHBondContact O-N 3.46Å; D44-E46 PolarHBondContact OD1-N 2.86Å; E46-R50 WeakPolarHBondContact O-CB 3.31Å; E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 2.79Å; E46-R50 VanDerWaalsContact O-N 3.11Å; E46-R50 PolarHBondContact O-NE 3.34Å
47	A	92.7	Very high	91.9	Very high	13 Å²	13	58.9 Å²	58.9	11%	0.107	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-40.8	171.9	0	0	0	0	0	111.9	A39 D44 R50 L51	A39-A47 HydrophobicContact CB-CB 3.89Å; D44-A47 HydrophobicContact CB-CB 4.02Å; D44-A47 PolarHBondContact O-N 3.17Å; D44-A47 WeakPolarHBondContact OD1-CB 3.12Å; D44-A47 PolarHBondContact OD1-N 3.46Å; D44-A47 VanDerWaalsContact OD2-CB 3.26Å; D44-A47 WeakPolarHBondContact OD2-CB 3.46Å; A47-R50 PolarHBondContact O-N 3.37Å; A47-L51 WeakPolarHBondContact O-CB 3.24Å; A47-L51 WeakPolarHBondContact O-CG 3.28Å; A47-L51 PolarHBondContact O-N 2.91Å
48	I	92.2	Very high	91.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-50.7	176.5	-67	165.6	0	0	0	110.3	L36 A39 D44 R50 L51 V52 A80 V83 L84	L36-I48 HydrophobicContact CD1-CB 4.33Å; L36-I48 HydrophobicContact CD1-CG1 4.17Å; L36-I48 HydrophobicContact CD1-CG2 3.99Å; A39-I48 HydrophobicContact CB-CG1 3.72Å; D44-I48 VanDerWaalsContact O-CG1 3.3Å; D44-I48 WeakPolarHBondContact O-CG1 3.4Å; D44-I48 PolarHBondContact O-N 2.94Å; I48-R50 PolarHBondContact O-N 3.03Å; I48-L51 PolarHBondContact O-N 3.33Å; I48-V52 HydrophobicContact CG2-CG2 4.35Å; I48-V52 WeakPolarHBondContact O-CG2 3.21Å; I48-V52 PolarHBondContact O-N 3.44Å; I48-A80 HydrophobicContact CD1-CB 3.37Å; I48-V83 HydrophobicContact CB-CG1 4.17Å; I48-V83 HydrophobicContact CG2-CB 4.34Å; I48-V83 HydrophobicContact CG2-CG1 3.67Å; I48-L84 HydrophobicContact CD1-CG 4.41Å; I48-L84 HydrophobicContact CG2-CD2 3.74Å; I48-L84 HydrophobicContact CG2-CG 4.06Å
49	Q	92.2	Very high	91.7	Very high	63 Å²	63	58.2 Å²	58.2	29%	0.294	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-45.8	-179.7	-169	63	50.7	0	0	111.3	S45 L51 V52 D53 V83 N87	S45-Q49 PolarHBondContact O-N 3.48Å; Q49-L51 VanDerWaalsContact C-N 3.29Å; Q49-L51 PolarHBondContact O-N 3.28Å; Q49-V52 PolarHBondContact O-N 2.87Å; Q49-D53 PolarHBondContact NE2-OD1 3.42Å; Q49-D53 WeakPolarHBondContact O-CB 3.3Å; Q49-D53 PolarHBondContact O-N 2.9Å; Q49-V83 HydrophobicContact CB-CG1 4.3Å; Q49-N87 PolarHBondContact NE2-OD1 3.47Å; Q49-N87 VanDerWaalsContact NE2-OD1 3.17Å; Q49-N87 PolarHBondContact OE1-ND2 3.27Å
50	R	93.3	Very high	91.5	Very high	164 Å²	164	63 Å²	63	62%	0.619	34%	0.342	S	S	*	.	H	α-helix	trans	-59.6	-37.5	177	-75.6	-175.4	-66.8	146.1	-4	113.2	E46 A47 I48 A54	E46-R50 WeakPolarHBondContact O-CB 3.31Å; E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 2.79Å; E46-R50 VanDerWaalsContact O-N 3.11Å; E46-R50 PolarHBondContact O-NE 3.34Å; A47-R50 PolarHBondContact O-N 3.37Å; I48-R50 PolarHBondContact O-N 3.03Å; R50-A54 WeakPolarHBondContact O-CB 3.42Å; R50-A54 PolarHBondContact O-N 3.46Å
51	L	91.8	Very high	91.3	Very high	22 Å²	22	67 Å²	67	12%	0.115	36%	0.357	C	S	.	.	H	α-helix	trans	-71.1	-42.8	178.5	-72.1	169	0	0	0	111.5	Q35 L36 A39 A47 I48 Q49 A54 G55 A56	Q35-L51 HydrophobicContact CB-CD1 3.91Å; Q35-L51 HydrophobicContact CB-CD2 4.18Å; L36-L51 HydrophobicContact CB-CD1 4.2Å; L36-L51 HydrophobicContact CD1-CB 4.3Å; L36-L51 HydrophobicContact CD1-CD1 4.19Å; A39-L51 HydrophobicContact CB-CD1 4.4Å; A47-L51 WeakPolarHBondContact O-CB 3.24Å; A47-L51 WeakPolarHBondContact O-CG 3.28Å; A47-L51 PolarHBondContact O-N 2.91Å; I48-L51 PolarHBondContact O-N 3.33Å; Q49-L51 VanDerWaalsContact C-N 3.29Å; Q49-L51 PolarHBondContact O-N 3.28Å; L51-A54 CarbonylContact O-C 3.56Å; L51-A54 WeakPolarHBondContact O-CB 3.49Å; L51-A54 PolarHBondContact O-N 3.25Å; L51-G55 PolarHBondContact O-N 3.47Å; L51-A56 HydrophobicContact CB-CB 4.12Å; L51-A56 WeakPolarHBondContact O-CB 3.43Å; L51-A56 PolarHBondContact O-N 3.42Å
52	V	90	Very high	91.1	Very high	24 Å²	24	63.1 Å²	63.1	15%	0.145	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-42	176.6	177.2	0	0	0	0	110.7	I48 Q49 A54 G55 N87	I48-V52 HydrophobicContact CG2-CG2 4.35Å; I48-V52 WeakPolarHBondContact O-CG2 3.21Å; I48-V52 PolarHBondContact O-N 3.44Å; Q49-V52 PolarHBondContact O-N 2.87Å; V52-A54 PolarHBondContact O-N 3.24Å; V52-G55 WeakPolarHBondContact O-CA 3.44Å; V52-G55 PolarHBondContact O-N 2.91Å; V52-N87 HydrophobicContact CG1-CB 3.78Å; V52-N87 HydrophobicContact CG2-CB 4.38Å
53	D	90.4	Very high	90.7	Very high	116 Å²	116	58.4 Å²	58.4	62%	0.62	32%	0.318	S	S	*	.	H	α-helix	trans	-61.5	-31.3	173.9	-65.9	-15	0	0	0	112	Q49 G55	Q49-D53 PolarHBondContact NE2-OD1 3.42Å; Q49-D53 WeakPolarHBondContact O-CB 3.3Å; Q49-D53 PolarHBondContact O-N 2.9Å; D53-G55 PolarHBondContact O-N 2.8Å
54	A	90.5	Very high	90.3	Very high	86 Å²	86	56.3 Å²	56.3	71%	0.711	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	2.8	173	0	0	0	0	0	113.8	R50 L51 V52	R50-A54 WeakPolarHBondContact O-CB 3.42Å; R50-A54 PolarHBondContact O-N 3.46Å; L51-A54 CarbonylContact O-C 3.56Å; L51-A54 WeakPolarHBondContact O-CB 3.49Å; L51-A54 PolarHBondContact O-N 3.25Å; V52-A54 PolarHBondContact O-N 3.24Å
55	G	87.2	Confident	90	Very high	67 Å²	67	53.8 Å²	53.8	69%	0.691	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	13.8	177.3	0	0	0	0	0	115	L51 V52 D53 D57	L51-G55 PolarHBondContact O-N 3.47Å; V52-G55 WeakPolarHBondContact O-CA 3.44Å; V52-G55 PolarHBondContact O-N 2.91Å; D53-G55 PolarHBondContact O-N 2.8Å; G55-D57 PolarHBondContact O-N 3.39Å
56	A	88.3	Confident	89.9	Confident	15 Å²	15	52 Å²	52	12%	0.124	28%	0.284	C	S	.	.			trans	-68.9	126.6	172.2	0	0	0	0	0	110.5	L51 P58	L51-A56 HydrophobicContact CB-CB 4.12Å; L51-A56 WeakPolarHBondContact O-CB 3.43Å; L51-A56 PolarHBondContact O-N 3.42Å; A56-P58 WeakPolarHBondContact O-CD 3.47Å
57	D	89.8	Confident	89.9	Confident	83 Å²	83	45.2 Å²	45.2	44%	0.444	25%	0.253	S	S	.	.			trans	-75.4	118.5	176.1	173.4	14.4	0	0	0	110.6	G55 N59 K60	G55-D57 PolarHBondContact O-N 3.39Å; D57-N59 PolarHBondContact O-N 2.96Å; D57-N59 WeakPolarHBondContact OD1-CB 3.39Å; D57-N59 PolarHBondContact OD1-N 2.72Å; D57-K60 HydrophobicContact CB-CB 4.18Å; D57-K60 VanDerWaalsContact O-CB 3.29Å; D57-K60 WeakPolarHBondContact O-CB 3.01Å; D57-K60 PolarHBondContact O-N 3.16Å; D57-K60 VanDerWaalsContact O-N 3.1Å
58	P	89.8	Confident	90	Very high	11 Å²	11	44.6 Å²	44.6	7%	0.071	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17	179.5	29.1	-36	0	0	0	113.5	A56 P68 L84 A89	A56-P58 WeakPolarHBondContact O-CD 3.47Å; P58-P68 WeakPolarHBondContact O-CD 3.37Å; P58-L84 HydrophobicContact CB-CD2 4.15Å; P58-A89 HydrophobicContact CB-CB 4.13Å
59	N	91.3	Very high	90.1	Very high	54 Å²	54	44.7 Å²	44.7	29%	0.289	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-0.9	177.2	-64.9	-57.7	0	0	0	113.3	D57 R61 G88 A89 D90	D57-N59 PolarHBondContact O-N 2.96Å; D57-N59 WeakPolarHBondContact OD1-CB 3.39Å; D57-N59 PolarHBondContact OD1-N 2.72Å; N59-R61 PolarHBondContact O-N 3.5Å; N59-R61 VanDerWaalsContact O-N 3.14Å; N59-G88 PolarHBondContact ND2-O 3.47Å; N59-A89 WeakPolarHBondContact OD1-CA 3.04Å; N59-D90 PolarHBondContact OD1-N 2.95Å
60	K	89.5	Confident	90.3	Very high	107 Å²	107	41.7 Å²	41.7	47%	0.465	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-60.9	121.5	-179.7	-172	68	176	-173.7	0	109.6	F37 D57 P68	F37-K60 WeakPolarHBondContact CZ-O 3.49Å; D57-K60 HydrophobicContact CB-CB 4.18Å; D57-K60 VanDerWaalsContact O-CB 3.29Å; D57-K60 WeakPolarHBondContact O-CB 3.01Å; D57-K60 PolarHBondContact O-N 3.16Å; D57-K60 VanDerWaalsContact O-N 3.1Å; K60-P68 WeakPolarHBondContact O-CD 3.21Å
61	R	90	Very high	90.4	Very high	84 Å²	84	33.9 Å²	33.9	32%	0.317	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-77.5	141	177.6	-70.3	173.8	177.4	-86	-0.4	110.8	N59 G65 W66 R94 N96	N59-R61 PolarHBondContact O-N 3.5Å; N59-R61 VanDerWaalsContact O-N 3.14Å; R61-G65 PolarHBondContact NH1-O 2.86Å; R61-W66 WeakPolarHBondContact CA-O 3.28Å; R61-R94 PolarHBondContact NH1-O 3.49Å; R61-R94 PolarHBondContact NH2-O 2.91Å; R61-N96 PolarHBondContact NH1-ND2 3.39Å
62	H	88.5	Confident	90.5	Very high	5 Å²	5	32.9 Å²	32.9	2%	0.023	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-60.5	151.5	164.2	-171.9	-97.1	0	0	0	109.2	F37 N64 G65 W66 S117 F121	F37-H62 HydrophobicContact CE1-CB 3.83Å; F37-H62 HydrophobicContact CE2-CB 4.37Å; F37-H62 HydrophobicContact CZ-CB 3.74Å; H62-N64 PolarHBondContact CE1-ND2 3.04Å; H62-N64 PolarHBondContact ND1-N 2.95Å; H62-N64 PolarHBondContact O-N 3.3Å; H62-G65 PolarHBondContact O-N 3.06Å; H62-W66 HydrophobicContact CB-CD2 3.97Å; H62-W66 HydrophobicContact CB-CG 4.06Å; H62-W66 HydrophobicContact CB-CZ2 4.14Å; H62-W66 WeakPolarHBondContact CB-O 3.3Å; H62-W66 AromaticContact CE1-CH2 3.8Å; H62-W66 AromaticContact CE1-CZ2 3.39Å; H62-W66 WeakPolarHBondContact CE1-CZ2 3.29Å; H62-W66 AromaticContact CG-CE2 3.45Å; H62-W66 VanDerWaalsContact CG-CE2 3.45Å; H62-W66 AromaticContact CG-CZ2 3.49Å; H62-W66 VanDerWaalsContact CG-CZ2 3.49Å; H62-W66 AromaticContact CG-NE1 3.57Å; H62-W66 PolarHBondContact N-O 3Å; H62-W66 AromaticContact ND1-CE2 3.44Å; H62-W66 AromaticContact ND1-CH2 3.49Å; H62-W66 WeakPolarHBondContact ND1-CH2 3.27Å; H62-W66 AromaticContact ND1-CZ2 3.04Å; H62-W66 WeakPolarHBondContact ND1-CZ2 3.41Å; H62-W66 AromaticContact NE2-CZ2 3.98Å; H62-S117 PolarHBondContact CE1-OG 3.02Å; H62-F121 AromaticContact NE2-CE2 3.88Å
63	P	84.4	Confident	90.8	Very high	14 Å²	14	31.7 Å²	31.7	9%	0.091	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.2	-178.3	-26.8	37	0	0	0	114.7	F29 S105 R107	F29-P63 HydrophobicContact CB-CG 4.06Å; F29-P63 HydrophobicContact CD2-CG 3.52Å; F29-P63 HydrophobicContact CE2-CG 4.08Å; F29-P63 HydrophobicContact CG-CG 3.83Å; P63-S105 PolarHBondContact O-OG 3.28Å; P63-R107 HydrophobicContact CB-CB 3.88Å
64	N	83.6	Confident	91	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.043	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-1.9	175.5	-63.7	-20	0	0	0	113.6	H62 W66 F97 S117	H62-N64 PolarHBondContact CE1-ND2 3.04Å; H62-N64 PolarHBondContact ND1-N 2.95Å; H62-N64 PolarHBondContact O-N 3.3Å; N64-W66 HydrophobicContact CB-CE3 3.78Å; N64-W66 HydrophobicContact CB-CH2 3.52Å; N64-W66 HydrophobicContact CB-CZ2 4.34Å; N64-W66 HydrophobicContact CB-CZ3 3.18Å; N64-W66 WeakPolarHBondContact ND2-CH2 3.04Å; N64-F97 HydrophobicContact CB-CD2 4.02Å; N64-F97 HydrophobicContact CB-CE2 4.4Å; N64-F97 WeakPolarHBondContact O-CA 3.5Å; N64-F97 WeakPolarHBondContact O-CB 3.42Å; N64-F97 WeakPolarHBondContact O-CD2 3.19Å; N64-S117 PolarHBondContact ND2-OG 2.7Å
65	G	88	Confident	91.1	Very high	11 Å²	11	25.6 Å²	25.6	11%	0.113	15%	0.147	C	C	.	.	S	Bend	trans	114.1	-7.5	165.2	0	0	0	0	0	117.9	R61 H62 N96	R61-G65 PolarHBondContact NH1-O 2.86Å; H62-G65 PolarHBondContact O-N 3.06Å; G65-N96 PolarHBondContact O-N 3Å
66	W	91.6	Very high	91.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.123	C	C	.	.			trans	-96.7	151.3	-179.1	60.3	84.7	0	0	0	113.4	F37 R61 H62 N64 H70 F97 R118 F121 F122	F37-W66 AromaticContact CD1-CD1 3.83Å; F37-W66 AromaticContact CD1-NE1 3.74Å; F37-W66 AromaticContact CE1-CD1 3.53Å; F37-W66 AromaticContact CE1-NE1 3.75Å; F37-W66 WeakPolarHBondContact CE1-O 3.31Å; R61-W66 WeakPolarHBondContact CA-O 3.28Å; H62-W66 HydrophobicContact CB-CD2 3.97Å; H62-W66 HydrophobicContact CB-CG 4.06Å; H62-W66 HydrophobicContact CB-CZ2 4.14Å; H62-W66 WeakPolarHBondContact CB-O 3.3Å; H62-W66 AromaticContact CE1-CH2 3.8Å; H62-W66 AromaticContact CE1-CZ2 3.39Å; H62-W66 WeakPolarHBondContact CE1-CZ2 3.29Å; H62-W66 AromaticContact CG-CE2 3.45Å; H62-W66 VanDerWaalsContact CG-CE2 3.45Å; H62-W66 AromaticContact CG-CZ2 3.49Å; H62-W66 VanDerWaalsContact CG-CZ2 3.49Å; H62-W66 AromaticContact CG-NE1 3.57Å; H62-W66 PolarHBondContact N-O 3Å; H62-W66 AromaticContact ND1-CE2 3.44Å; H62-W66 AromaticContact ND1-CH2 3.49Å; H62-W66 WeakPolarHBondContact ND1-CH2 3.27Å; H62-W66 AromaticContact ND1-CZ2 3.04Å; H62-W66 WeakPolarHBondContact ND1-CZ2 3.41Å; H62-W66 AromaticContact NE2-CZ2 3.98Å; N64-W66 HydrophobicContact CB-CE3 3.78Å; N64-W66 HydrophobicContact CB-CH2 3.52Å; N64-W66 HydrophobicContact CB-CZ2 4.34Å; N64-W66 HydrophobicContact CB-CZ3 3.18Å; N64-W66 WeakPolarHBondContact ND2-CH2 3.04Å; W66-H70 HydrophobicContact CB-CB 4.44Å; W66-F97 HydrophobicContact CE3-CB 4.27Å; W66-F97 HydrophobicContact CZ3-CD2 4.05Å; W66-F97 HydrophobicContact CZ3-CG 4.33Å; W66-R118 VanDerWaalsContact CE3-NH1 3.27Å; W66-R118 HydrophobicContact CH2-CB 4.45Å; W66-F121 AromaticContact CZ2-CD2 3.62Å; W66-F121 HydrophobicContact CZ2-CD2 3.62Å; W66-F121 HydrophobicContact CZ2-CE2 4.26Å; W66-F121 HydrophobicContact CZ2-CG 4.45Å; W66-F122 HydrophobicContact CB-CE2 4.32Å; W66-F122 HydrophobicContact CB-CZ 4.02Å; W66-F122 AromaticContact CD1-CE2 3.95Å; W66-F122 AromaticContact CD2-CE2 3.79Å; W66-F122 HydrophobicContact CD2-CE2 3.79Å; W66-F122 HydrophobicContact CD2-CZ 4.37Å; W66-F122 HydrophobicContact CE3-CE2 4.27Å; W66-F122 AromaticContact CG-CE2 3.79Å; W66-F122 HydrophobicContact CG-CE2 3.79Å; W66-F122 AromaticContact CG-CZ 3.97Å; W66-F122 HydrophobicContact CG-CZ 3.97Å
67	C	93.2	Very high	91.7	Very high	3 Å²	3	23 Å²	23	2%	0.02	12%	0.12	C	C	.	.			trans	-89.3	162.1	170.6	-56.3	0	0	0	0	112.9	L69 H70 C93	C67-L69 PolarHBondContact O-N 2.93Å; C67-H70 PolarHBondContact N-ND1 3.46Å; C67-H70 PolarHBondContact O-N 3.05Å; C67-H70 VanDerWaalsContact O-N 3.16Å; C67-C93 HydrophobicContact CB-CB 4.4Å
68	P	94.2	Very high	91.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-54.8	-33.6	175.7	-26.4	34.5	0	0	0	113.5	L36 F37 A40 P58 K60 H70 V71 A72 L84	L36-P68 HydrophobicContact CD2-CB 4.39Å; L36-P68 HydrophobicContact CD2-CG 3.75Å; L36-P68 HydrophobicContact CG-CB 4.28Å; L36-P68 HydrophobicContact CG-CG 4.06Å; F37-P68 HydrophobicContact CD1-CB 4.44Å; F37-P68 HydrophobicContact CD1-CG 4.28Å; F37-P68 HydrophobicContact CE1-CB 4.39Å; F37-P68 HydrophobicContact CE1-CG 3.87Å; F37-P68 HydrophobicContact CE2-CG 4.2Å; F37-P68 HydrophobicContact CZ-CG 3.81Å; A40-P68 HydrophobicContact CB-CB 4.28Å; P58-P68 WeakPolarHBondContact O-CD 3.37Å; K60-P68 WeakPolarHBondContact O-CD 3.21Å; P68-H70 VanDerWaalsContact C-N 3.33Å; P68-H70 PolarHBondContact O-N 2.55Å; P68-V71 WeakPolarHBondContact O-CB 3.37Å; P68-V71 PolarHBondContact O-N 3.11Å; P68-V71 VanDerWaalsContact O-N 3.17Å; P68-A72 PolarHBondContact O-N 3.26Å; P68-L84 HydrophobicContact CB-CD1 4.01Å; P68-L84 HydrophobicContact CB-CD2 4.2Å
69	L	95.4	Very high	92.2	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-62.1	-36.4	179.7	-166	67.5	0	0	0	113	C67 V71 A72 A73 I81 L84 L85 D90 A137 L153	C67-L69 PolarHBondContact O-N 2.93Å; L69-V71 VanDerWaalsContact C-N 3.32Å; L69-V71 PolarHBondContact O-N 2.86Å; L69-A72 PolarHBondContact O-N 3.15Å; L69-A73 VanDerWaalsContact O-CB 3.28Å; L69-A73 WeakPolarHBondContact O-CB 3.28Å; L69-A73 PolarHBondContact O-N 3.1Å; L69-I81 HydrophobicContact CD1-CB 4.34Å; L69-I81 HydrophobicContact CD1-CG1 4.18Å; L69-I81 HydrophobicContact CD1-CG2 4.07Å; L69-L84 HydrophobicContact CD1-CB 4.37Å; L69-L84 HydrophobicContact CD1-CD1 4.37Å; L69-L85 HydrophobicContact CD1-CD1 4.33Å; L69-L85 HydrophobicContact CD1-CD2 4.2Å; L69-L85 HydrophobicContact CD1-CG 4.05Å; L69-L85 HydrophobicContact CD2-CD2 3.88Å; L69-D90 WeakPolarHBondContact CD2-O 3.44Å; L69-A137 HydrophobicContact CB-CB 4.42Å; L69-A137 HydrophobicContact CD2-CB 3.69Å; L69-A137 HydrophobicContact CG-CB 3.65Å; L69-L153 HydrophobicContact CD1-CD2 4.23Å; L69-L153 HydrophobicContact CD2-CD2 4.11Å; L69-L153 HydrophobicContact CG-CD2 4.28Å
70	H	95.5	Very high	92.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-63.8	-40.2	175.7	-56.3	128.1	0	0	0	111.8	W66 C67 P68 A73 M74 C93 F122 Y140	W66-H70 HydrophobicContact CB-CB 4.44Å; C67-H70 PolarHBondContact N-ND1 3.46Å; C67-H70 PolarHBondContact O-N 3.05Å; C67-H70 VanDerWaalsContact O-N 3.16Å; P68-H70 VanDerWaalsContact C-N 3.33Å; P68-H70 PolarHBondContact O-N 2.55Å; H70-A73 PolarHBondContact O-N 2.97Å; H70-M74 WeakPolarHBondContact O-CB 3.49Å; H70-M74 PolarHBondContact O-N 3.24Å; H70-C93 VanDerWaalsContact CE1-SG 3.54Å; H70-C93 PolarHBondContact NE2-O 3.19Å; H70-C93 PolarHBondContact NE2-SG 3.3Å; H70-C93 VanDerWaalsContact NE2-SG 3.36Å; H70-F122 HydrophobicContact CB-CE1 3.97Å; H70-F122 HydrophobicContact CB-CZ 3.8Å; H70-Y140 HydrophobicContact CB-CD2 3.84Å; H70-Y140 HydrophobicContact CB-CE2 3.94Å; H70-Y140 AromaticContact CD2-CD2 3.86Å; H70-Y140 AromaticContact CD2-CE2 3.84Å
71	V	94.5	Very high	92.7	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.8	-46.8	178.9	178.2	0	0	0	0	109.9	F37 R41 P68 L69 A73 M74 N75 F121 F122	F37-V71 HydrophobicContact CD1-CG2 3.92Å; R41-V71 HydrophobicContact CB-CG1 3.68Å; R41-V71 HydrophobicContact CG-CG1 4.37Å; P68-V71 WeakPolarHBondContact O-CB 3.37Å; P68-V71 PolarHBondContact O-N 3.11Å; P68-V71 VanDerWaalsContact O-N 3.17Å; L69-V71 VanDerWaalsContact C-N 3.32Å; L69-V71 PolarHBondContact O-N 2.86Å; V71-A73 VanDerWaalsContact C-N 3.3Å; V71-A73 PolarHBondContact O-N 3.4Å; V71-M74 PolarHBondContact O-N 3.09Å; V71-N75 PolarHBondContact O-N 2.95Å; V71-N75 PolarHBondContact O-ND2 3.33Å; V71-F121 HydrophobicContact CG1-CB 4.11Å; V71-F121 HydrophobicContact CG1-CD1 4.15Å; V71-F121 HydrophobicContact CG2-CB 3.83Å; V71-F121 HydrophobicContact CG2-CD1 4.45Å; V71-F121 HydrophobicContact CG2-CG 4.33Å; V71-F122 HydrophobicContact CG2-CE2 4Å; V71-F122 HydrophobicContact CG2-CZ 4.19Å
72	A	95.7	Very high	92.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60.3	-41.2	175.9	0	0	0	0	0	111.9	A40 P68 L69 N75 G76 C77 A80 I81 L84	A40-A72 HydrophobicContact CB-CB 4.2Å; P68-A72 PolarHBondContact O-N 3.26Å; L69-A72 PolarHBondContact O-N 3.15Å; A72-N75 PolarHBondContact O-N 3.49Å; A72-G76 PolarHBondContact O-N 3.42Å; A72-C77 HydrophobicContact CB-CB 4.19Å; A72-C77 WeakPolarHBondContact O-CB 3.34Å; A72-C77 PolarHBondContact O-N 3.07Å; A72-A80 HydrophobicContact CB-CB 4.04Å; A72-I81 HydrophobicContact CB-CG1 3.72Å; A72-L84 HydrophobicContact CB-CD1 4.33Å
73	A	95.3	Very high	93.3	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-65	-47.8	178.7	0	0	0	0	0	113.4	L69 H70 V71 N75 G76 I81 A137 A141 H146 L153	L69-A73 VanDerWaalsContact O-CB 3.28Å; L69-A73 WeakPolarHBondContact O-CB 3.28Å; L69-A73 PolarHBondContact O-N 3.1Å; H70-A73 PolarHBondContact O-N 2.97Å; V71-A73 VanDerWaalsContact C-N 3.3Å; V71-A73 PolarHBondContact O-N 3.4Å; A73-N75 VanDerWaalsContact C-N 3.25Å; A73-N75 PolarHBondContact O-N 2.94Å; A73-G76 PolarHBondContact O-N 3.13Å; A73-G76 VanDerWaalsContact O-N 3.14Å; A73-I81 HydrophobicContact CB-CD1 4.42Å; A73-A137 HydrophobicContact CB-CB 4.06Å; A73-A137 WeakPolarHBondContact CB-O 3.48Å; A73-A141 HydrophobicContact CB-CB 4.22Å; A73-H146 PolarHBondContact O-CD2 2.8Å; A73-L153 HydrophobicContact CB-CD1 4.3Å
74	M	93.7	Very high	93.8	Very high	23 Å²	23	16 Å²	16	11%	0.113	9%	0.088	C	C	.	.	H	α-helix	trans	-64.1	-30.3	179.2	-174.8	66.8	-166.7	0	0	112.7	H70 V71 F122 L126 Y140 L143 H146	H70-M74 WeakPolarHBondContact O-CB 3.49Å; H70-M74 PolarHBondContact O-N 3.24Å; V71-M74 PolarHBondContact O-N 3.09Å; M74-F122 HydrophobicContact CB-CD1 3.72Å; M74-F122 HydrophobicContact CB-CE1 4.27Å; M74-F122 HydrophobicContact CG-CB 4.03Å; M74-F122 HydrophobicContact CG-CD1 3.72Å; M74-F122 HydrophobicContact CG-CG 4.3Å; M74-F122 WeakPolarHBondContact CG-O 3.47Å; M74-L126 HydrophobicContact CE-CD2 3.63Å; M74-L126 HydrophobicContact CE-CG 4.01Å; M74-L126 HydrophobicContact SD-CD2 4.02Å; M74-Y140 HydrophobicContact CB-CD1 4.44Å; M74-Y140 HydrophobicContact CB-CG 4.48Å; M74-Y140 HydrophobicContact SD-CD1 3.94Å; M74-L143 HydrophobicContact SD-CD2 4.43Å; M74-H146 PolarHBondContact O-CD2 3.13Å; M74-H146 PolarHBondContact O-NE2 3.35Å
75	N	93.6	Very high	94.3	Very high	51 Å²	51	16.3 Å²	16.3	27%	0.273	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	7.5	178.6	-66.6	-86.5	0	0	0	112.8	V71 A72 A73 C77 F121	V71-N75 PolarHBondContact O-N 2.95Å; V71-N75 PolarHBondContact O-ND2 3.33Å; A72-N75 PolarHBondContact O-N 3.49Å; A73-N75 VanDerWaalsContact C-N 3.25Å; A73-N75 PolarHBondContact O-N 2.94Å; N75-C77 PolarHBondContact O-N 3.38Å; N75-C77 PolarHBondContact O-SG 2.94Å; N75-F121 PolarHBondContact ND2-O 3.44Å
76	G	93.2	Very high	94.6	Very high	18 Å²	18	21.1 Å²	21.1	19%	0.186	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.8	21.9	177.7	0	0	0	0	0	114.7	A72 A73 A78 H146	A72-G76 PolarHBondContact O-N 3.42Å; A73-G76 PolarHBondContact O-N 3.13Å; A73-G76 VanDerWaalsContact O-N 3.14Å; G76-A78 VanDerWaalsContact C-N 3.33Å; G76-A78 PolarHBondContact O-N 3.19Å; G76-H146 WeakPolarHBondContact CA-CD2 3.41Å; G76-H146 PolarHBondContact N-CD2 2.9Å; G76-H146 PolarHBondContact N-NE2 2.86Å
77	C	95.2	Very high	94.7	Very high	8 Å²	8	23.4 Å²	23.4	5%	0.054	13%	0.125	C	C	.	.			trans	-81	73	-172.9	-65.6	0	0	0	0	111.7	A40 R41 N43 A72 N75 K79 A80 I81	A40-C77 WeakPolarHBondContact O-CB 3.48Å; A40-C77 PolarHBondContact O-SG 3.48Å; R41-C77 PolarHBondContact O-SG 3.01Å; N43-C77 HydrophobicContact CB-CB 3.75Å; N43-C77 VanDerWaalsContact OD1-CA 3.31Å; N43-C77 WeakPolarHBondContact OD1-CA 3.3Å; N43-C77 WeakPolarHBondContact OD1-CB 3.4Å; N43-C77 PolarHBondContact OD1-O 3.36Å; A72-C77 HydrophobicContact CB-CB 4.19Å; A72-C77 WeakPolarHBondContact O-CB 3.34Å; A72-C77 PolarHBondContact O-N 3.07Å; N75-C77 PolarHBondContact O-N 3.38Å; N75-C77 PolarHBondContact O-SG 2.94Å; C77-K79 VanDerWaalsContact C-N 3.3Å; C77-K79 PolarHBondContact O-N 3.33Å; C77-A80 HydrophobicContact CB-CB 3.93Å; C77-A80 WeakPolarHBondContact O-CB 3.35Å; C77-A80 PolarHBondContact O-N 2.88Å; C77-I81 WeakPolarHBondContact O-CG1 3.47Å; C77-I81 PolarHBondContact O-N 3.27Å
78	A	94.1	Very high	94.6	Very high	11 Å²	11	25.6 Å²	25.6	9%	0.091	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-34	-174.5	0	0	0	0	0	114.2	G76 I81 N82 E148	G76-A78 VanDerWaalsContact C-N 3.33Å; G76-A78 PolarHBondContact O-N 3.19Å; A78-I81 PolarHBondContact O-N 3.49Å; A78-N82 PolarHBondContact O-N 2.99Å; A78-N82 VanDerWaalsContact O-N 3.15Å; A78-N82 PolarHBondContact O-ND2 3.41Å; A78-E148 HydrophobicContact CB-CB 3.74Å
79	K	95	Very high	94.5	Very high	135 Å²	135	26.2 Å²	26.2	59%	0.587	15%	0.154	S	C	*	.	H	α-helix	trans	-70.1	-43.1	177.8	-60.5	-178.8	-179.6	178.7	0	110.9	N43 C77 I81 N82 V83	N43-K79 WeakPolarHBondContact OD1-CB 3.11Å; N43-K79 PolarHBondContact OD1-N 3.22Å; N43-K79 VanDerWaalsContact OD1-N 3.09Å; C77-K79 VanDerWaalsContact C-N 3.3Å; C77-K79 PolarHBondContact O-N 3.33Å; K79-I81 VanDerWaalsContact C-N 3.33Å; K79-I81 PolarHBondContact O-N 2.92Å; K79-N82 PolarHBondContact O-N 3.33Å; K79-V83 WeakPolarHBondContact O-CG2 3.5Å; K79-V83 PolarHBondContact O-N 3.36Å; K79-V83 VanDerWaalsContact O-N 3.13Å
80	A	94.9	Very high	94.4	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.2	-42.4	174.1	0	0	0	0	0	112.2	N43 I48 A72 C77 V83 L84	N43-A80 PolarHBondContact OD1-N 2.95Å; I48-A80 HydrophobicContact CD1-CB 3.37Å; A72-A80 HydrophobicContact CB-CB 4.04Å; C77-A80 HydrophobicContact CB-CB 3.93Å; C77-A80 WeakPolarHBondContact O-CB 3.35Å; C77-A80 PolarHBondContact O-N 2.88Å; A80-V83 PolarHBondContact O-N 3.04Å; A80-L84 WeakPolarHBondContact O-CB 3.5Å; A80-L84 VanDerWaalsContact O-CG 3.27Å; A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 3.38Å
81	I	95.9	Very high	94.4	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.2	-52	176.2	-70.4	166.9	0	0	0	111.1	L69 A72 A73 C77 A78 K79 V83 L84 L85 A149 A152 L153	L69-I81 HydrophobicContact CD1-CB 4.34Å; L69-I81 HydrophobicContact CD1-CG1 4.18Å; L69-I81 HydrophobicContact CD1-CG2 4.07Å; A72-I81 HydrophobicContact CB-CG1 3.72Å; A73-I81 HydrophobicContact CB-CD1 4.42Å; C77-I81 WeakPolarHBondContact O-CG1 3.47Å; C77-I81 PolarHBondContact O-N 3.27Å; A78-I81 PolarHBondContact O-N 3.49Å; K79-I81 VanDerWaalsContact C-N 3.33Å; K79-I81 PolarHBondContact O-N 2.92Å; I81-V83 PolarHBondContact O-N 3.42Å; I81-L84 PolarHBondContact O-N 2.85Å; I81-L85 HydrophobicContact CG2-CD1 3.55Å; I81-L85 HydrophobicContact CG2-CG 4.44Å; I81-L85 WeakPolarHBondContact O-CB 3.42Å; I81-L85 VanDerWaalsContact O-CG 3.26Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 3.18Å; I81-A149 HydrophobicContact CD1-CB 3.48Å; I81-A149 VanDerWaalsContact CD1-CB 3.48Å; I81-A152 HydrophobicContact CB-CB 4.18Å; I81-A152 HydrophobicContact CG2-CB 3.66Å; I81-L153 HydrophobicContact CD1-CG 4.41Å; I81-L153 HydrophobicContact CG2-CD2 3.81Å; I81-L153 HydrophobicContact CG2-CG 4.01Å
82	N	96.2	Very high	94.4	Very high	41 Å²	41	32.7 Å²	32.7	22%	0.219	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-48.3	-179.1	-71.1	-58.2	0	0	0	111.2	A78 K79 L84 L85 D86 H156	A78-N82 PolarHBondContact O-N 2.99Å; A78-N82 VanDerWaalsContact O-N 3.15Å; A78-N82 PolarHBondContact O-ND2 3.41Å; K79-N82 PolarHBondContact O-N 3.33Å; N82-L84 PolarHBondContact O-N 3.26Å; N82-L85 PolarHBondContact O-N 2.87Å; N82-D86 WeakPolarHBondContact O-CB 3.07Å; N82-D86 PolarHBondContact O-N 2.96Å; N82-H156 PolarHBondContact OD1-NE2 3.31Å
83	V	95.5	Very high	94.2	Very high	24 Å²	24	32.9 Å²	32.9	15%	0.145	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-40.6	-179.1	177.1	0	0	0	0	112.1	I48 Q49 K79 A80 I81 L85 N87	I48-V83 HydrophobicContact CB-CG1 4.17Å; I48-V83 HydrophobicContact CG2-CB 4.34Å; I48-V83 HydrophobicContact CG2-CG1 3.67Å; Q49-V83 HydrophobicContact CB-CG1 4.3Å; K79-V83 WeakPolarHBondContact O-CG2 3.5Å; K79-V83 PolarHBondContact O-N 3.36Å; K79-V83 VanDerWaalsContact O-N 3.13Å; A80-V83 PolarHBondContact O-N 3.04Å; I81-V83 PolarHBondContact O-N 3.42Å; V83-L85 VanDerWaalsContact C-N 3.34Å; V83-L85 PolarHBondContact O-N 3.39Å; V83-N87 PolarHBondContact O-N 2.92Å; V83-N87 VanDerWaalsContact O-N 3.15Å; V83-N87 PolarHBondContact O-ND2 3.43Å
84	L	95	Very high	94.1	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-44.9	176.1	-74.5	168.7	0	0	0	111.3	L36 A40 I48 P58 P68 L69 A72 A80 I81 N82 N87 G88 A89	L36-L84 HydrophobicContact CD1-CD2 4.19Å; A40-L84 HydrophobicContact CB-CD1 4.3Å; I48-L84 HydrophobicContact CD1-CG 4.41Å; I48-L84 HydrophobicContact CG2-CD2 3.74Å; I48-L84 HydrophobicContact CG2-CG 4.06Å; P58-L84 HydrophobicContact CB-CD2 4.15Å; P68-L84 HydrophobicContact CB-CD1 4.01Å; P68-L84 HydrophobicContact CB-CD2 4.2Å; L69-L84 HydrophobicContact CD1-CB 4.37Å; L69-L84 HydrophobicContact CD1-CD1 4.37Å; A72-L84 HydrophobicContact CB-CD1 4.33Å; A80-L84 WeakPolarHBondContact O-CB 3.5Å; A80-L84 VanDerWaalsContact O-CG 3.27Å; A80-L84 WeakPolarHBondContact O-CG 3.4Å; A80-L84 PolarHBondContact O-N 3.38Å; I81-L84 PolarHBondContact O-N 2.85Å; N82-L84 PolarHBondContact O-N 3.26Å; L84-N87 CarbonylContact O-C 3.57Å; L84-N87 PolarHBondContact O-N 3.41Å; L84-G88 PolarHBondContact O-N 3.31Å; L84-A89 HydrophobicContact CB-CB 4.03Å; L84-A89 WeakPolarHBondContact O-CB 3.44Å; L84-A89 PolarHBondContact O-N 2.95Å
85	L	94.9	Very high	94	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-71.4	-38.6	-178.5	-66.5	169.4	0	0	0	112.5	L69 I81 N82 V83 N87 G88 A89 V91 L153 H156	L69-L85 HydrophobicContact CD1-CD1 4.33Å; L69-L85 HydrophobicContact CD1-CD2 4.2Å; L69-L85 HydrophobicContact CD1-CG 4.05Å; L69-L85 HydrophobicContact CD2-CD2 3.88Å; I81-L85 HydrophobicContact CG2-CD1 3.55Å; I81-L85 HydrophobicContact CG2-CG 4.44Å; I81-L85 WeakPolarHBondContact O-CB 3.42Å; I81-L85 VanDerWaalsContact O-CG 3.26Å; I81-L85 WeakPolarHBondContact O-CG 3.44Å; I81-L85 PolarHBondContact O-N 3.18Å; N82-L85 PolarHBondContact O-N 2.87Å; V83-L85 VanDerWaalsContact C-N 3.34Å; V83-L85 PolarHBondContact O-N 3.39Å; L85-N87 PolarHBondContact O-N 3.01Å; L85-G88 PolarHBondContact O-N 3.17Å; L85-A89 HydrophobicContact CD2-CB 4.16Å; L85-A89 WeakPolarHBondContact CD2-O 3.49Å; L85-V91 HydrophobicContact CD1-CG2 4.36Å; L85-V91 HydrophobicContact CD2-CB 3.73Å; L85-V91 HydrophobicContact CD2-CG2 3.97Å; L85-L153 HydrophobicContact CD1-CD2 4.18Å; L85-H156 HydrophobicContact CB-CB 4.36Å; L85-H156 HydrophobicContact CD1-CB 3.57Å; L85-H156 HydrophobicContact CG-CB 4.41Å
86	D	94.2	Very high	93.7	Very high	112 Å²	112	38.1 Å²	38.1	60%	0.599	21%	0.211	S	C	*	.	H	α-helix	trans	-60.5	-29.6	173.3	-74	-28.9	0	0	0	111.7	N82 H156	N82-D86 WeakPolarHBondContact O-CB 3.07Å; N82-D86 PolarHBondContact O-N 2.96Å; D86-H156 IonicContact OD1-CE1 2.75Å; D86-H156 PolarHBondContact OD1-CE1 3.4Å; D86-H156 VanDerWaalsContact OD1-CE1 3.27Å; D86-H156 IonicContact OD1-NE2 3.41Å
87	N	93.5	Very high	93.4	Very high	47 Å²	47	38 Å²	38	25%	0.251	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	13.8	175.7	-72.9	-78.2	0	0	0	114	Q49 V52 V83 L84 L85	Q49-N87 PolarHBondContact NE2-OD1 3.47Å; Q49-N87 VanDerWaalsContact NE2-OD1 3.17Å; Q49-N87 PolarHBondContact OE1-ND2 3.27Å; V52-N87 HydrophobicContact CG1-CB 3.78Å; V52-N87 HydrophobicContact CG2-CB 4.38Å; V83-N87 PolarHBondContact O-N 2.92Å; V83-N87 VanDerWaalsContact O-N 3.15Å; V83-N87 PolarHBondContact O-ND2 3.43Å; L84-N87 CarbonylContact O-C 3.57Å; L84-N87 PolarHBondContact O-N 3.41Å; L85-N87 PolarHBondContact O-N 3.01Å
88	G	91.1	Very high	92.6	Very high	50 Å²	50	40.1 Å²	40.1	52%	0.515	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	87	22.6	172.9	0	0	0	0	0	115.4	N59 L84 L85	N59-G88 PolarHBondContact ND2-O 3.47Å; L84-G88 PolarHBondContact O-N 3.31Å; L85-G88 PolarHBondContact O-N 3.17Å
89	A	92.8	Very high	91.7	Very high	12 Å²	12	40.5 Å²	40.5	10%	0.099	22%	0.223	C	C	.	.			trans	-60.8	137.8	164.7	0	0	0	0	0	110.8	P58 N59 L84 L85 V91	P58-A89 HydrophobicContact CB-CB 4.13Å; N59-A89 WeakPolarHBondContact OD1-CA 3.04Å; L84-A89 HydrophobicContact CB-CB 4.03Å; L84-A89 WeakPolarHBondContact O-CB 3.44Å; L84-A89 PolarHBondContact O-N 2.95Å; L85-A89 HydrophobicContact CD2-CB 4.16Å; L85-A89 WeakPolarHBondContact CD2-O 3.49Å; A89-V91 PolarHBondContact O-N 3.38Å
90	D	93.5	Very high	90.5	Very high	81 Å²	81	34.7 Å²	34.7	43%	0.433	20%	0.2	S	C	.	.			trans	-69.3	112.5	171.7	177.4	14.9	0	0	0	109.5	N59 L69 D92 C93	N59-D90 PolarHBondContact OD1-N 2.95Å; L69-D90 WeakPolarHBondContact CD2-O 3.44Å; D90-D92 PolarHBondContact O-N 2.94Å; D90-D92 PolarHBondContact OD1-N 3.36Å; D90-D92 VanDerWaalsContact OD1-N 3.1Å; D90-C93 HydrophobicContact CB-CB 4.21Å; D90-C93 WeakPolarHBondContact O-CB 3.41Å; D90-C93 PolarHBondContact O-N 3.07Å; D90-C93 PolarHBondContact OD2-N 3.23Å
91	V	94.5	Very high	89.3	Confident	21 Å²	21	44.6 Å²	44.6	13%	0.127	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-29	-178.2	69.7	0	0	0	0	112.5	L85 A89 L153 H156 A158	L85-V91 HydrophobicContact CD1-CG2 4.36Å; L85-V91 HydrophobicContact CD2-CB 3.73Å; L85-V91 HydrophobicContact CD2-CG2 3.97Å; A89-V91 PolarHBondContact O-N 3.38Å; V91-L153 HydrophobicContact CG2-CD2 4.2Å; V91-H156 HydrophobicContact CG2-CB 4.43Å; V91-A158 HydrophobicContact CG2-CB 3.52Å
92	D	93.6	Very high	87.9	Confident	37 Å²	37	45.9 Å²	45.9	20%	0.198	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	19.8	-174.3	-66	-37.9	0	0	0	112.4	D90 R94 D159 I162	D90-D92 PolarHBondContact O-N 2.94Å; D90-D92 PolarHBondContact OD1-N 3.36Å; D90-D92 VanDerWaalsContact OD1-N 3.1Å; D92-R94 PolarHBondContact O-N 3.19Å; D92-D159 PolarHBondContact OD1-N 3.1Å; D92-D159 WeakPolarHBondContact OD2-CB 3.39Å; D92-I162 HydrophobicContact CB-CD1 3.65Å
93	C	92.5	Very high	86	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.02	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-54.8	134.7	175.4	69.8	0	0	0	0	109.9	C67 H70 D90 T136	C67-C93 HydrophobicContact CB-CB 4.4Å; H70-C93 VanDerWaalsContact CE1-SG 3.54Å; H70-C93 PolarHBondContact NE2-O 3.19Å; H70-C93 PolarHBondContact NE2-SG 3.3Å; H70-C93 VanDerWaalsContact NE2-SG 3.36Å; D90-C93 HydrophobicContact CB-CB 4.21Å; D90-C93 WeakPolarHBondContact O-CB 3.41Å; D90-C93 PolarHBondContact O-N 3.07Å; D90-C93 PolarHBondContact OD2-N 3.23Å; C93-T136 WeakPolarHBondContact O-CA 3.42Å
94	R	93.6	Very high	84.1	Confident	108 Å²	108	56.6 Å²	56.6	41%	0.408	31%	0.306	S	S	.	.	B	Isolated β-bridge	trans	-99.1	139	-179.8	-63.6	-173.6	-177.8	-155.5	-1	111.6	R61 D92 T136	R61-R94 PolarHBondContact NH1-O 3.49Å; R61-R94 PolarHBondContact NH2-O 2.91Å; D92-R94 PolarHBondContact O-N 3.19Å; R94-T136 HydrophobicContact CG-CG2 4.38Å
95	D	91.2	Very high	82.5	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-69.9	128.3	172.9	-169.3	1.1	0	0	0	111.2	F97 R118 K133 G134 T135 Y140	D95-F97 WeakPolarHBondContact OD1-CB 3.47Å; D95-F97 PolarHBondContact OD1-N 3.15Å; D95-R118 IonicContact OD1-NH1 2.72Å; D95-R118 IonicContact OD2-CZ 3.22Å; D95-R118 IonicContact OD2-NH1 3.05Å; D95-R118 PolarHBondContact OD2-NH1 3.27Å; D95-R118 IonicContact OD2-NH2 3.38Å; D95-R118 PolarHBondContact OD2-NH2 3.25Å; D95-K133 CarbonylContact O-C 3.45Å; D95-K133 WeakPolarHBondContact O-CA 3.47Å; D95-G134 PolarHBondContact O-N 3.35Å; D95-T135 PolarHBondContact N-O 3.43Å; D95-Y140 HydrophobicContact CB-CE2 4.3Å; D95-Y140 PolarHBondContact OD2-OH 3.18Å
96	N	88.3	Confident	80.7	Confident	76 Å²	76	64.8 Å²	64.8	41%	0.406	35%	0.346	S	S	.	.			trans	-99.3	3.5	178.4	-68.4	-11.2	0	0	0	113	R61 G65 T98	R61-N96 PolarHBondContact NH1-ND2 3.39Å; G65-N96 PolarHBondContact O-N 3Å; N96-T98 WeakPolarHBondContact O-CG2 3.47Å; N96-T98 PolarHBondContact O-N 2.88Å; N96-T98 VanDerWaalsContact O-N 3.13Å
97	F	85.4	Confident	79.3	Confident	17 Å²	17	64.7 Å²	64.7	8%	0.075	34%	0.337	C	S	.	.			trans	-68	110	179.1	-175.9	-109.8	0	0	0	111.4	N64 W66 D95 K114 R118	N64-F97 HydrophobicContact CB-CD2 4.02Å; N64-F97 HydrophobicContact CB-CE2 4.4Å; N64-F97 WeakPolarHBondContact O-CA 3.5Å; N64-F97 WeakPolarHBondContact O-CB 3.42Å; N64-F97 WeakPolarHBondContact O-CD2 3.19Å; W66-F97 HydrophobicContact CE3-CB 4.27Å; W66-F97 HydrophobicContact CZ3-CD2 4.05Å; W66-F97 HydrophobicContact CZ3-CG 4.33Å; D95-F97 WeakPolarHBondContact OD1-CB 3.47Å; D95-F97 PolarHBondContact OD1-N 3.15Å; F97-K114 HydrophobicContact CE2-CB 4.38Å; F97-R118 HydrophobicContact CE1-CG 4.3Å
98	T	77.9	Confident	77.9	Confident	51 Å²	51	72.6 Å²	72.6	31%	0.313	37%	0.37	S	S	.	.			trans	-92.8	-15	-177.1	73.9	0	0	0	0	113.7	N96 D102 K133	N96-T98 WeakPolarHBondContact O-CG2 3.47Å; N96-T98 PolarHBondContact O-N 2.88Å; N96-T98 VanDerWaalsContact O-N 3.13Å; T98-D102 WeakPolarHBondContact OG1-CB 3.43Å; T98-D102 PolarHBondContact OG1-OD1 3.32Å; T98-D102 PolarHBondContact OG1-OD2 3.07Å; T98-K133 HydrophobicContact CG2-CD 3.7Å; T98-K133 HydrophobicContact CG2-CG 4.32Å
99	G	76	Confident	76.9	Confident	19 Å²	19	71 Å²	71	20%	0.196	35%	0.351	C	S	.	.			trans	138.6	-178	177.2	0	0	0	0	0	113.7	Y101 D102	G99-Y101 VanDerWaalsContact C-N 3.28Å; G99-Y101 PolarHBondContact O-N 3.07Å; G99-D102 PolarHBondContact O-N 3.46Å
100	A	69.9	Low	76.3	Confident	14 Å²	14	77.2 Å²	77.2	12%	0.116	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-30.9	-177.6	0	0	0	0	0	113.4	P111 L115	A100-P111 HydrophobicContact CB-CB 3.95Å; A100-P111 WeakPolarHBondContact O-CA 3.36Å; A100-P111 WeakPolarHBondContact O-CB 3.28Å; A100-L115 HydrophobicContact CB-CD1 3.89Å; A100-L115 HydrophobicContact CB-CD2 4.02Å; A100-L115 HydrophobicContact CB-CG 3.75Å
101	Y	70.1	Confident	75.6	Confident	207 Å²	207	75.6 Å²	75.6	81%	0.812	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	12.1	-176.3	-64	-78.1	0	0	0	113.9	G99 S103 P111	G99-Y101 VanDerWaalsContact C-N 3.28Å; G99-Y101 PolarHBondContact O-N 3.07Å; Y101-S103 PolarHBondContact O-N 3.13Å; Y101-S103 VanDerWaalsContact O-N 3.07Å; Y101-P111 HydrophobicContact CD1-CG 4.19Å; Y101-P111 HydrophobicContact CE1-CB 4.4Å; Y101-P111 HydrophobicContact CE1-CG 4.18Å
102	D	66.5	Low	75	Confident	27 Å²	27	79 Å²	79	14%	0.144	39%	0.386	C	S	.	.			trans	-60.9	113	179.6	-166.5	-4.7	0	0	0	111.7	T98 G99 Q104 K114	T98-D102 WeakPolarHBondContact OG1-CB 3.43Å; T98-D102 PolarHBondContact OG1-OD1 3.32Å; T98-D102 PolarHBondContact OG1-OD2 3.07Å; G99-D102 PolarHBondContact O-N 3.46Å; D102-Q104 VanDerWaalsContact C-N 3.32Å; D102-Q104 WeakPolarHBondContact OD1-CA 3.41Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.19Å; D102-Q104 PolarHBondContact OD1-N 3.25Å; D102-K114 PolarHBondContact O-NZ 3.49Å
103	S	55.5	Low	74.4	Confident	119 Å²	119	81 Å²	81	83%	0.832	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.6	174.4	52.5	0	0	0	0	113.1	Y101	Y101-S103 PolarHBondContact O-N 3.13Å; Y101-S103 VanDerWaalsContact O-N 3.07Å
104	Q	56.7	Low	73.9	Confident	171 Å²	171	81.4 Å²	81.4	80%	0.799	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-5.5	-179.4	-58.5	-163	-12.6	0	0	114.3	D102 E106	D102-Q104 VanDerWaalsContact C-N 3.32Å; D102-Q104 WeakPolarHBondContact OD1-CA 3.41Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.19Å; D102-Q104 PolarHBondContact OD1-N 3.25Å; Q104-E106 PolarHBondContact O-N 3.49Å
105	S	60.1	Low	73.4	Confident	20 Å²	20	78.2 Å²	78.2	14%	0.14	39%	0.387	C	S	.	.	S	Bend	trans	-66.7	134.4	175.8	174.5	0	0	0	0	110.7	P63 R107	P63-S105 PolarHBondContact O-OG 3.28Å; S105-R107 PolarHBondContact O-N 3.45Å; S105-R107 VanDerWaalsContact O-N 3.09Å; S105-R107 PolarHBondContact OG-N 3.2Å
106	E	58.8	Low	73.1	Confident	168 Å²	168	85.2 Å²	85.2	79%	0.785	41%	0.414	S	S	*	.	S	Bend	trans	-56.2	-26.8	176.4	-66.1	-176.5	170.8	0	0	112.3	Q104	Q104-E106 PolarHBondContact O-N 3.49Å
107	R	63.2	Low	73	Confident	110 Å²	110	82.3 Å²	82.3	42%	0.415	40%	0.399	S	S	.	.	S	Bend	trans	-95.1	113.8	176.7	-162.7	177.1	175.9	171.4	-2.1	109.9	P63 S105 A109	P63-R107 HydrophobicContact CB-CB 3.88Å; S105-R107 PolarHBondContact O-N 3.45Å; S105-R107 VanDerWaalsContact O-N 3.09Å; S105-R107 PolarHBondContact OG-N 3.2Å; R107-A109 HydrophobicContact CG-CB 3.96Å; R107-A109 PolarHBondContact O-N 3.47Å
108	K	65.6	Low	73.1	Confident	214 Å²	214	82.1 Å²	82.1	93%	0.93	40%	0.398	S	S	*	.			trans	-70	58.5	163.6	-66.8	-177.3	-179.2	175.9	0	110.7
109	A	69.7	Low	73.6	Confident	15 Å²	15	81.7 Å²	81.7	12%	0.124	39%	0.392	C	S	.	.			trans	-84	151.5	172.4	0	0	0	0	0	110.1	R107 E113 K114	R107-A109 HydrophobicContact CG-CB 3.96Å; R107-A109 PolarHBondContact O-N 3.47Å; A109-E113 WeakPolarHBondContact CA-OE2 3.17Å; A109-E113 HydrophobicContact CB-CB 4.29Å; A109-E113 WeakPolarHBondContact CB-OE2 3.44Å; A109-K114 HydrophobicContact CB-CG 3.97Å
110	F	79.3	Confident	74.2	Confident	144 Å²	144	84.3 Å²	84.3	63%	0.632	40%	0.399	S	S	*	.			trans	-63.3	146.1	173	-72.1	-78.7	0	0	0	110.1	I112 E113 K114	F110-I112 HydrophobicContact CB-CG2 4.28Å; F110-I112 PolarHBondContact O-N 3.2Å; F110-E113 HydrophobicContact CB-CG 4.16Å; F110-E113 PolarHBondContact N-OE2 2.91Å; F110-E113 WeakPolarHBondContact O-CB 3.44Å; F110-E113 PolarHBondContact O-N 2.79Å; F110-K114 PolarHBondContact O-N 3.48Å
111	P	79	Confident	75.1	Confident	46 Å²	46	83.7 Å²	83.7	30%	0.299	39%	0.394	S	S	.	.	H	α-helix	trans	-50.7	-35.8	179.9	-30.4	36.1	0	0	0	113.9	A100 Y101 K114 L115	A100-P111 HydrophobicContact CB-CB 3.95Å; A100-P111 WeakPolarHBondContact O-CA 3.36Å; A100-P111 WeakPolarHBondContact O-CB 3.28Å; Y101-P111 HydrophobicContact CD1-CG 4.19Å; Y101-P111 HydrophobicContact CE1-CB 4.4Å; Y101-P111 HydrophobicContact CE1-CG 4.18Å; P111-K114 PolarHBondContact O-N 2.89Å; P111-L115 WeakPolarHBondContact O-CG 3.23Å; P111-L115 PolarHBondContact O-N 3.26Å
112	I	82	Confident	76	Confident	92 Å²	92	74 Å²	74	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-69.2	-37	178.7	-159.8	163.1	0	0	0	113.1	F110 K114 L115 W116	F110-I112 HydrophobicContact CB-CG2 4.28Å; F110-I112 PolarHBondContact O-N 3.2Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-L115 PolarHBondContact O-N 3.22Å; I112-W116 HydrophobicContact CD1-CH2 4.17Å; I112-W116 HydrophobicContact CD1-CZ2 3.69Å; I112-W116 HydrophobicContact CG1-CD2 4.19Å; I112-W116 HydrophobicContact CG1-CH2 4.21Å; I112-W116 HydrophobicContact CG1-CZ2 3.74Å; I112-W116 HydrophobicContact CG2-CH2 4.4Å; I112-W116 HydrophobicContact CG2-CZ3 4.34Å; I112-W116 PolarHBondContact O-N 3.46Å
113	E	82.2	Confident	76.8	Confident	80 Å²	80	73.9 Å²	73.9	37%	0.374	36%	0.362	S	S	.	.	H	α-helix	trans	-67.6	-37.8	176.8	-65	174.7	160.5	0	0	111.2	A109 F110 L115 W116 S117	A109-E113 WeakPolarHBondContact CA-OE2 3.17Å; A109-E113 HydrophobicContact CB-CB 4.29Å; A109-E113 WeakPolarHBondContact CB-OE2 3.44Å; F110-E113 HydrophobicContact CB-CG 4.16Å; F110-E113 PolarHBondContact N-OE2 2.91Å; F110-E113 WeakPolarHBondContact O-CB 3.44Å; F110-E113 PolarHBondContact O-N 2.79Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 2.8Å; E113-W116 PolarHBondContact O-N 3Å; E113-S117 VanDerWaalsContact O-CB 3.3Å; E113-S117 WeakPolarHBondContact O-CB 3.34Å; E113-S117 PolarHBondContact O-N 2.93Å
114	K	81.9	Confident	78	Confident	11 Å²	11	74.2 Å²	74.2	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-42.5	174.6	-66.7	-176.9	180	177.7	0	111.2	F97 D102 A109 F110 P111 I112 R118	F97-K114 HydrophobicContact CE2-CB 4.38Å; D102-K114 PolarHBondContact O-NZ 3.49Å; A109-K114 HydrophobicContact CB-CG 3.97Å; F110-K114 PolarHBondContact O-N 3.48Å; P111-K114 PolarHBondContact O-N 2.89Å; I112-K114 VanDerWaalsContact C-N 3.35Å; K114-R118 WeakPolarHBondContact O-CB 3.4Å; K114-R118 PolarHBondContact O-N 2.83Å
115	L	82.9	Confident	78.9	Confident	41 Å²	41	69.3 Å²	69.3	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-44.2	176.4	-71	173.6	0	0	0	111.9	A100 P111 I112 E113 S117 R118 E119	A100-L115 HydrophobicContact CB-CD1 3.89Å; A100-L115 HydrophobicContact CB-CD2 4.02Å; A100-L115 HydrophobicContact CB-CG 3.75Å; P111-L115 WeakPolarHBondContact O-CG 3.23Å; P111-L115 PolarHBondContact O-N 3.26Å; I112-L115 PolarHBondContact O-N 3.22Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 2.8Å; L115-S117 PolarHBondContact O-N 2.99Å; L115-R118 WeakPolarHBondContact O-CB 3.35Å; L115-R118 PolarHBondContact O-N 3.27Å; L115-R118 VanDerWaalsContact O-N 3.16Å; L115-E119 WeakPolarHBondContact O-CG 3.26Å; L115-E119 PolarHBondContact O-N 3.46Å
116	W	85.2	Confident	79.9	Confident	148 Å²	148	69.5 Å²	69.5	56%	0.561	35%	0.353	S	S	*	.	H	α-helix	trans	-62.1	-43.8	175.7	-70.2	-24.9	0	0	0	112.4	I112 E113 R118 E119 E120	I112-W116 HydrophobicContact CD1-CH2 4.17Å; I112-W116 HydrophobicContact CD1-CZ2 3.69Å; I112-W116 HydrophobicContact CG1-CD2 4.19Å; I112-W116 HydrophobicContact CG1-CH2 4.21Å; I112-W116 HydrophobicContact CG1-CZ2 3.74Å; I112-W116 HydrophobicContact CG2-CH2 4.4Å; I112-W116 HydrophobicContact CG2-CZ3 4.34Å; I112-W116 PolarHBondContact O-N 3.46Å; E113-W116 PolarHBondContact O-N 3Å; W116-R118 VanDerWaalsContact C-N 3.27Å; W116-R118 PolarHBondContact O-N 3.48Å; W116-E119 PolarHBondContact O-N 2.88Å; W116-E120 VanDerWaalsContact O-CB 3.31Å; W116-E120 WeakPolarHBondContact O-CB 3.36Å; W116-E120 PolarHBondContact O-N 3.25Å
117	S	85.6	Confident	80.9	Confident	14 Å²	14	65.8 Å²	65.8	10%	0.098	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-39.3	174.3	176.5	0	0	0	0	111.3	H62 N64 E113 L115 E120 F121	H62-S117 PolarHBondContact CE1-OG 3.02Å; N64-S117 PolarHBondContact ND2-OG 2.7Å; E113-S117 VanDerWaalsContact O-CB 3.3Å; E113-S117 WeakPolarHBondContact O-CB 3.34Å; E113-S117 PolarHBondContact O-N 2.93Å; L115-S117 PolarHBondContact O-N 2.99Å; S117-E120 PolarHBondContact O-N 3.3Å; S117-F121 WeakPolarHBondContact O-CD2 3.35Å; S117-F121 PolarHBondContact O-N 3.08Å
118	R	87.4	Confident	81.5	Confident	13 Å²	13	68.3 Å²	68.3	5%	0.049	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-46.8	175.5	-173.9	64.8	-180	-159.7	-4.7	111.7	W66 D95 F97 K114 L115 W116 E120 F121 F122 Y140	W66-R118 VanDerWaalsContact CE3-NH1 3.27Å; W66-R118 HydrophobicContact CH2-CB 4.45Å; D95-R118 IonicContact OD1-NH1 2.72Å; D95-R118 IonicContact OD2-CZ 3.22Å; D95-R118 IonicContact OD2-NH1 3.05Å; D95-R118 PolarHBondContact OD2-NH1 3.27Å; D95-R118 IonicContact OD2-NH2 3.38Å; D95-R118 PolarHBondContact OD2-NH2 3.25Å; F97-R118 HydrophobicContact CE1-CG 4.3Å; K114-R118 WeakPolarHBondContact O-CB 3.4Å; K114-R118 PolarHBondContact O-N 2.83Å; L115-R118 WeakPolarHBondContact O-CB 3.35Å; L115-R118 PolarHBondContact O-N 3.27Å; L115-R118 VanDerWaalsContact O-N 3.16Å; W116-R118 VanDerWaalsContact C-N 3.27Å; W116-R118 PolarHBondContact O-N 3.48Å; R118-E120 VanDerWaalsContact C-N 3.3Å; R118-E120 PolarHBondContact O-N 3.42Å; R118-F121 PolarHBondContact O-N 3.18Å; R118-F122 HydrophobicContact CG-CD2 4.47Å; R118-F122 VanDerWaalsContact CZ-CE2 3.49Å; R118-F122 VanDerWaalsContact CZ-CZ 3.49Å; R118-F122 VanDerWaalsContact NH1-CE2 3.32Å; R118-F122 VanDerWaalsContact NH1-CZ 3.33Å; R118-F122 WeakPolarHBondContact O-CB 3.12Å; R118-F122 WeakPolarHBondContact O-CD2 3.26Å; R118-F122 PolarHBondContact O-N 3.17Å; R118-Y140 PolarHBondContact NH2-OH 3.34Å
119	E	87.7	Confident	82	Confident	42 Å²	42	65.9 Å²	65.9	20%	0.196	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-33.4	178.3	-72.2	-179.6	168.6	0	0	112.8	L115 W116 G123 R128	L115-E119 WeakPolarHBondContact O-CG 3.26Å; L115-E119 PolarHBondContact O-N 3.46Å; W116-E119 PolarHBondContact O-N 2.88Å; E119-G123 CarbonylContact O-C 3.5Å; E119-G123 WeakPolarHBondContact O-CA 3.28Å; E119-G123 PolarHBondContact O-N 2.86Å; E119-R128 IonicContact OE1-CZ 2.71Å; E119-R128 IonicContact OE1-NE 3.35Å; E119-R128 PolarHBondContact OE1-NE 3.01Å; E119-R128 IonicContact OE1-NH2 3.35Å; E119-R128 PolarHBondContact OE1-NH2 2.83Å; E119-R128 IonicContact OE2-NH2 3.11Å; E119-R128 PolarHBondContact OE2-NH2 3.29Å
120	E	88.6	Confident	82.3	Confident	74 Å²	74	67.8 Å²	67.8	35%	0.346	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-45.2	175.4	-179.4	175.7	-163.7	0	0	111.1	Y38 R41 W116 S117 R118	Y38-E120 HydrophobicContact CE1-CG 4.34Å; Y38-E120 VanDerWaalsContact CE1-OE1 3.22Å; Y38-E120 WeakPolarHBondContact CE1-OE1 3.26Å; Y38-E120 VanDerWaalsContact CZ-OE1 3.26Å; Y38-E120 PolarHBondContact OH-OE1 3.48Å; R41-E120 WeakPolarHBondContact CD-O 3.48Å; R41-E120 PolarHBondContact NE-O 3.17Å; R41-E120 VanDerWaalsContact NE-O 3.12Å; R41-E120 PolarHBondContact NH1-O 3.35Å; R41-E120 PolarHBondContact NH2-O 2.9Å; W116-E120 VanDerWaalsContact O-CB 3.31Å; W116-E120 WeakPolarHBondContact O-CB 3.36Å; W116-E120 PolarHBondContact O-N 3.25Å; S117-E120 PolarHBondContact O-N 3.3Å; R118-E120 VanDerWaalsContact C-N 3.3Å; R118-E120 PolarHBondContact O-N 3.42Å
121	F	89	Confident	82.4	Confident	1 Å²	1	63 Å²	63	0%	0.004	34%	0.339	C	S	.	.	H	α-helix	trans	-88.3	-32.9	-177.4	-68.8	-67.6	0	0	0	114.3	L34 F37 Y38 H62 W66 V71 N75 S117 R118	L34-F121 HydrophobicContact CD1-CE2 4.33Å; L34-F121 HydrophobicContact CD1-CZ 3.73Å; F37-F121 HydrophobicContact CB-CD1 3.83Å; F37-F121 HydrophobicContact CB-CE1 3.37Å; F37-F121 HydrophobicContact CB-CZ 3.94Å; F37-F121 HydrophobicContact CG-CE1 4.41Å; Y38-F121 AromaticContact CD1-CE1 3.97Å; Y38-F121 HydrophobicContact CD1-CE1 3.97Å; Y38-F121 AromaticContact CE1-CE1 3.91Å; Y38-F121 HydrophobicContact CE1-CE1 3.91Å; Y38-F121 HydrophobicContact CE1-CZ 4.18Å; Y38-F121 HydrophobicContact CE2-CZ 4.45Å; Y38-F121 HydrophobicContact CG-CE1 4.33Å; H62-F121 AromaticContact NE2-CE2 3.88Å; W66-F121 AromaticContact CZ2-CD2 3.62Å; W66-F121 HydrophobicContact CZ2-CD2 3.62Å; W66-F121 HydrophobicContact CZ2-CE2 4.26Å; W66-F121 HydrophobicContact CZ2-CG 4.45Å; V71-F121 HydrophobicContact CG1-CB 4.11Å; V71-F121 HydrophobicContact CG1-CD1 4.15Å; V71-F121 HydrophobicContact CG2-CB 3.83Å; V71-F121 HydrophobicContact CG2-CD1 4.45Å; V71-F121 HydrophobicContact CG2-CG 4.33Å; N75-F121 PolarHBondContact ND2-O 3.44Å; S117-F121 WeakPolarHBondContact O-CD2 3.35Å; S117-F121 PolarHBondContact O-N 3.08Å; R118-F121 PolarHBondContact O-N 3.18Å
122	F	88.4	Confident	82.6	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.018	33%	0.328	C	S	.	.	H	α-helix	trans	-106.5	-5.8	-174.2	-68.5	-104.2	0	0	0	113.8	W66 H70 V71 M74 R118 L126 Y140	W66-F122 HydrophobicContact CB-CE2 4.32Å; W66-F122 HydrophobicContact CB-CZ 4.02Å; W66-F122 AromaticContact CD1-CE2 3.95Å; W66-F122 AromaticContact CD2-CE2 3.79Å; W66-F122 HydrophobicContact CD2-CE2 3.79Å; W66-F122 HydrophobicContact CD2-CZ 4.37Å; W66-F122 HydrophobicContact CE3-CE2 4.27Å; W66-F122 AromaticContact CG-CE2 3.79Å; W66-F122 HydrophobicContact CG-CE2 3.79Å; W66-F122 AromaticContact CG-CZ 3.97Å; W66-F122 HydrophobicContact CG-CZ 3.97Å; H70-F122 HydrophobicContact CB-CE1 3.97Å; H70-F122 HydrophobicContact CB-CZ 3.8Å; V71-F122 HydrophobicContact CG2-CE2 4Å; V71-F122 HydrophobicContact CG2-CZ 4.19Å; M74-F122 HydrophobicContact CB-CD1 3.72Å; M74-F122 HydrophobicContact CB-CE1 4.27Å; M74-F122 HydrophobicContact CG-CB 4.03Å; M74-F122 HydrophobicContact CG-CD1 3.72Å; M74-F122 HydrophobicContact CG-CG 4.3Å; M74-F122 WeakPolarHBondContact CG-O 3.47Å; R118-F122 HydrophobicContact CG-CD2 4.47Å; R118-F122 VanDerWaalsContact CZ-CE2 3.49Å; R118-F122 VanDerWaalsContact CZ-CZ 3.49Å; R118-F122 VanDerWaalsContact NH1-CE2 3.32Å; R118-F122 VanDerWaalsContact NH1-CZ 3.33Å; R118-F122 WeakPolarHBondContact O-CB 3.12Å; R118-F122 WeakPolarHBondContact O-CD2 3.26Å; R118-F122 PolarHBondContact O-N 3.17Å; F122-L126 HydrophobicContact CB-CD1 3.47Å; F122-L126 VanDerWaalsContact CB-CD1 3.47Å; F122-L126 HydrophobicContact CB-CG 4.22Å; F122-L126 HydrophobicContact CD1-CD1 3.8Å; F122-L126 HydrophobicContact CG-CD1 3.82Å; F122-Y140 HydrophobicContact CD1-CD1 4.2Å; F122-Y140 HydrophobicContact CD1-CE1 4.06Å; F122-Y140 HydrophobicContact CE1-CD1 4.08Å; F122-Y140 HydrophobicContact CE1-CD2 4.19Å; F122-Y140 AromaticContact CE1-CE1 3.85Å; F122-Y140 HydrophobicContact CE1-CE1 3.85Å; F122-Y140 AromaticContact CE1-CE2 3.93Å; F122-Y140 HydrophobicContact CE1-CE2 3.93Å; F122-Y140 HydrophobicContact CE1-CG 4.28Å; F122-Y140 AromaticContact CE1-CZ 3.79Å
123	G	84.4	Confident	82.9	Confident	25 Å²	25	60.9 Å²	60.9	26%	0.258	32%	0.322	S	S	.	.			trans	80	178.5	-174.3	0	0	0	0	0	113.5	E119 G125	E119-G123 CarbonylContact O-C 3.5Å; E119-G123 WeakPolarHBondContact O-CA 3.28Å; E119-G123 PolarHBondContact O-N 2.86Å; G123-G125 VanDerWaalsContact C-N 3.28Å; G123-G125 PolarHBondContact O-N 2.87Å
124	T	80.7	Confident	83.2	Confident	125 Å²	125	57.1 Å²	57.1	77%	0.767	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	0.9	-177.5	58.4	0	0	0	0	113.8
125	G	75.2	Confident	83.7	Confident	69 Å²	69	56.7 Å²	56.7	71%	0.711	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-15.8	-174	0	0	0	0	0	115	G123	G123-G125 VanDerWaalsContact C-N 3.28Å; G123-G125 PolarHBondContact O-N 2.87Å
126	L	81.7	Confident	84.3	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	29%	0.293	C	S	.	.	S	Bend	trans	-80.1	132.4	-179.7	-65.5	-175.6	0	0	0	111.6	M74 F122 R128 F132 L143	M74-L126 HydrophobicContact CE-CD2 3.63Å; M74-L126 HydrophobicContact CE-CG 4.01Å; M74-L126 HydrophobicContact SD-CD2 4.02Å; F122-L126 HydrophobicContact CB-CD1 3.47Å; F122-L126 VanDerWaalsContact CB-CD1 3.47Å; F122-L126 HydrophobicContact CB-CG 4.22Å; F122-L126 HydrophobicContact CD1-CD1 3.8Å; F122-L126 HydrophobicContact CG-CD1 3.82Å; L126-R128 PolarHBondContact O-N 2.77Å; L126-F132 HydrophobicContact CB-CE2 4.22Å; L126-F132 HydrophobicContact CB-CZ 4.47Å; L126-F132 HydrophobicContact CD2-CE1 4.26Å; L126-F132 HydrophobicContact CD2-CE2 4.32Å; L126-F132 HydrophobicContact CD2-CZ 3.92Å; L126-L143 HydrophobicContact CD2-CD2 3.47Å; L126-L143 VanDerWaalsContact CD2-CD2 3.47Å
127	N	79	Confident	84.8	Confident	91 Å²	91	47.7 Å²	47.7	49%	0.487	27%	0.266	S	S	.	.			trans	-69.2	118.2	175.6	-173.3	-13.4	0	0	0	110.9	L129 V130	N127-L129 PolarHBondContact O-N 3.3Å; N127-L129 WeakPolarHBondContact OD1-CB 3.47Å; N127-L129 PolarHBondContact OD1-N 3.28Å; N127-V130 HydrophobicContact CB-CB 4.47Å; N127-V130 HydrophobicContact CB-CG2 4.01Å; N127-V130 PolarHBondContact O-N 3.15Å
128	R	76.5	Confident	85.3	Confident	163 Å²	163	47 Å²	47	62%	0.615	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.5	-179.1	-61.1	-179.9	-176.9	166.1	-1.5	114.2	E119 L126	E119-R128 IonicContact OE1-CZ 2.71Å; E119-R128 IonicContact OE1-NE 3.35Å; E119-R128 PolarHBondContact OE1-NE 3.01Å; E119-R128 IonicContact OE1-NH2 3.35Å; E119-R128 PolarHBondContact OE1-NH2 2.83Å; E119-R128 IonicContact OE2-NH2 3.11Å; E119-R128 PolarHBondContact OE2-NH2 3.29Å; L126-R128 PolarHBondContact O-N 2.77Å
129	L	75.1	Confident	85.7	Confident	163 Å²	163	46.5 Å²	46.5	85%	0.853	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-11.7	-178.8	-60.6	177.9	0	0	0	113.4	N127	N127-L129 PolarHBondContact O-N 3.3Å; N127-L129 WeakPolarHBondContact OD1-CB 3.47Å; N127-L129 PolarHBondContact OD1-N 3.28Å
130	V	77.7	Confident	86	Confident	55 Å²	55	44.5 Å²	44.5	33%	0.333	25%	0.25	S	S	.	.	S	Bend	trans	-103.2	128.8	-174.9	-176.7	0	0	0	0	109.2	N127 F132 Q166	N127-V130 HydrophobicContact CB-CB 4.47Å; N127-V130 HydrophobicContact CB-CG2 4.01Å; N127-V130 PolarHBondContact O-N 3.15Å; V130-F132 HydrophobicContact CB-CE2 4.19Å; V130-F132 HydrophobicContact CB-CZ 4.35Å; V130-F132 HydrophobicContact CG1-CE2 4.46Å; V130-F132 HydrophobicContact CG1-CZ 4.37Å; V130-F132 VanDerWaalsContact O-CD2 3.32Å; V130-F132 WeakPolarHBondContact O-CD2 3.45Å; V130-F132 WeakPolarHBondContact O-CE2 3.42Å; V130-Q166 VanDerWaalsContact CG1-NE2 3.31Å
131	S	81.5	Confident	86.3	Confident	42 Å²	42	41 Å²	41	29%	0.294	23%	0.234	S	C	.	.			trans	-74.2	130.1	170.5	177.9	0	0	0	0	109.9	K133 Q166	S131-K133 WeakPolarHBondContact OG-CB 3.35Å; S131-K133 PolarHBondContact OG-N 3Å; S131-Q166 PolarHBondContact O-NE2 3.44Å
132	F	81.8	Confident	86.6	Confident	18 Å²	18	41 Å²	41	8%	0.079	23%	0.234	C	C	.	.			trans	-103.9	21.7	173.2	-65.9	-88	0	0	0	111.9	L126 V130 G134 T135 Y140 L143	L126-F132 HydrophobicContact CB-CE2 4.22Å; L126-F132 HydrophobicContact CB-CZ 4.47Å; L126-F132 HydrophobicContact CD2-CE1 4.26Å; L126-F132 HydrophobicContact CD2-CE2 4.32Å; L126-F132 HydrophobicContact CD2-CZ 3.92Å; V130-F132 HydrophobicContact CB-CE2 4.19Å; V130-F132 HydrophobicContact CB-CZ 4.35Å; V130-F132 HydrophobicContact CG1-CE2 4.46Å; V130-F132 HydrophobicContact CG1-CZ 4.37Å; V130-F132 VanDerWaalsContact O-CD2 3.32Å; V130-F132 WeakPolarHBondContact O-CD2 3.45Å; V130-F132 WeakPolarHBondContact O-CE2 3.42Å; F132-G134 PolarHBondContact O-N 3.47Å; F132-T135 VanDerWaalsContact C-OG1 3.26Å; F132-T135 WeakPolarHBondContact O-CB 3.29Å; F132-T135 PolarHBondContact O-N 3.26Å; F132-T135 VanDerWaalsContact O-N 3.16Å; F132-T135 PolarHBondContact O-OG1 3.28Å; F132-Y140 VanDerWaalsContact CB-OH 3.24Å; F132-Y140 WeakPolarHBondContact CB-OH 3.5Å; F132-Y140 HydrophobicContact CD1-CE1 4.32Å; F132-L143 HydrophobicContact CE1-CD2 3.86Å; F132-L143 HydrophobicContact CZ-CD2 4.47Å
133	K	88.1	Confident	86.7	Confident	76 Å²	76	42.6 Å²	42.6	33%	0.33	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	136.6	178.3	-167.8	-174.2	174.4	-159.5	0	111.1	D95 T98 S131 T135 D165	D95-K133 CarbonylContact O-C 3.45Å; D95-K133 WeakPolarHBondContact O-CA 3.47Å; T98-K133 HydrophobicContact CG2-CD 3.7Å; T98-K133 HydrophobicContact CG2-CG 4.32Å; S131-K133 WeakPolarHBondContact OG-CB 3.35Å; S131-K133 PolarHBondContact OG-N 3Å; K133-T135 VanDerWaalsContact C-N 3.25Å; K133-T135 PolarHBondContact O-N 3.03Å; K133-D165 HydrophobicContact CB-CB 4.3Å; K133-D165 WeakPolarHBondContact CD-OD2 3.43Å; K133-D165 WeakPolarHBondContact CE-OD2 3.37Å; K133-D165 HydrophobicContact CG-CB 4.5Å; K133-D165 WeakPolarHBondContact CG-OD2 3.09Å; K133-D165 IonicContact NZ-OD2 2.59Å; K133-D165 PolarHBondContact NZ-OD2 3.27Å; K133-D165 WeakPolarHBondContact O-CB 3.49Å; K133-D165 PolarHBondContact O-N 3.45Å
134	G	89.7	Confident	87	Confident	2 Å²	2	42.4 Å²	42.4	2%	0.021	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	-6.8	-177.1	0	0	0	0	0	114.5	D95 F132	D95-G134 PolarHBondContact O-N 3.35Å; F132-G134 PolarHBondContact O-N 3.47Å
135	T	92.7	Very high	87.5	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.012	22%	0.221	C	C	.	.			trans	-67.6	131.7	-177.9	-55.5	0	0	0	0	110.6	D95 F132 K133 H139 Y140	D95-T135 PolarHBondContact N-O 3.43Å; F132-T135 VanDerWaalsContact C-OG1 3.26Å; F132-T135 WeakPolarHBondContact O-CB 3.29Å; F132-T135 PolarHBondContact O-N 3.26Å; F132-T135 VanDerWaalsContact O-N 3.16Å; F132-T135 PolarHBondContact O-OG1 3.28Å; K133-T135 VanDerWaalsContact C-N 3.25Å; K133-T135 PolarHBondContact O-N 3.03Å; T135-H139 HydrophobicContact CG2-CB 3.32Å; T135-Y140 HydrophobicContact CG2-CD1 4.33Å; T135-Y140 HydrophobicContact CG2-CD2 3.94Å; T135-Y140 HydrophobicContact CG2-CE1 3.95Å; T135-Y140 HydrophobicContact CG2-CE2 3.56Å; T135-Y140 HydrophobicContact CG2-CG 4.29Å
136	T	95.5	Very high	88.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-92.4	171	177.6	70.7	0	0	0	0	111.9	C93 R94 L138 H139 Y140 I162	C93-T136 WeakPolarHBondContact O-CA 3.42Å; R94-T136 HydrophobicContact CG-CG2 4.38Å; T136-L138 PolarHBondContact O-N 3.36Å; T136-L138 PolarHBondContact OG1-N 3.38Å; T136-H139 PolarHBondContact N-ND1 3.3Å; T136-H139 WeakPolarHBondContact O-CB 3.42Å; T136-H139 PolarHBondContact O-N 3.2Å; T136-H139 PolarHBondContact OG1-ND1 3.23Å; T136-Y140 WeakPolarHBondContact O-CD2 3.44Å; T136-Y140 PolarHBondContact O-N 3.27Å; T136-I162 HydrophobicContact CG2-CB 4.16Å; T136-I162 HydrophobicContact CG2-CD1 4.11Å; T136-I162 HydrophobicContact CG2-CG2 3.66Å
137	A	95.3	Very high	88.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-36	173.3	0	0	0	0	0	112.5	L69 A73 Y140 A141 L153	L69-A137 HydrophobicContact CB-CB 4.42Å; L69-A137 HydrophobicContact CD2-CB 3.69Å; L69-A137 HydrophobicContact CG-CB 3.65Å; A73-A137 HydrophobicContact CB-CB 4.06Å; A73-A137 WeakPolarHBondContact CB-O 3.48Å; A137-Y140 PolarHBondContact O-N 3.37Å; A137-A141 PolarHBondContact O-N 3.43Å; A137-L153 HydrophobicContact CB-CD1 4.03Å; A137-L153 HydrophobicContact CB-CD2 3.84Å; A137-L153 WeakPolarHBondContact O-CD1 3.38Å
138	L	95.9	Very high	89.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-43.6	178.3	-173.9	61.4	0	0	0	111.7	T136 Y140 A141 V142 L153 A158 P160 A170 L183	T136-L138 PolarHBondContact O-N 3.36Å; T136-L138 PolarHBondContact OG1-N 3.38Å; L138-Y140 VanDerWaalsContact C-N 3.31Å; L138-Y140 PolarHBondContact O-N 3.16Å; L138-A141 PolarHBondContact O-N 2.88Å; L138-V142 VanDerWaalsContact O-CG2 3.26Å; L138-V142 WeakPolarHBondContact O-CG2 3.24Å; L138-V142 PolarHBondContact O-N 3.1Å; L138-L153 HydrophobicContact CB-CD1 4.4Å; L138-L153 HydrophobicContact CD1-CB 4.26Å; L138-L153 HydrophobicContact CD1-CD1 4.36Å; L138-A158 HydrophobicContact CB-CB 4.4Å; L138-A158 HydrophobicContact CD2-CB 4.33Å; L138-P160 HydrophobicContact CD2-CB 4.05Å; L138-A170 HydrophobicContact CB-CB 4.46Å; L138-A170 HydrophobicContact CD2-CB 4.03Å; L138-A170 HydrophobicContact CG-CB 3.89Å; L138-L183 HydrophobicContact CD1-CD2 4.36Å
139	H	95.3	Very high	90.4	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-57.9	-43.3	175.2	-66.5	82.9	0	0	0	112	T135 T136 V142 L143 I162 H168 L169 A170 Y173	T135-H139 HydrophobicContact CG2-CB 3.32Å; T136-H139 PolarHBondContact N-ND1 3.3Å; T136-H139 WeakPolarHBondContact O-CB 3.42Å; T136-H139 PolarHBondContact O-N 3.2Å; T136-H139 PolarHBondContact OG1-ND1 3.23Å; H139-V142 PolarHBondContact O-N 3.19Å; H139-L143 VanDerWaalsContact O-CB 3.29Å; H139-L143 WeakPolarHBondContact O-CB 3.32Å; H139-L143 PolarHBondContact O-N 2.69Å; H139-I162 PolarHBondContact CE1-O 2.94Å; H139-I162 PolarHBondContact NE2-O 3.4Å; H139-H168 PolarHBondContact NE2-O 3.28Å; H139-L169 VanDerWaalsContact CD2-C 3.48Å; H139-L169 VanDerWaalsContact NE2-C 3.26Å; H139-A170 VanDerWaalsContact CD2-CA 3.49Å; H139-A170 WeakPolarHBondContact CD2-CA 3.31Å; H139-A170 PolarHBondContact CD2-N 3.48Å; H139-A170 PolarHBondContact NE2-N 2.85Å; H139-A170 VanDerWaalsContact NE2-N 3.17Å; H139-Y173 HydrophobicContact CB-CD2 4.48Å; H139-Y173 AromaticContact CD2-CD2 3.78Å; H139-Y173 AromaticContact CD2-CE2 3.7Å
140	Y	94.3	Very high	91.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-40	177.3	-74.2	-59.8	0	0	0	113	H70 M74 D95 R118 F122 F132 T135 T136 A137 L138 V142 L143 G144	H70-Y140 HydrophobicContact CB-CD2 3.84Å; H70-Y140 HydrophobicContact CB-CE2 3.94Å; H70-Y140 AromaticContact CD2-CD2 3.86Å; H70-Y140 AromaticContact CD2-CE2 3.84Å; M74-Y140 HydrophobicContact CB-CD1 4.44Å; M74-Y140 HydrophobicContact CB-CG 4.48Å; M74-Y140 HydrophobicContact SD-CD1 3.94Å; D95-Y140 HydrophobicContact CB-CE2 4.3Å; D95-Y140 PolarHBondContact OD2-OH 3.18Å; R118-Y140 PolarHBondContact NH2-OH 3.34Å; F122-Y140 HydrophobicContact CD1-CD1 4.2Å; F122-Y140 HydrophobicContact CD1-CE1 4.06Å; F122-Y140 HydrophobicContact CE1-CD1 4.08Å; F122-Y140 HydrophobicContact CE1-CD2 4.19Å; F122-Y140 AromaticContact CE1-CE1 3.85Å; F122-Y140 HydrophobicContact CE1-CE1 3.85Å; F122-Y140 AromaticContact CE1-CE2 3.93Å; F122-Y140 HydrophobicContact CE1-CE2 3.93Å; F122-Y140 HydrophobicContact CE1-CG 4.28Å; F122-Y140 AromaticContact CE1-CZ 3.79Å; F132-Y140 VanDerWaalsContact CB-OH 3.24Å; F132-Y140 WeakPolarHBondContact CB-OH 3.5Å; F132-Y140 HydrophobicContact CD1-CE1 4.32Å; T135-Y140 HydrophobicContact CG2-CD1 4.33Å; T135-Y140 HydrophobicContact CG2-CD2 3.94Å; T135-Y140 HydrophobicContact CG2-CE1 3.95Å; T135-Y140 HydrophobicContact CG2-CE2 3.56Å; T135-Y140 HydrophobicContact CG2-CG 4.29Å; T136-Y140 WeakPolarHBondContact O-CD2 3.44Å; T136-Y140 PolarHBondContact O-N 3.27Å; A137-Y140 PolarHBondContact O-N 3.37Å; L138-Y140 VanDerWaalsContact C-N 3.31Å; L138-Y140 PolarHBondContact O-N 3.16Å; Y140-V142 VanDerWaalsContact C-N 3.27Å; Y140-V142 PolarHBondContact O-N 2.97Å; Y140-L143 HydrophobicContact CD1-CD2 4.36Å; Y140-L143 PolarHBondContact O-N 2.85Å; Y140-G144 PolarHBondContact O-N 2.86Å
141	A	94.6	Very high	92.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.9	-36.9	177.1	0	0	0	0	0	111.8	A73 A137 L138 N145 H146 A149 M150 L153	A73-A141 HydrophobicContact CB-CB 4.22Å; A137-A141 PolarHBondContact O-N 3.43Å; L138-A141 PolarHBondContact O-N 2.88Å; A141-N145 PolarHBondContact O-N 2.75Å; A141-H146 PolarHBondContact O-N 2.79Å; A141-A149 HydrophobicContact CB-CB 4.04Å; A141-M150 HydrophobicContact CB-CG 3.76Å; A141-L153 HydrophobicContact CB-CD1 3.75Å
142	V	94.5	Very high	92.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-71.4	-45.3	175	-176.8	0	0	0	0	111	L138 H139 Y140 G144 N145 M150 A170 A174 T179 L183	L138-V142 VanDerWaalsContact O-CG2 3.26Å; L138-V142 WeakPolarHBondContact O-CG2 3.24Å; L138-V142 PolarHBondContact O-N 3.1Å; H139-V142 PolarHBondContact O-N 3.19Å; Y140-V142 VanDerWaalsContact C-N 3.27Å; Y140-V142 PolarHBondContact O-N 2.97Å; V142-G144 PolarHBondContact O-N 2.91Å; V142-N145 WeakPolarHBondContact O-CA 3.46Å; V142-N145 PolarHBondContact O-N 2.62Å; V142-M150 HydrophobicContact CB-SD 4.21Å; V142-M150 HydrophobicContact CG2-CG 4.18Å; V142-M150 HydrophobicContact CG2-SD 3.6Å; V142-A170 WeakPolarHBondContact CG1-O 3.35Å; V142-A170 HydrophobicContact CG2-CB 4.37Å; V142-A174 HydrophobicContact CG1-CB 4.02Å; V142-T179 HydrophobicContact CG1-CG2 4.14Å; V142-L183 HydrophobicContact CB-CD1 4.4Å; V142-L183 HydrophobicContact CG1-CD1 3.89Å; V142-L183 HydrophobicContact CG2-CD1 3.53Å; V142-L183 HydrophobicContact CG2-CD2 4.08Å; V142-L183 HydrophobicContact CG2-CG 4.38Å
143	L	91.6	Very high	93.5	Very high	38 Å²	38	27.9 Å²	27.9	20%	0.199	14%	0.141	C	C	.	.	H	α-helix	trans	-61.5	-28.6	177	-177.3	68.3	0	0	0	113.3	M74 L126 F132 H139 Y140 N145 Y173 F175	M74-L143 HydrophobicContact SD-CD2 4.43Å; L126-L143 HydrophobicContact CD2-CD2 3.47Å; L126-L143 VanDerWaalsContact CD2-CD2 3.47Å; F132-L143 HydrophobicContact CE1-CD2 3.86Å; F132-L143 HydrophobicContact CZ-CD2 4.47Å; H139-L143 VanDerWaalsContact O-CB 3.29Å; H139-L143 WeakPolarHBondContact O-CB 3.32Å; H139-L143 PolarHBondContact O-N 2.69Å; Y140-L143 HydrophobicContact CD1-CD2 4.36Å; Y140-L143 PolarHBondContact O-N 2.85Å; L143-N145 VanDerWaalsContact C-N 3.35Å; L143-Y173 HydrophobicContact CD1-CD1 3.82Å; L143-Y173 HydrophobicContact CD1-CE1 4.5Å; L143-F175 HydrophobicContact CD1-CZ 4.23Å; L143-F175 WeakPolarHBondContact O-CE2 3.37Å; L143-F175 VanDerWaalsContact O-CZ 3.3Å; L143-F175 WeakPolarHBondContact O-CZ 3.43Å
144	G	89.8	Confident	93.8	Very high	22 Å²	22	25.2 Å²	25.2	23%	0.227	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.6	171.8	0	0	0	0	0	114.3	Y140 V142 H146	Y140-G144 PolarHBondContact O-N 2.86Å; V142-G144 PolarHBondContact O-N 2.91Å; G144-H146 PolarHBondContact O-CE1 3.39Å; G144-H146 PolarHBondContact O-N 2.95Å; G144-H146 PolarHBondContact O-ND1 3.41Å
145	N	91.4	Very high	94	Very high	66 Å²	66	32.3 Å²	32.3	35%	0.353	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	40.4	-170	-164.2	11.1	0	0	0	113.2	A141 V142 L143 K147 F175	A141-N145 PolarHBondContact O-N 2.75Å; V142-N145 WeakPolarHBondContact O-CA 3.46Å; V142-N145 PolarHBondContact O-N 2.62Å; L143-N145 VanDerWaalsContact C-N 3.35Å; N145-K147 PolarHBondContact O-N 2.85Å; N145-F175 HydrophobicContact CB-CD2 4.02Å; N145-F175 HydrophobicContact CB-CE2 4.49Å
146	H	93.6	Very high	94.1	Very high	60 Å²	60	34.4 Å²	34.4	28%	0.278	17%	0.17	S	C	.	.			trans	-96.1	87.5	-174.6	-65.5	-48.4	0	0	0	111.9	A73 M74 G76 A141 G144 E148 A149 M150	A73-H146 PolarHBondContact O-CD2 2.8Å; M74-H146 PolarHBondContact O-CD2 3.13Å; M74-H146 PolarHBondContact O-NE2 3.35Å; G76-H146 WeakPolarHBondContact CA-CD2 3.41Å; G76-H146 PolarHBondContact N-CD2 2.9Å; G76-H146 PolarHBondContact N-NE2 2.86Å; A141-H146 PolarHBondContact O-N 2.79Å; G144-H146 PolarHBondContact O-CE1 3.39Å; G144-H146 PolarHBondContact O-N 2.95Å; G144-H146 PolarHBondContact O-ND1 3.41Å; H146-E148 VanDerWaalsContact C-N 3.32Å; H146-E148 PolarHBondContact O-N 3.07Å; H146-A149 HydrophobicContact CB-CB 3.81Å; H146-A149 PolarHBondContact O-N 2.71Å; H146-A149 VanDerWaalsContact O-N 3.1Å; H146-M150 WeakPolarHBondContact O-CG 3.38Å; H146-M150 PolarHBondContact O-N 3.08Å
147	K	92.6	Very high	93.8	Very high	85 Å²	85	37.4 Å²	37.4	37%	0.37	19%	0.186	S	C	.	.	H	α-helix	trans	-54.8	-41.1	-175.8	-65.1	-173.8	178.1	-176.1	0	114.2	N145 M150 N151 D176 Q178	N145-K147 PolarHBondContact O-N 2.85Å; K147-M150 VanDerWaalsContact CA-CE 3.48Å; K147-M150 HydrophobicContact CB-CE 4.18Å; K147-M150 HydrophobicContact CG-CE 3.73Å; K147-N151 WeakPolarHBondContact O-CB 3.1Å; K147-N151 VanDerWaalsContact O-CG 3.27Å; K147-N151 PolarHBondContact O-N 3.09Å; K147-N151 PolarHBondContact O-ND2 3.27Å; K147-D176 IonicContact NZ-OD2 2.62Å; K147-D176 PolarHBondContact NZ-OD2 2.74Å; K147-Q178 VanDerWaalsContact NZ-OE1 3.13Å
148	E	94.1	Very high	93.7	Very high	144 Å²	144	37.4 Å²	37.4	67%	0.673	19%	0.186	S	C	*	.	H	α-helix	trans	-68.8	-38.9	178.5	-63.2	-174.1	175.6	0	0	112.8	A78 H146 N151 A152	A78-E148 HydrophobicContact CB-CB 3.74Å; H146-E148 VanDerWaalsContact C-N 3.32Å; H146-E148 PolarHBondContact O-N 3.07Å; E148-N151 PolarHBondContact O-N 3.26Å; E148-A152 PolarHBondContact O-N 2.73Å
149	A	94.4	Very high	93.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.3	-41.9	176.1	0	0	0	0	0	111.6	I81 A141 H146 N151 A152 L153	I81-A149 HydrophobicContact CD1-CB 3.48Å; I81-A149 VanDerWaalsContact CD1-CB 3.48Å; A141-A149 HydrophobicContact CB-CB 4.04Å; H146-A149 HydrophobicContact CB-CB 3.81Å; H146-A149 PolarHBondContact O-N 2.71Å; H146-A149 VanDerWaalsContact O-N 3.1Å; A149-N151 VanDerWaalsContact C-N 3.35Å; A149-N151 PolarHBondContact O-N 3.42Å; A149-A152 PolarHBondContact O-N 2.9Å; A149-L153 WeakPolarHBondContact O-CG 3.44Å; A149-L153 PolarHBondContact O-N 3.25Å
150	M	95.1	Very high	93.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-57.3	-48.7	172.6	-67.7	-171.9	-76.5	0	0	110.8	A141 V142 H146 K147 A152 L153 M154 T179	A141-M150 HydrophobicContact CB-CG 3.76Å; V142-M150 HydrophobicContact CB-SD 4.21Å; V142-M150 HydrophobicContact CG2-CG 4.18Å; V142-M150 HydrophobicContact CG2-SD 3.6Å; H146-M150 WeakPolarHBondContact O-CG 3.38Å; H146-M150 PolarHBondContact O-N 3.08Å; K147-M150 VanDerWaalsContact CA-CE 3.48Å; K147-M150 HydrophobicContact CB-CE 4.18Å; K147-M150 HydrophobicContact CG-CE 3.73Å; M150-A152 VanDerWaalsContact C-N 3.35Å; M150-A152 PolarHBondContact O-N 3.44Å; M150-L153 PolarHBondContact O-N 3.15Å; M150-M154 HydrophobicContact CB-CE 4.13Å; M150-M154 WeakPolarHBondContact O-CB 3.45Å; M150-M154 VanDerWaalsContact O-CG 3.28Å; M150-M154 WeakPolarHBondContact O-CG 3.42Å; M150-M154 PolarHBondContact O-N 3.37Å; M150-T179 HydrophobicContact CE-CG2 3.74Å; M150-T179 HydrophobicContact SD-CG2 3.65Å
151	N	95.1	Very high	93.3	Very high	83 Å²	83	41.5 Å²	41.5	44%	0.444	21%	0.21	S	C	.	.	H	α-helix	trans	-62.2	-38.9	178.6	-73.7	-25	0	0	0	113	K147 E148 A149 M154 K155	K147-N151 WeakPolarHBondContact O-CB 3.1Å; K147-N151 VanDerWaalsContact O-CG 3.27Å; K147-N151 PolarHBondContact O-N 3.09Å; K147-N151 PolarHBondContact O-ND2 3.27Å; E148-N151 PolarHBondContact O-N 3.26Å; A149-N151 VanDerWaalsContact C-N 3.35Å; A149-N151 PolarHBondContact O-N 3.42Å; N151-M154 WeakPolarHBondContact OD1-CE 3.29Å; N151-K155 VanDerWaalsContact O-CB 3.28Å; N151-K155 WeakPolarHBondContact O-CB 3.34Å; N151-K155 PolarHBondContact O-N 3.5Å
152	A	95	Very high	93.1	Very high	6 Å²	6	42.5 Å²	42.5	5%	0.05	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-48.8	175	0	0	0	0	0	111.1	I81 E148 A149 M150 M154 K155 H156	I81-A152 HydrophobicContact CB-CB 4.18Å; I81-A152 HydrophobicContact CG2-CB 3.66Å; E148-A152 PolarHBondContact O-N 2.73Å; A149-A152 PolarHBondContact O-N 2.9Å; M150-A152 VanDerWaalsContact C-N 3.35Å; M150-A152 PolarHBondContact O-N 3.44Å; A152-M154 PolarHBondContact O-N 3.41Å; A152-K155 WeakPolarHBondContact O-CB 3.44Å; A152-K155 PolarHBondContact O-N 2.89Å; A152-H156 PolarHBondContact O-CD2 3.08Å; A152-H156 VanDerWaalsContact O-CD2 3.27Å; A152-H156 PolarHBondContact O-N 3.44Å
153	L	95.5	Very high	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-43.6	177.5	-68.5	168.1	0	0	0	112.3	L69 A73 I81 L85 V91 A137 L138 A141 A149 M150 K155 H156 N157 A158	L69-L153 HydrophobicContact CD1-CD2 4.23Å; L69-L153 HydrophobicContact CD2-CD2 4.11Å; L69-L153 HydrophobicContact CG-CD2 4.28Å; A73-L153 HydrophobicContact CB-CD1 4.3Å; I81-L153 HydrophobicContact CD1-CG 4.41Å; I81-L153 HydrophobicContact CG2-CD2 3.81Å; I81-L153 HydrophobicContact CG2-CG 4.01Å; L85-L153 HydrophobicContact CD1-CD2 4.18Å; V91-L153 HydrophobicContact CG2-CD2 4.2Å; A137-L153 HydrophobicContact CB-CD1 4.03Å; A137-L153 HydrophobicContact CB-CD2 3.84Å; A137-L153 WeakPolarHBondContact O-CD1 3.38Å; L138-L153 HydrophobicContact CB-CD1 4.4Å; L138-L153 HydrophobicContact CD1-CB 4.26Å; L138-L153 HydrophobicContact CD1-CD1 4.36Å; A141-L153 HydrophobicContact CB-CD1 3.75Å; A149-L153 WeakPolarHBondContact O-CG 3.44Å; A149-L153 PolarHBondContact O-N 3.25Å; M150-L153 PolarHBondContact O-N 3.15Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 3.16Å; L153-H156 CarbonylContact O-C 2.98Å; L153-H156 PolarHBondContact O-N 3.48Å; L153-H156 VanDerWaalsContact O-N 3.14Å; L153-N157 PolarHBondContact O-N 3.34Å; L153-A158 HydrophobicContact CB-CB 3.96Å; L153-A158 WeakPolarHBondContact O-CB 3.49Å; L153-A158 PolarHBondContact O-N 3.29Å; L153-A158 VanDerWaalsContact O-N 3.08Å
154	M	94.3	Very high	93	Very high	19 Å²	19	45.9 Å²	45.9	9%	0.094	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-35.6	177	-71.6	-172.6	-69.4	0	0	112.5	M150 N151 A152 H156 N157 L182 L183 Y186	M150-M154 HydrophobicContact CB-CE 4.13Å; M150-M154 WeakPolarHBondContact O-CB 3.45Å; M150-M154 VanDerWaalsContact O-CG 3.28Å; M150-M154 WeakPolarHBondContact O-CG 3.42Å; M150-M154 PolarHBondContact O-N 3.37Å; N151-M154 WeakPolarHBondContact OD1-CE 3.29Å; A152-M154 PolarHBondContact O-N 3.41Å; M154-H156 PolarHBondContact O-N 2.77Å; M154-N157 PolarHBondContact O-N 3.32Å; M154-N157 VanDerWaalsContact O-N 3.15Å; M154-L182 HydrophobicContact CE-CD1 4.49Å; M154-L182 HydrophobicContact CE-CD2 3.96Å; M154-L182 HydrophobicContact CE-CG 4.14Å; M154-L183 HydrophobicContact SD-CD2 4.45Å; M154-Y186 HydrophobicContact CB-CD2 3.99Å; M154-Y186 HydrophobicContact CB-CE1 4.39Å; M154-Y186 HydrophobicContact CB-CE2 3.69Å; M154-Y186 HydrophobicContact CB-CG 4.46Å; M154-Y186 HydrophobicContact CG-CD1 3.76Å; M154-Y186 HydrophobicContact CG-CD2 3.87Å; M154-Y186 HydrophobicContact CG-CE1 3.74Å; M154-Y186 HydrophobicContact CG-CE2 3.85Å; M154-Y186 HydrophobicContact CG-CG 3.83Å; M154-Y186 HydrophobicContact SD-CD1 3.79Å; M154-Y186 HydrophobicContact SD-CD2 3.8Å; M154-Y186 HydrophobicContact SD-CE1 4.39Å; M154-Y186 HydrophobicContact SD-CE2 4.4Å; M154-Y186 HydrophobicContact SD-CG 3.46Å
155	K	93.5	Very high	92.9	Very high	151 Å²	151	49.2 Å²	49.2	66%	0.657	24%	0.243	S	C	*	.	H	α-helix	trans	-62.5	-32.1	174.6	-178.7	-172	171.2	-159.4	0	112	N151 A152 L153 N157	N151-K155 VanDerWaalsContact O-CB 3.28Å; N151-K155 WeakPolarHBondContact O-CB 3.34Å; N151-K155 PolarHBondContact O-N 3.5Å; A152-K155 WeakPolarHBondContact O-CB 3.44Å; A152-K155 PolarHBondContact O-N 2.89Å; L153-K155 VanDerWaalsContact C-N 3.33Å; L153-K155 PolarHBondContact O-N 3.16Å; K155-N157 VanDerWaalsContact C-N 3.32Å
156	H	93.9	Very high	92.6	Very high	47 Å²	47	49.7 Å²	49.7	22%	0.218	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	18.5	177	-74.4	-87.4	0	0	0	113.4	N82 L85 D86 V91 A152 L153 M154 A158	N82-H156 PolarHBondContact OD1-NE2 3.31Å; L85-H156 HydrophobicContact CB-CB 4.36Å; L85-H156 HydrophobicContact CD1-CB 3.57Å; L85-H156 HydrophobicContact CG-CB 4.41Å; D86-H156 IonicContact OD1-CE1 2.75Å; D86-H156 PolarHBondContact OD1-CE1 3.4Å; D86-H156 VanDerWaalsContact OD1-CE1 3.27Å; D86-H156 IonicContact OD1-NE2 3.41Å; V91-H156 HydrophobicContact CG2-CB 4.43Å; A152-H156 PolarHBondContact O-CD2 3.08Å; A152-H156 VanDerWaalsContact O-CD2 3.27Å; A152-H156 PolarHBondContact O-N 3.44Å; L153-H156 CarbonylContact O-C 2.98Å; L153-H156 PolarHBondContact O-N 3.48Å; L153-H156 VanDerWaalsContact O-N 3.14Å; M154-H156 PolarHBondContact O-N 2.77Å; H156-A158 PolarHBondContact O-N 3.03Å
157	N	91.1	Very high	92.4	Very high	63 Å²	63	48.4 Å²	48.4	34%	0.337	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	39.6	176.1	-58.2	-2.1	0	0	0	114.5	L153 M154 K155 D159 Y186 Y190 R197	L153-N157 PolarHBondContact O-N 3.34Å; M154-N157 PolarHBondContact O-N 3.32Å; M154-N157 VanDerWaalsContact O-N 3.15Å; K155-N157 VanDerWaalsContact C-N 3.32Å; N157-D159 PolarHBondContact O-N 3.14Å; N157-Y186 WeakPolarHBondContact CA-OH 3.44Å; N157-Y190 HydrophobicContact CB-CE2 4.45Å; N157-Y190 WeakPolarHBondContact O-CE2 3.24Å; N157-R197 PolarHBondContact ND2-NH2 2.62Å
158	A	93.1	Very high	92.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.			trans	-54	133.8	169.5	0	0	0	0	0	111.3	V91 L138 L153 H156 P160 Y186	V91-A158 HydrophobicContact CG2-CB 3.52Å; L138-A158 HydrophobicContact CB-CB 4.4Å; L138-A158 HydrophobicContact CD2-CB 4.33Å; L153-A158 HydrophobicContact CB-CB 3.96Å; L153-A158 WeakPolarHBondContact O-CB 3.49Å; L153-A158 PolarHBondContact O-N 3.29Å; L153-A158 VanDerWaalsContact O-N 3.08Å; H156-A158 PolarHBondContact O-N 3.03Å; A158-P160 VanDerWaalsContact O-CD 3.26Å; A158-P160 WeakPolarHBondContact O-CD 3.26Å; A158-Y186 PolarHBondContact N-OH 3.27Å; A158-Y186 VanDerWaalsContact O-CE1 3.24Å; A158-Y186 WeakPolarHBondContact O-CE1 3.41Å; A158-Y186 PolarHBondContact O-OH 3.22Å
159	D	92.9	Very high	92.3	Very high	18 Å²	18	43.2 Å²	43.2	10%	0.096	23%	0.225	C	C	.	.			trans	-77.7	112.7	-178.1	-164.6	-32.5	0	0	0	111.1	D92 N157 T161 I162 Y190	D92-D159 PolarHBondContact OD1-N 3.1Å; D92-D159 WeakPolarHBondContact OD2-CB 3.39Å; N157-D159 PolarHBondContact O-N 3.14Å; D159-T161 VanDerWaalsContact C-N 3.25Å; D159-T161 PolarHBondContact O-N 3.17Å; D159-T161 WeakPolarHBondContact OD1-CA 3.45Å; D159-T161 VanDerWaalsContact OD1-CB 3.29Å; D159-T161 WeakPolarHBondContact OD1-CB 3.49Å; D159-T161 PolarHBondContact OD1-N 3.3Å; D159-T161 PolarHBondContact OD1-OG1 2.8Å; D159-I162 HydrophobicContact CB-CD1 3.76Å; D159-I162 HydrophobicContact CB-CG1 3.94Å; D159-Y190 HydrophobicContact CB-CE1 4.09Å; D159-Y190 HydrophobicContact CB-CE2 4.49Å; D159-Y190 WeakPolarHBondContact CB-OH 3.14Å; D159-Y190 WeakPolarHBondContact OD1-CE1 3.29Å; D159-Y190 WeakPolarHBondContact OD2-CE1 3.47Å; D159-Y190 PolarHBondContact OD2-OH 3.24Å
160	P	92.6	Very high	92.2	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.026	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-6.1	178.8	35.2	-32.9	0	0	0	113	L138 A158 Y186 Y190	L138-P160 HydrophobicContact CD2-CB 4.05Å; A158-P160 VanDerWaalsContact O-CD 3.26Å; A158-P160 WeakPolarHBondContact O-CD 3.26Å; P160-Y186 HydrophobicContact CB-CD1 3.9Å; P160-Y186 HydrophobicContact CB-CE1 3.95Å; P160-Y186 HydrophobicContact CG-CD1 3.77Å; P160-Y186 HydrophobicContact CG-CE1 3.67Å; P160-Y190 VanDerWaalsContact CD-CD1 3.43Å; P160-Y190 HydrophobicContact CG-CD1 4.05Å; P160-Y190 HydrophobicContact CG-CG 4.03Å
161	T	89.9	Confident	92.1	Very high	65 Å²	65	44.8 Å²	44.8	40%	0.399	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-3.8	-176.7	71.8	0	0	0	0	113.2	D159 Q163	D159-T161 VanDerWaalsContact C-N 3.25Å; D159-T161 PolarHBondContact O-N 3.17Å; D159-T161 WeakPolarHBondContact OD1-CA 3.45Å; D159-T161 VanDerWaalsContact OD1-CB 3.29Å; D159-T161 WeakPolarHBondContact OD1-CB 3.49Å; D159-T161 PolarHBondContact OD1-N 3.3Å; D159-T161 PolarHBondContact OD1-OG1 2.8Å; T161-Q163 PolarHBondContact O-N 3.38Å
162	I	91.5	Very high	92	Very high	21 Å²	21	45.3 Å²	45.3	11%	0.108	24%	0.237	C	C	.	.			trans	-72.1	125.4	175.8	-66.3	173.6	0	0	0	109.3	D92 T136 H139 D159	D92-I162 HydrophobicContact CB-CD1 3.65Å; T136-I162 HydrophobicContact CG2-CB 4.16Å; T136-I162 HydrophobicContact CG2-CD1 4.11Å; T136-I162 HydrophobicContact CG2-CG2 3.66Å; H139-I162 PolarHBondContact CE1-O 2.94Å; H139-I162 PolarHBondContact NE2-O 3.4Å; D159-I162 HydrophobicContact CB-CD1 3.76Å; D159-I162 HydrophobicContact CB-CG1 3.94Å
163	Q	92.6	Very high	91.8	Very high	102 Å²	102	46.8 Å²	46.8	48%	0.477	24%	0.241	S	C	.	.			trans	-93.2	142.7	167.1	-67.1	175.6	-7.9	0	0	110.5	T161 H168 L169	T161-Q163 PolarHBondContact O-N 3.38Å; Q163-H168 VanDerWaalsContact CA-O 3.31Å; Q163-H168 WeakPolarHBondContact CA-O 3.5Å; Q163-L169 HydrophobicContact CG-CD2 3.49Å; Q163-L169 VanDerWaalsContact CG-CD2 3.49Å; Q163-L169 HydrophobicContact CG-CG 3.89Å
164	N	90.1	Very high	91.6	Very high	7 Å²	7	48.1 Å²	48.1	4%	0.037	25%	0.252	C	S	.	.			trans	-74	178.3	168.9	70	10	0	0	0	111.5	Q166 G167 H168 Y173	N164-Q166 PolarHBondContact O-N 3.38Å; N164-Q166 WeakPolarHBondContact OD1-CA 3.48Å; N164-Q166 WeakPolarHBondContact OD1-CB 3.36Å; N164-Q166 PolarHBondContact OD1-N 3.21Å; N164-G167 PolarHBondContact O-N 3.15Å; N164-G167 PolarHBondContact OD1-N 3.13Å; N164-H168 PolarHBondContact N-O 2.98Å; N164-H168 PolarHBondContact OD1-N 2.76Å; N164-H168 PolarHBondContact OD1-O 2.75Å; N164-Y173 PolarHBondContact ND2-OH 3.03Å
165	D	88.8	Confident	91.2	Very high	92 Å²	92	53.6 Å²	53.6	49%	0.492	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.3	-178.1	-74.1	25.2	0	0	0	112.8	K133	K133-D165 HydrophobicContact CB-CB 4.3Å; K133-D165 WeakPolarHBondContact CD-OD2 3.43Å; K133-D165 WeakPolarHBondContact CE-OD2 3.37Å; K133-D165 HydrophobicContact CG-CB 4.5Å; K133-D165 WeakPolarHBondContact CG-OD2 3.09Å; K133-D165 IonicContact NZ-OD2 2.59Å; K133-D165 PolarHBondContact NZ-OD2 3.27Å; K133-D165 WeakPolarHBondContact O-CB 3.49Å; K133-D165 PolarHBondContact O-N 3.45Å
166	Q	85.4	Confident	91	Very high	76 Å²	76	48.3 Å²	48.3	36%	0.355	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-5.4	171.5	-61.2	-177.2	-18.6	0	0	113.3	V130 S131 N164 H168	V130-Q166 VanDerWaalsContact CG1-NE2 3.31Å; S131-Q166 PolarHBondContact O-NE2 3.44Å; N164-Q166 PolarHBondContact O-N 3.38Å; N164-Q166 WeakPolarHBondContact OD1-CA 3.48Å; N164-Q166 WeakPolarHBondContact OD1-CB 3.36Å; N164-Q166 PolarHBondContact OD1-N 3.21Å; Q166-H168 PolarHBondContact OE1-ND1 3.36Å
167	G	88.2	Confident	90.9	Very high	33 Å²	33	51.7 Å²	51.7	34%	0.34	28%	0.275	S	S	.	.	S	Bend	trans	84.7	6.7	-177	0	0	0	0	0	114.7	N164	N164-G167 PolarHBondContact O-N 3.15Å; N164-G167 PolarHBondContact OD1-N 3.13Å
168	H	92.5	Very high	90.9	Very high	75 Å²	75	54.9 Å²	54.9	35%	0.347	29%	0.288	S	S	.	.			trans	-87.6	139.4	179.5	-57.3	141.6	0	0	0	111.5	H139 Q163 N164 Q166 D172 Y173	H139-H168 PolarHBondContact NE2-O 3.28Å; Q163-H168 VanDerWaalsContact CA-O 3.31Å; Q163-H168 WeakPolarHBondContact CA-O 3.5Å; N164-H168 PolarHBondContact N-O 2.98Å; N164-H168 PolarHBondContact OD1-N 2.76Å; N164-H168 PolarHBondContact OD1-O 2.75Å; Q166-H168 PolarHBondContact OE1-ND1 3.36Å; H168-D172 WeakPolarHBondContact CA-OD2 3.42Å; H168-D172 HydrophobicContact CB-CB 4.29Å; H168-Y173 HydrophobicContact CB-CE2 3.77Å; H168-Y173 PolarHBondContact ND1-OH 3.38Å
169	L	93.6	Very high	90.8	Very high	46 Å²	46	55 Å²	55	24%	0.241	29%	0.288	C	S	.	.			trans	-87.1	167.6	170.6	-66.6	167.6	0	0	0	111	H139 Q163 V171 D172 Y173	H139-L169 VanDerWaalsContact CD2-C 3.48Å; H139-L169 VanDerWaalsContact NE2-C 3.26Å; Q163-L169 HydrophobicContact CG-CD2 3.49Å; Q163-L169 VanDerWaalsContact CG-CD2 3.49Å; Q163-L169 HydrophobicContact CG-CG 3.89Å; L169-V171 HydrophobicContact CB-CG2 3.65Å; L169-V171 HydrophobicContact CD1-CG2 4.06Å; L169-V171 PolarHBondContact O-N 3.46Å; L169-D172 PolarHBondContact N-OD2 3.35Å; L169-D172 WeakPolarHBondContact O-CB 3.5Å; L169-D172 PolarHBondContact O-N 2.99Å; L169-D172 VanDerWaalsContact O-N 3.15Å; L169-Y173 WeakPolarHBondContact O-CD2 3.36Å
170	A	92.4	Very high	90.8	Very high	1 Å²	1	59 Å²	59	1%	0.008	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-61.4	-33.4	175.3	0	0	0	0	0	112.5	L138 H139 V142 D172 Y173	L138-A170 HydrophobicContact CB-CB 4.46Å; L138-A170 HydrophobicContact CD2-CB 4.03Å; L138-A170 HydrophobicContact CG-CB 3.89Å; H139-A170 VanDerWaalsContact CD2-CA 3.49Å; H139-A170 WeakPolarHBondContact CD2-CA 3.31Å; H139-A170 PolarHBondContact CD2-N 3.48Å; H139-A170 PolarHBondContact NE2-N 2.85Å; H139-A170 VanDerWaalsContact NE2-N 3.17Å; V142-A170 WeakPolarHBondContact CG1-O 3.35Å; V142-A170 HydrophobicContact CG2-CB 4.37Å; A170-D172 VanDerWaalsContact C-N 3.26Å; A170-D172 PolarHBondContact O-N 2.92Å; A170-Y173 PolarHBondContact O-N 3.2Å
171	V	92.9	Very high	90.8	Very high	32 Å²	32	65.2 Å²	65.2	19%	0.194	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-61.5	-32.4	176.4	-70.9	0	0	0	0	113.1	L169 Y173 A174 L183	L169-V171 HydrophobicContact CB-CG2 3.65Å; L169-V171 HydrophobicContact CD1-CG2 4.06Å; L169-V171 PolarHBondContact O-N 3.46Å; V171-Y173 PolarHBondContact O-N 3.01Å; V171-A174 VanDerWaalsContact O-CB 3.26Å; V171-A174 WeakPolarHBondContact O-CB 3.4Å; V171-A174 PolarHBondContact O-N 2.88Å; V171-A174 VanDerWaalsContact O-N 3.08Å; V171-L183 HydrophobicContact CG1-CB 3.44Å; V171-L183 VanDerWaalsContact CG1-CB 3.44Å; V171-L183 HydrophobicContact CG1-CD1 4.06Å; V171-L183 HydrophobicContact CG1-CG 4.4Å
172	D	92.1	Very high	90.9	Very high	93 Å²	93	65 Å²	65	50%	0.497	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-70.1	-15.5	-175.4	-58	-30.2	0	0	0	112.4	H168 L169 A170	H168-D172 WeakPolarHBondContact CA-OD2 3.42Å; H168-D172 HydrophobicContact CB-CB 4.29Å; L169-D172 PolarHBondContact N-OD2 3.35Å; L169-D172 WeakPolarHBondContact O-CB 3.5Å; L169-D172 PolarHBondContact O-N 2.99Å; L169-D172 VanDerWaalsContact O-N 3.15Å; A170-D172 VanDerWaalsContact C-N 3.26Å; A170-D172 PolarHBondContact O-N 2.92Å
173	Y	90.6	Very high	90.9	Very high	37 Å²	37	64 Å²	64	15%	0.145	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-94.3	2.4	176.2	-67.9	-76.9	0	0	0	113.4	H139 L143 N164 H168 L169 A170 V171	H139-Y173 HydrophobicContact CB-CD2 4.48Å; H139-Y173 AromaticContact CD2-CD2 3.78Å; H139-Y173 AromaticContact CD2-CE2 3.7Å; L143-Y173 HydrophobicContact CD1-CD1 3.82Å; L143-Y173 HydrophobicContact CD1-CE1 4.5Å; N164-Y173 PolarHBondContact ND2-OH 3.03Å; H168-Y173 HydrophobicContact CB-CE2 3.77Å; H168-Y173 PolarHBondContact ND1-OH 3.38Å; L169-Y173 WeakPolarHBondContact O-CD2 3.36Å; A170-Y173 PolarHBondContact O-N 3.2Å; V171-Y173 PolarHBondContact O-N 3.01Å
174	A	91.2	Very high	90.9	Very high	28 Å²	28	61.9 Å²	61.9	23%	0.231	32%	0.32	C	S	.	.			trans	-69.2	134.2	-179.9	0	0	0	0	0	111.4	V142 V171 T179 E180	V142-A174 HydrophobicContact CG1-CB 4.02Å; V171-A174 VanDerWaalsContact O-CB 3.26Å; V171-A174 WeakPolarHBondContact O-CB 3.4Å; V171-A174 PolarHBondContact O-N 2.88Å; V171-A174 VanDerWaalsContact O-N 3.08Å; A174-T179 HydrophobicContact CB-CG2 4.01Å; A174-E180 HydrophobicContact CB-CB 4.25Å
175	F	85.6	Confident	91	Very high	135 Å²	135	64.8 Å²	64.8	59%	0.592	34%	0.341	S	S	*	.			trans	-91.1	-27	179.3	-63.5	-88.5	0	0	0	113.5	L143 N145	L143-F175 HydrophobicContact CD1-CZ 4.23Å; L143-F175 WeakPolarHBondContact O-CE2 3.37Å; L143-F175 VanDerWaalsContact O-CZ 3.3Å; L143-F175 WeakPolarHBondContact O-CZ 3.43Å; N145-F175 HydrophobicContact CB-CD2 4.02Å; N145-F175 HydrophobicContact CB-CE2 4.49Å
176	D	91.1	Very high	91.2	Very high	39 Å²	39	61.3 Å²	61.3	21%	0.209	32%	0.321	C	S	.	.	S	Bend	trans	-125.3	143.2	-174.6	61.1	-32	0	0	0	111.8	K147 Q178 T179 E180	K147-D176 IonicContact NZ-OD2 2.62Å; K147-D176 PolarHBondContact NZ-OD2 2.74Å; D176-Q178 PolarHBondContact O-N 3.04Å; D176-T179 PolarHBondContact O-N 3.49Å; D176-T179 WeakPolarHBondContact OD1-CB 3.45Å; D176-T179 PolarHBondContact OD1-OG1 2.73Å; D176-T179 PolarHBondContact OD2-OG1 2.69Å; D176-E180 PolarHBondContact O-N 3.14Å; D176-E180 VanDerWaalsContact O-N 3.11Å
177	D	90.7	Very high	91.5	Very high	119 Å²	119	59.7 Å²	59.7	64%	0.636	32%	0.318	S	S	*	.	H	α-helix	trans	-53.3	-31.3	177.2	-59.6	3.1	0	0	0	112.4	Q181	D177-Q181 WeakPolarHBondContact O-CB 3.05Å; D177-Q181 WeakPolarHBondContact O-CG 3.42Å; D177-Q181 PolarHBondContact O-N 3.45Å
178	Q	91	Very high	91.7	Very high	130 Å²	130	65 Å²	65	61%	0.607	33%	0.332	S	S	*	.	H	α-helix	trans	-65	-41	177.3	-64.2	-175.3	-3.9	0	0	112.2	K147 D176 L182	K147-Q178 VanDerWaalsContact NZ-OE1 3.13Å; D176-Q178 PolarHBondContact O-N 3.04Å; Q178-L182 WeakPolarHBondContact O-CB 3.44Å; Q178-L182 PolarHBondContact O-N 3.32Å
179	T	91.6	Very high	91.6	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.006	34%	0.34	C	S	.	.	H	α-helix	trans	-74.1	-39.4	178.9	-62.5	0	0	0	0	110.6	V142 M150 A174 D176 Q181 L182 L183	V142-T179 HydrophobicContact CG1-CG2 4.14Å; M150-T179 HydrophobicContact CE-CG2 3.74Å; M150-T179 HydrophobicContact SD-CG2 3.65Å; A174-T179 HydrophobicContact CB-CG2 4.01Å; D176-T179 PolarHBondContact O-N 3.49Å; D176-T179 WeakPolarHBondContact OD1-CB 3.45Å; D176-T179 PolarHBondContact OD1-OG1 2.73Å; D176-T179 PolarHBondContact OD2-OG1 2.69Å; T179-Q181 VanDerWaalsContact C-N 3.34Å; T179-Q181 PolarHBondContact O-N 2.79Å; T179-L182 PolarHBondContact O-N 3.23Å; T179-L183 HydrophobicContact CG2-CD1 3.86Å; T179-L183 HydrophobicContact CG2-CG 4.23Å; T179-L183 WeakPolarHBondContact O-CB 3.33Å; T179-L183 WeakPolarHBondContact O-CG 3.43Å; T179-L183 PolarHBondContact O-N 3.42Å
180	E	92.3	Very high	91.5	Very high	104 Å²	104	65.4 Å²	65.4	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-58.5	-46.3	173.1	-170.3	-173.7	165.8	0	0	110.9	A174 D176 L182 L183 T184	A174-E180 HydrophobicContact CB-CB 4.25Å; D176-E180 PolarHBondContact O-N 3.14Å; D176-E180 VanDerWaalsContact O-N 3.11Å; E180-L182 PolarHBondContact O-N 2.75Å; E180-L183 PolarHBondContact O-N 2.8Å; E180-T184 VanDerWaalsContact O-CB 3.23Å; E180-T184 WeakPolarHBondContact O-CB 3.34Å; E180-T184 PolarHBondContact O-N 3.42Å; E180-T184 PolarHBondContact O-OG1 3.16Å
181	Q	92.6	Very high	91.3	Very high	134 Å²	134	66.7 Å²	66.7	63%	0.626	34%	0.343	S	S	*	.	H	α-helix	trans	-62.7	-42.9	175.8	-73.5	172.7	23.9	0	0	112.5	D177 T179 T184 S185	D177-Q181 WeakPolarHBondContact O-CB 3.05Å; D177-Q181 WeakPolarHBondContact O-CG 3.42Å; D177-Q181 PolarHBondContact O-N 3.45Å; T179-Q181 VanDerWaalsContact C-N 3.34Å; T179-Q181 PolarHBondContact O-N 2.79Å; Q181-T184 PolarHBondContact O-N 3.01Å; Q181-S185 WeakPolarHBondContact O-CB 3.5Å; Q181-S185 PolarHBondContact O-N 3.22Å; Q181-S185 PolarHBondContact O-OG 3.43Å
182	L	92	Very high	91	Very high	60 Å²	60	71.6 Å²	71.6	31%	0.314	36%	0.364	S	S	.	.	H	α-helix	trans	-59.8	-52	177.6	178.9	63.6	0	0	0	111	M154 Q178 T179 E180 S185 Y186	M154-L182 HydrophobicContact CE-CD1 4.49Å; M154-L182 HydrophobicContact CE-CD2 3.96Å; M154-L182 HydrophobicContact CE-CG 4.14Å; Q178-L182 WeakPolarHBondContact O-CB 3.44Å; Q178-L182 PolarHBondContact O-N 3.32Å; T179-L182 PolarHBondContact O-N 3.23Å; E180-L182 PolarHBondContact O-N 2.75Å; L182-S185 PolarHBondContact O-N 3.09Å; L182-S185 PolarHBondContact O-OG 2.9Å; L182-Y186 WeakPolarHBondContact O-CB 3.21Å; L182-Y186 PolarHBondContact O-N 3.38Å
183	L	91.9	Very high	90.8	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67.3	-36.5	179.4	-67.6	170.9	0	0	0	112.2	L138 V142 M154 V171 T179 E180 S185 Y186 S187	L138-L183 HydrophobicContact CD1-CD2 4.36Å; V142-L183 HydrophobicContact CB-CD1 4.4Å; V142-L183 HydrophobicContact CG1-CD1 3.89Å; V142-L183 HydrophobicContact CG2-CD1 3.53Å; V142-L183 HydrophobicContact CG2-CD2 4.08Å; V142-L183 HydrophobicContact CG2-CG 4.38Å; M154-L183 HydrophobicContact SD-CD2 4.45Å; V171-L183 HydrophobicContact CG1-CB 3.44Å; V171-L183 VanDerWaalsContact CG1-CB 3.44Å; V171-L183 HydrophobicContact CG1-CD1 4.06Å; V171-L183 HydrophobicContact CG1-CG 4.4Å; T179-L183 HydrophobicContact CG2-CD1 3.86Å; T179-L183 HydrophobicContact CG2-CG 4.23Å; T179-L183 WeakPolarHBondContact O-CB 3.33Å; T179-L183 WeakPolarHBondContact O-CG 3.43Å; T179-L183 PolarHBondContact O-N 3.42Å; E180-L183 PolarHBondContact O-N 2.8Å; L183-S185 VanDerWaalsContact C-N 3.34Å; L183-S185 PolarHBondContact O-N 2.71Å; L183-Y186 PolarHBondContact O-N 3.42Å; L183-S187 VanDerWaalsContact O-CB 3.29Å; L183-S187 WeakPolarHBondContact O-CB 3.46Å; L183-S187 PolarHBondContact O-N 2.91Å
184	T	92.4	Very high	90.6	Very high	58 Å²	58	72.4 Å²	72.4	36%	0.356	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-44.6	173.2	-59.7	0	0	0	0	110.9	E180 Q181 S187 K188	E180-T184 VanDerWaalsContact O-CB 3.23Å; E180-T184 WeakPolarHBondContact O-CB 3.34Å; E180-T184 PolarHBondContact O-N 3.42Å; E180-T184 PolarHBondContact O-OG1 3.16Å; Q181-T184 PolarHBondContact O-N 3.01Å; T184-S187 PolarHBondContact O-N 3.44Å; T184-K188 WeakPolarHBondContact O-CG 3.33Å; T184-K188 PolarHBondContact O-N 3.48Å; T184-K188 VanDerWaalsContact O-N 3.16Å
185	S	92.9	Very high	90.2	Very high	68 Å²	68	76.5 Å²	76.5	48%	0.476	38%	0.382	S	S	.	.	H	α-helix	trans	-65.8	-39.2	177	77.1	0	0	0	0	112.2	Q181 L182 L183 K189	Q181-S185 WeakPolarHBondContact O-CB 3.5Å; Q181-S185 PolarHBondContact O-N 3.22Å; Q181-S185 PolarHBondContact O-OG 3.43Å; L182-S185 PolarHBondContact O-N 3.09Å; L182-S185 PolarHBondContact O-OG 2.9Å; L183-S185 VanDerWaalsContact C-N 3.34Å; L183-S185 PolarHBondContact O-N 2.71Å; S185-K189 WeakPolarHBondContact O-CB 3.27Å; S185-K189 PolarHBondContact O-N 3.41Å; S185-K189 VanDerWaalsContact O-N 3.08Å
186	Y	93	Very high	90.1	Very high	19 Å²	19	73.5 Å²	73.5	8%	0.075	37%	0.37	C	S	.	.	H	α-helix	trans	-66.4	-42.4	175.5	176.5	-109.5	0	0	0	111.6	M154 N157 A158 P160 L182 L183 K188 K189 Y190	M154-Y186 HydrophobicContact CB-CD2 3.99Å; M154-Y186 HydrophobicContact CB-CE1 4.39Å; M154-Y186 HydrophobicContact CB-CE2 3.69Å; M154-Y186 HydrophobicContact CB-CG 4.46Å; M154-Y186 HydrophobicContact CG-CD1 3.76Å; M154-Y186 HydrophobicContact CG-CD2 3.87Å; M154-Y186 HydrophobicContact CG-CE1 3.74Å; M154-Y186 HydrophobicContact CG-CE2 3.85Å; M154-Y186 HydrophobicContact CG-CG 3.83Å; M154-Y186 HydrophobicContact SD-CD1 3.79Å; M154-Y186 HydrophobicContact SD-CD2 3.8Å; M154-Y186 HydrophobicContact SD-CE1 4.39Å; M154-Y186 HydrophobicContact SD-CE2 4.4Å; M154-Y186 HydrophobicContact SD-CG 3.46Å; N157-Y186 WeakPolarHBondContact CA-OH 3.44Å; A158-Y186 PolarHBondContact N-OH 3.27Å; A158-Y186 VanDerWaalsContact O-CE1 3.24Å; A158-Y186 WeakPolarHBondContact O-CE1 3.41Å; A158-Y186 PolarHBondContact O-OH 3.22Å; P160-Y186 HydrophobicContact CB-CD1 3.9Å; P160-Y186 HydrophobicContact CB-CE1 3.95Å; P160-Y186 HydrophobicContact CG-CD1 3.77Å; P160-Y186 HydrophobicContact CG-CE1 3.67Å; L182-Y186 WeakPolarHBondContact O-CB 3.21Å; L182-Y186 PolarHBondContact O-N 3.38Å; L183-Y186 PolarHBondContact O-N 3.42Å; Y186-K188 VanDerWaalsContact C-N 3.34Å; Y186-K188 PolarHBondContact O-N 3.04Å; Y186-K189 CarbonylContact O-C 3.55Å; Y186-K189 PolarHBondContact O-N 3.43Å; Y186-Y190 WeakPolarHBondContact O-CB 3.44Å; Y186-Y190 PolarHBondContact O-N 3.32Å
187	S	91.4	Very high	89.8	Confident	42 Å²	42	76.9 Å²	76.9	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-59	-44.3	177.4	-177.6	0	0	0	0	111.9	L183 T184 Y190 G191	L183-S187 VanDerWaalsContact O-CB 3.29Å; L183-S187 WeakPolarHBondContact O-CB 3.46Å; L183-S187 PolarHBondContact O-N 2.91Å; T184-S187 PolarHBondContact O-N 3.44Å; S187-Y190 PolarHBondContact O-N 2.92Å; S187-G191 PolarHBondContact O-N 2.92Å
188	K	91.5	Very high	89.4	Confident	145 Å²	145	74 Å²	74	63%	0.63	36%	0.363	S	S	*	.	H	α-helix	trans	-59.9	-51.8	173	-69.8	-179.8	-177.7	-177.3	0	111.8	T184 Y186 Y190 G191 E192	T184-K188 WeakPolarHBondContact O-CG 3.33Å; T184-K188 PolarHBondContact O-N 3.48Å; T184-K188 VanDerWaalsContact O-N 3.16Å; Y186-K188 VanDerWaalsContact C-N 3.34Å; Y186-K188 PolarHBondContact O-N 3.04Å; K188-Y190 VanDerWaalsContact C-N 3.33Å; K188-Y190 PolarHBondContact O-N 3.06Å; K188-G191 PolarHBondContact O-N 2.56Å; K188-E192 PolarHBondContact O-N 2.79Å
189	K	90.8	Very high	89	Confident	119 Å²	119	73.3 Å²	73.3	52%	0.517	35%	0.354	S	S	.	.	H	α-helix	trans	-61.9	-39.5	179.4	-174.5	-179.4	179.3	-176.4	0	112.4	S185 Y186 E192 Q193	S185-K189 WeakPolarHBondContact O-CB 3.27Å; S185-K189 PolarHBondContact O-N 3.41Å; S185-K189 VanDerWaalsContact O-N 3.08Å; Y186-K189 CarbonylContact O-C 3.55Å; Y186-K189 PolarHBondContact O-N 3.43Å; K189-E192 PolarHBondContact O-N 2.78Å; K189-Q193 WeakPolarHBondContact O-CB 3.34Å; K189-Q193 VanDerWaalsContact O-CG 3.27Å; K189-Q193 WeakPolarHBondContact O-CG 3.29Å; K189-Q193 PolarHBondContact O-N 3.42Å
190	Y	91.5	Very high	88.7	Confident	10 Å²	10	77.7 Å²	77.7	4%	0.039	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-42.7	177.1	-179.7	-92	0	0	0	110.4	N157 D159 P160 Y186 S187 K188 E192 Q193 K194	N157-Y190 HydrophobicContact CB-CE2 4.45Å; N157-Y190 WeakPolarHBondContact O-CE2 3.24Å; D159-Y190 HydrophobicContact CB-CE1 4.09Å; D159-Y190 HydrophobicContact CB-CE2 4.49Å; D159-Y190 WeakPolarHBondContact CB-OH 3.14Å; D159-Y190 WeakPolarHBondContact OD1-CE1 3.29Å; D159-Y190 WeakPolarHBondContact OD2-CE1 3.47Å; D159-Y190 PolarHBondContact OD2-OH 3.24Å; P160-Y190 VanDerWaalsContact CD-CD1 3.43Å; P160-Y190 HydrophobicContact CG-CD1 4.05Å; P160-Y190 HydrophobicContact CG-CG 4.03Å; Y186-Y190 WeakPolarHBondContact O-CB 3.44Å; Y186-Y190 PolarHBondContact O-N 3.32Å; S187-Y190 PolarHBondContact O-N 2.92Å; K188-Y190 VanDerWaalsContact C-N 3.33Å; K188-Y190 PolarHBondContact O-N 3.06Å; Y190-E192 PolarHBondContact O-N 3.49Å; Y190-Q193 PolarHBondContact O-N 3.3Å; Y190-K194 HydrophobicContact CE1-CB 4.46Å; Y190-K194 HydrophobicContact CE1-CD 4.13Å; Y190-K194 WeakPolarHBondContact O-CB 3.4Å; Y190-K194 PolarHBondContact O-N 3.48Å
191	G	87.4	Confident	88.1	Confident	27 Å²	27	76 Å²	76	28%	0.278	37%	0.369	S	S	.	.	H	α-helix	trans	-55.7	-49	172.3	0	0	0	0	0	112.3	S187 K188 Q193 K194 I195	S187-G191 PolarHBondContact O-N 2.92Å; K188-G191 PolarHBondContact O-N 2.56Å; G191-Q193 PolarHBondContact O-N 2.75Å; G191-K194 PolarHBondContact O-N 2.98Å; G191-I195 VanDerWaalsContact O-CG1 3.29Å; G191-I195 WeakPolarHBondContact O-CG1 3.22Å; G191-I195 PolarHBondContact O-N 3.42Å
192	E	87.8	Confident	87.5	Confident	136 Å²	136	73.1 Å²	73.1	64%	0.636	35%	0.353	S	S	*	.	H	α-helix	trans	-60.7	-45.4	176.1	-68.4	171.8	-178.8	0	0	112.3	K188 K189 Y190 K194 I195 E196	K188-E192 PolarHBondContact O-N 2.79Å; K189-E192 PolarHBondContact O-N 2.78Å; Y190-E192 PolarHBondContact O-N 3.49Å; E192-K194 VanDerWaalsContact C-N 3.35Å; E192-K194 PolarHBondContact O-N 2.97Å; E192-I195 PolarHBondContact O-N 2.85Å; E192-E196 PolarHBondContact O-N 3.5Å
193	Q	87.8	Confident	87	Confident	70 Å²	70	76.7 Å²	76.7	33%	0.327	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-36.4	177.5	-74.7	-179.9	-5.3	0	0	112.7	K189 Y190 G191 E196 R197	K189-Q193 WeakPolarHBondContact O-CB 3.34Å; K189-Q193 VanDerWaalsContact O-CG 3.27Å; K189-Q193 WeakPolarHBondContact O-CG 3.29Å; K189-Q193 PolarHBondContact O-N 3.42Å; Y190-Q193 PolarHBondContact O-N 3.3Å; G191-Q193 PolarHBondContact O-N 2.75Å; Q193-E196 PolarHBondContact O-N 3.49Å; Q193-R197 VanDerWaalsContact O-CB 3.22Å; Q193-R197 WeakPolarHBondContact O-CB 3.43Å; Q193-R197 PolarHBondContact O-N 3.28Å
194	K	85.8	Confident	86.3	Confident	76 Å²	76	84 Å²	84	33%	0.33	40%	0.398	S	S	.	.	H	α-helix	trans	-64.5	-48	176.4	-178.6	178.7	179.8	175.9	0	110	Y190 G191 E192 E196 R197 E198	Y190-K194 HydrophobicContact CE1-CB 4.46Å; Y190-K194 HydrophobicContact CE1-CD 4.13Å; Y190-K194 WeakPolarHBondContact O-CB 3.4Å; Y190-K194 PolarHBondContact O-N 3.48Å; G191-K194 PolarHBondContact O-N 2.98Å; E192-K194 VanDerWaalsContact C-N 3.35Å; E192-K194 PolarHBondContact O-N 2.97Å; K194-E196 PolarHBondContact O-N 3.22Å; K194-R197 PolarHBondContact O-N 3.31Å; K194-E198 WeakPolarHBondContact O-CB 3.2Å; K194-E198 WeakPolarHBondContact O-CG 3.25Å; K194-E198 PolarHBondContact O-N 2.87Å
195	I	82.4	Confident	85.7	Confident	114 Å²	114	85.4 Å²	85.4	59%	0.585	40%	0.399	S	S	*	.	H	α-helix	trans	-58.5	-48.2	175.5	-67.8	165.1	0	0	0	110.6	G191 E192 R197 E198 R199	G191-I195 VanDerWaalsContact O-CG1 3.29Å; G191-I195 WeakPolarHBondContact O-CG1 3.22Å; G191-I195 PolarHBondContact O-N 3.42Å; E192-I195 PolarHBondContact O-N 2.85Å; I195-R197 PolarHBondContact O-N 2.83Å; I195-E198 PolarHBondContact O-N 3.37Å; I195-R199 VanDerWaalsContact O-CB 3.32Å; I195-R199 WeakPolarHBondContact O-CB 3.32Å; I195-R199 PolarHBondContact O-N 2.89Å
196	E	84.5	Confident	85.3	Confident	73 Å²	73	83.8 Å²	83.8	34%	0.341	39%	0.387	S	S	.	.	H	α-helix	trans	-66.1	-37.2	179.2	-175.2	58	-155.1	0	0	111.9	E192 Q193 K194 R199 L200	E192-E196 PolarHBondContact O-N 3.5Å; Q193-E196 PolarHBondContact O-N 3.49Å; K194-E196 PolarHBondContact O-N 3.22Å; E196-R199 WeakPolarHBondContact O-CB 3.46Å; E196-R199 PolarHBondContact O-N 2.87Å; E196-R199 WeakPolarHBondContact OE2-CD 3.45Å; E196-R199 IonicContact OE2-NH1 3.7Å; E196-R199 PolarHBondContact OE2-NH1 3.46Å; E196-L200 HydrophobicContact CG-CD1 4.29Å; E196-L200 HydrophobicContact CG-CG 4.45Å; E196-L200 WeakPolarHBondContact O-CB 3.49Å; E196-L200 VanDerWaalsContact O-CG 3.25Å; E196-L200 WeakPolarHBondContact O-CG 3.49Å; E196-L200 PolarHBondContact O-N 3.46Å
197	R	85.1	Confident	85	Confident	110 Å²	110	83.2 Å²	83.2	42%	0.415	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-45.8	175.3	-171.1	-172.4	-54.5	157.5	7.4	111.5	N157 Q193 K194 I195 R199 L200 E201	N157-R197 PolarHBondContact ND2-NH2 2.62Å; Q193-R197 VanDerWaalsContact O-CB 3.22Å; Q193-R197 WeakPolarHBondContact O-CB 3.43Å; Q193-R197 PolarHBondContact O-N 3.28Å; K194-R197 PolarHBondContact O-N 3.31Å; I195-R197 PolarHBondContact O-N 2.83Å; R197-R199 VanDerWaalsContact C-N 3.32Å; R197-L200 PolarHBondContact O-N 3.25Å; R197-E201 WeakPolarHBondContact O-CB 3.32Å; R197-E201 PolarHBondContact O-N 3.29Å
198	E	82.7	Confident	85	Confident	59 Å²	59	83 Å²	83	28%	0.276	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-42.3	175.1	-72.6	176.7	-177.5	0	0	110.6	K194 I195 L200 E201 R202	K194-E198 WeakPolarHBondContact O-CB 3.2Å; K194-E198 WeakPolarHBondContact O-CG 3.25Å; K194-E198 PolarHBondContact O-N 2.87Å; I195-E198 PolarHBondContact O-N 3.37Å; E198-L200 PolarHBondContact O-N 3.47Å; E198-E201 WeakPolarHBondContact O-CB 3.37Å; E198-E201 PolarHBondContact O-N 3.42Å; E198-R202 VanDerWaalsContact O-CG 3.24Å; E198-R202 WeakPolarHBondContact O-CG 3.24Å; E198-R202 PolarHBondContact O-N 3.2Å; E198-R202 IonicContact OE2-NH2 3.09Å
199	R	82.6	Confident	84.8	Confident	114 Å²	114	81.7 Å²	81.7	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-60.7	-43.2	174.7	-170.7	-170.3	-173.4	-167.2	6.3	112.8	I195 E196 R197 R202 K203	I195-R199 VanDerWaalsContact O-CB 3.32Å; I195-R199 WeakPolarHBondContact O-CB 3.32Å; I195-R199 PolarHBondContact O-N 2.89Å; E196-R199 WeakPolarHBondContact O-CB 3.46Å; E196-R199 PolarHBondContact O-N 2.87Å; E196-R199 WeakPolarHBondContact OE2-CD 3.45Å; E196-R199 IonicContact OE2-NH1 3.7Å; E196-R199 PolarHBondContact OE2-NH1 3.46Å; R197-R199 VanDerWaalsContact C-N 3.32Å; R199-R202 PolarHBondContact O-N 3.31Å; R199-K203 PolarHBondContact O-N 3.46Å; R199-K203 VanDerWaalsContact O-N 3.09Å
200	L	83.5	Confident	84.6	Confident	93 Å²	93	79.8 Å²	79.8	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-66	-38.6	175	-70.2	172.5	0	0	0	111.4	E196 R197 E198 K203 K204	E196-L200 HydrophobicContact CG-CD1 4.29Å; E196-L200 HydrophobicContact CG-CG 4.45Å; E196-L200 WeakPolarHBondContact O-CB 3.49Å; E196-L200 VanDerWaalsContact O-CG 3.25Å; E196-L200 WeakPolarHBondContact O-CG 3.49Å; E196-L200 PolarHBondContact O-N 3.46Å; R197-L200 PolarHBondContact O-N 3.25Å; E198-L200 PolarHBondContact O-N 3.47Å; L200-K203 PolarHBondContact O-N 3.4Å; L200-K204 WeakPolarHBondContact O-CB 3.18Å; L200-K204 PolarHBondContact O-N 3.19Å
201	E	80.7	Confident	84.6	Confident	69 Å²	69	79.4 Å²	79.4	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-61.2	-43.8	174.3	-166.7	-174.3	169.4	0	0	111.2	R197 E198 K203 K204 F205 R210 K268	R197-E201 WeakPolarHBondContact O-CB 3.32Å; R197-E201 PolarHBondContact O-N 3.29Å; E198-E201 WeakPolarHBondContact O-CB 3.37Å; E198-E201 PolarHBondContact O-N 3.42Å; E201-K203 PolarHBondContact O-N 2.89Å; E201-K204 PolarHBondContact O-N 2.91Å; E201-F205 PolarHBondContact O-N 3.18Å; E201-R210 IonicContact OE1-NH2 2.86Å; E201-R210 PolarHBondContact OE1-NH2 2.79Å; E201-K268 IonicContact OE2-NZ 3.14Å; E201-K268 PolarHBondContact OE2-NZ 2.99Å
202	R	80.6	Confident	84.7	Confident	73 Å²	73	82.5 Å²	82.5	28%	0.275	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-40.2	176	-67.9	171.1	-171.2	164.4	8.8	112.3	E198 R199 F205 P206 E233	E198-R202 VanDerWaalsContact O-CG 3.24Å; E198-R202 WeakPolarHBondContact O-CG 3.24Å; E198-R202 PolarHBondContact O-N 3.2Å; E198-R202 IonicContact OE2-NH2 3.09Å; R199-R202 PolarHBondContact O-N 3.31Å; R202-F205 CarbonylContact O-C 3.47Å; R202-P206 WeakPolarHBondContact O-CA 3.35Å; R202-E233 WeakPolarHBondContact CD-OE2 3.42Å; R202-E233 VanDerWaalsContact CZ-CD 3.44Å; R202-E233 IonicContact CZ-OE1 3.21Å; R202-E233 IonicContact CZ-OE2 3.27Å; R202-E233 IonicContact NE-OE1 2.69Å; R202-E233 PolarHBondContact NE-OE1 3.09Å; R202-E233 IonicContact NE-OE2 3.82Å; R202-E233 PolarHBondContact NE-OE2 3.13Å; R202-E233 IonicContact NH1-OE2 3.96Å; R202-E233 IonicContact NH2-OE1 3.8Å
203	K	80.2	Confident	84.8	Confident	136 Å²	136	83.1 Å²	83.1	59%	0.591	37%	0.37	S	S	*	.	H	α-helix	trans	-65	-41.2	174.1	-74.1	178.7	-179.3	173.1	0	112.2	R199 L200 E201	R199-K203 PolarHBondContact O-N 3.46Å; R199-K203 VanDerWaalsContact O-N 3.09Å; L200-K203 PolarHBondContact O-N 3.4Å; E201-K203 PolarHBondContact O-N 2.89Å
204	K	78	Confident	84.9	Confident	154 Å²	154	85.3 Å²	85.3	67%	0.67	38%	0.376	S	S	*	.	H	α-helix	trans	-70.6	-33.9	-178.7	-170.2	175.3	178.7	179.1	0	112.1	L200 E201	L200-K204 WeakPolarHBondContact O-CB 3.18Å; L200-K204 PolarHBondContact O-N 3.19Å; E201-K204 PolarHBondContact O-N 2.91Å
205	F	78.7	Confident	85.2	Confident	87 Å²	87	82.2 Å²	82.2	38%	0.382	36%	0.363	S	S	.	.	S	Bend	trans	-135	77.5	-177.3	-60.6	-70.8	0	0	0	111.3	E201 R202 R210	E201-F205 PolarHBondContact O-N 3.18Å; R202-F205 CarbonylContact O-C 3.47Å; F205-R210 PolarHBondContact O-NE 3.47Å
206	P	85	Confident	85.7	Confident	34 Å²	34	77.9 Å²	77.9	22%	0.221	34%	0.341	C	S	.	.			trans	-61.4	147.9	-176.9	26	-34.5	0	0	0	111.6	R202 E208 Q209 R210	R202-P206 WeakPolarHBondContact O-CA 3.35Å; P206-E208 VanDerWaalsContact C-N 3.27Å; P206-E208 PolarHBondContact O-N 2.99Å; P206-Q209 HydrophobicContact CG-CB 4.13Å; P206-Q209 VanDerWaalsContact CG-CD 3.44Å; P206-Q209 HydrophobicContact CG-CG 3.75Å; P206-Q209 PolarHBondContact O-N 3.05Å; P206-Q209 VanDerWaalsContact O-N 3.15Å; P206-R210 PolarHBondContact O-N 3.26Å
207	F	87.3	Confident	86	Confident	7 Å²	7	75 Å²	75	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-49.1	-47.8	-179.2	169.6	-101	0	0	0	112.2	Q209 R210 V211 I222 V225 A226 I229 L258 V262 Y265	F207-Q209 VanDerWaalsContact C-N 3.31Å; F207-Q209 PolarHBondContact O-N 3.38Å; F207-R210 PolarHBondContact O-N 3.21Å; F207-V211 HydrophobicContact CD1-CG2 4.19Å; F207-V211 HydrophobicContact CD2-CG2 3.88Å; F207-V211 HydrophobicContact CE1-CG2 3.82Å; F207-V211 HydrophobicContact CE2-CG2 3.43Å; F207-V211 VanDerWaalsContact CE2-CG2 3.43Å; F207-V211 HydrophobicContact CG-CG2 4.25Å; F207-V211 HydrophobicContact CZ-CG2 3.43Å; F207-V211 VanDerWaalsContact CZ-CG2 3.43Å; F207-V211 WeakPolarHBondContact O-CG2 3.34Å; F207-V211 PolarHBondContact O-N 3.06Å; F207-I222 HydrophobicContact CD1-CG2 4.48Å; F207-I222 HydrophobicContact CE1-CG2 4.17Å; F207-V225 HydrophobicContact CE1-CG1 4.2Å; F207-V225 HydrophobicContact CZ-CG1 4.03Å; F207-A226 HydrophobicContact CD1-CB 3.45Å; F207-A226 VanDerWaalsContact CD1-CB 3.45Å; F207-A226 HydrophobicContact CE1-CB 3.92Å; F207-A226 HydrophobicContact CG-CB 4.48Å; F207-I229 HydrophobicContact CE2-CD1 4.2Å; F207-I229 HydrophobicContact CZ-CD1 4.18Å; F207-L258 HydrophobicContact CZ-CD1 4.35Å; F207-V262 HydrophobicContact CE2-CB 4.5Å; F207-V262 HydrophobicContact CE2-CG2 3.88Å; F207-V262 HydrophobicContact CZ-CG2 3.64Å; F207-Y265 HydrophobicContact CB-CD1 4.49Å; F207-Y265 HydrophobicContact CB-CD2 4.38Å; F207-Y265 HydrophobicContact CB-CE1 4.11Å; F207-Y265 HydrophobicContact CB-CE2 3.97Å; F207-Y265 AromaticContact CD2-CD1 3.61Å; F207-Y265 HydrophobicContact CD2-CD1 3.61Å; F207-Y265 HydrophobicContact CD2-CD2 4.01Å; F207-Y265 HydrophobicContact CD2-CE1 4.06Å; F207-Y265 HydrophobicContact CD2-CE2 4.4Å; F207-Y265 AromaticContact CD2-CG 3.59Å; F207-Y265 HydrophobicContact CD2-CG 3.59Å; F207-Y265 HydrophobicContact CE2-CD1 4.36Å; F207-Y265 HydrophobicContact CE2-CG 4.32Å; F207-Y265 HydrophobicContact CG-CD1 4.47Å
208	E	90.5	Very high	86.4	Confident	38 Å²	38	70.2 Å²	70.2	18%	0.178	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-43.2	-176.7	-61.2	89.6	157.6	0	0	111.5	P206 R210 V211 K212 I222 A226 R230	P206-E208 VanDerWaalsContact C-N 3.27Å; P206-E208 PolarHBondContact O-N 2.99Å; E208-R210 VanDerWaalsContact C-N 3.35Å; E208-R210 PolarHBondContact O-N 3.08Å; E208-V211 PolarHBondContact O-N 3Å; E208-K212 WeakPolarHBondContact O-CB 3.15Å; E208-K212 WeakPolarHBondContact O-CG 3.41Å; E208-K212 PolarHBondContact O-N 3Å; E208-I222 HydrophobicContact CB-CG2 4.05Å; E208-I222 HydrophobicContact CG-CG2 3.91Å; E208-A226 VanDerWaalsContact CD-CB 3.43Å; E208-A226 HydrophobicContact CG-CB 3.78Å; E208-A226 WeakPolarHBondContact OE1-CB 3.34Å; E208-R230 IonicContact OE1-CZ 3.42Å; E208-R230 IonicContact OE1-NE 3.46Å; E208-R230 IonicContact OE1-NH2 2.71Å; E208-R230 PolarHBondContact OE1-NH2 2.96Å
209	Q	88.5	Confident	86.8	Confident	116 Å²	116	70.8 Å²	70.8	54%	0.542	32%	0.315	S	S	.	.	H	α-helix	trans	-68.5	-33.2	179.3	-70.7	178.6	10.7	0	0	112.7	P206 F207	P206-Q209 HydrophobicContact CG-CB 4.13Å; P206-Q209 VanDerWaalsContact CG-CD 3.44Å; P206-Q209 HydrophobicContact CG-CG 3.75Å; P206-Q209 PolarHBondContact O-N 3.05Å; P206-Q209 VanDerWaalsContact O-N 3.15Å; F207-Q209 VanDerWaalsContact C-N 3.31Å; F207-Q209 PolarHBondContact O-N 3.38Å
210	R	86.3	Confident	87.2	Confident	80 Å²	80	67.1 Å²	67.1	30%	0.302	31%	0.312	S	S	.	.	H	α-helix	trans	-70.1	-46.1	176.3	-72.6	178.3	179.9	-114.8	9.3	110.7	E201 F205 P206 F207 E208 K212 K213 Y214	E201-R210 IonicContact OE1-NH2 2.86Å; E201-R210 PolarHBondContact OE1-NH2 2.79Å; F205-R210 PolarHBondContact O-NE 3.47Å; P206-R210 PolarHBondContact O-N 3.26Å; F207-R210 PolarHBondContact O-N 3.21Å; E208-R210 VanDerWaalsContact C-N 3.35Å; E208-R210 PolarHBondContact O-N 3.08Å; R210-K212 VanDerWaalsContact C-N 3.35Å; R210-K212 PolarHBondContact O-N 3.15Å; R210-K213 WeakPolarHBondContact O-CB 3.37Å; R210-K213 PolarHBondContact O-N 3.24Å; R210-Y214 WeakPolarHBondContact O-CD2 3.41Å
211	V	91	Very high	87.7	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-42.1	179	176.9	0	0	0	0	111.1	F207 E208 K213 Y214 L215 I222 L258 Q261	F207-V211 HydrophobicContact CD1-CG2 4.19Å; F207-V211 HydrophobicContact CD2-CG2 3.88Å; F207-V211 HydrophobicContact CE1-CG2 3.82Å; F207-V211 HydrophobicContact CE2-CG2 3.43Å; F207-V211 VanDerWaalsContact CE2-CG2 3.43Å; F207-V211 HydrophobicContact CG-CG2 4.25Å; F207-V211 HydrophobicContact CZ-CG2 3.43Å; F207-V211 VanDerWaalsContact CZ-CG2 3.43Å; F207-V211 WeakPolarHBondContact O-CG2 3.34Å; F207-V211 PolarHBondContact O-N 3.06Å; E208-V211 PolarHBondContact O-N 3Å; V211-K213 PolarHBondContact O-N 3.32Å; V211-Y214 PolarHBondContact O-N 3.5Å; V211-L215 HydrophobicContact CG1-CB 3.86Å; V211-L215 HydrophobicContact CG1-CD2 4.03Å; V211-L215 PolarHBondContact O-N 3.44Å; V211-I222 HydrophobicContact CB-CG2 4.36Å; V211-I222 HydrophobicContact CG1-CD1 3.88Å; V211-I222 HydrophobicContact CG1-CG1 3.94Å; V211-I222 HydrophobicContact CG1-CG2 4.36Å; V211-L258 HydrophobicContact CG1-CD1 3.67Å; V211-L258 HydrophobicContact CG2-CD1 4.46Å; V211-Q261 HydrophobicContact CG1-CB 4.44Å; V211-Q261 HydrophobicContact CG2-CB 4.03Å
212	K	90.3	Very high	88.4	Confident	91 Å²	91	59.5 Å²	59.5	40%	0.396	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-19.9	178.4	-75.8	177.5	-165.4	-146.8	0	115	E208 R210 Y214 L215 E219 I222	E208-K212 WeakPolarHBondContact O-CB 3.15Å; E208-K212 WeakPolarHBondContact O-CG 3.41Å; E208-K212 PolarHBondContact O-N 3Å; R210-K212 VanDerWaalsContact C-N 3.35Å; R210-K212 PolarHBondContact O-N 3.15Å; K212-Y214 VanDerWaalsContact C-N 3.3Å; K212-L215 CarbonylContact C-O 3.57Å; K212-L215 WeakPolarHBondContact CA-O 3.34Å; K212-E219 VanDerWaalsContact CE-CD 3.46Å; K212-E219 WeakPolarHBondContact CE-OE1 3.26Å; K212-E219 WeakPolarHBondContact CE-OE2 3.47Å; K212-E219 IonicContact NZ-OE1 3.73Å; K212-E219 PolarHBondContact NZ-OE1 3.03Å; K212-E219 IonicContact NZ-OE2 2.63Å; K212-E219 PolarHBondContact NZ-OE2 3.5Å; K212-I222 HydrophobicContact CG-CD1 4.29Å
213	K	89	Confident	89	Confident	149 Å²	149	58.7 Å²	58.7	65%	0.648	28%	0.28	S	S	*	.	H	α-helix	trans	-69.9	-31.2	172.5	-65.1	-179.5	-179.6	-176.6	0	112	R210 V211 K449	R210-K213 WeakPolarHBondContact O-CB 3.37Å; R210-K213 PolarHBondContact O-N 3.24Å; V211-K213 PolarHBondContact O-N 3.32Å; K213-K449 PolarHBondContact O-NZ 2.64Å
214	Y	89.9	Confident	89.6	Confident	116 Å²	116	53.5 Å²	53.5	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-106.4	-33.4	-173.8	-63.1	-79.5	0	0	0	112.7	R210 V211 K212 Q261 K449	R210-Y214 WeakPolarHBondContact O-CD2 3.41Å; V211-Y214 PolarHBondContact O-N 3.5Å; K212-Y214 VanDerWaalsContact C-N 3.3Å; Y214-Q261 VanDerWaalsContact CD2-OE1 3.28Å; Y214-K449 PolarHBondContact O-NZ 3.37Å
215	L	92.5	Very high	90.4	Very high	11 Å²	11	46.2 Å²	46.2	6%	0.058	23%	0.229	C	C	.	.	S	Bend	trans	-108.7	130.9	179.8	-169.2	66.2	0	0	0	110.3	V211 K212 Q218 I222 E257 L258	V211-L215 HydrophobicContact CG1-CB 3.86Å; V211-L215 HydrophobicContact CG1-CD2 4.03Å; V211-L215 PolarHBondContact O-N 3.44Å; K212-L215 CarbonylContact C-O 3.57Å; K212-L215 WeakPolarHBondContact CA-O 3.34Å; L215-Q218 HydrophobicContact CD2-CB 4.29Å; L215-I222 HydrophobicContact CD2-CD1 4.02Å; L215-I222 HydrophobicContact CD2-CG1 3.98Å; L215-E257 HydrophobicContact CD1-CB 4.4Å; L215-E257 HydrophobicContact CD1-CG 4.48Å; L215-L258 HydrophobicContact CD2-CB 4.15Å; L215-L258 HydrophobicContact CD2-CD1 4.08Å
216	I	92.5	Very high	91.1	Very high	24 Å²	24	42.1 Å²	42.1	12%	0.123	21%	0.212	C	C	.	.			trans	-96.7	129.6	179.1	-64.7	166	0	0	0	108.6	E442 Q445 L446 K449	I216-E442 HydrophobicContact CG2-CB 4.02Å; I216-E442 HydrophobicContact CG2-CG 4.31Å; I216-Q445 HydrophobicContact CD1-CB 4.18Å; I216-Q445 HydrophobicContact CG2-CB 3.99Å; I216-L446 HydrophobicContact CD1-CB 4.02Å; I216-L446 HydrophobicContact CD1-CG 4.36Å; I216-K449 HydrophobicContact CD1-CB 4.27Å; I216-K449 HydrophobicContact CD1-CD 3.91Å
217	G	91	Very high	91.5	Very high	11 Å²	11	42.3 Å²	42.3	11%	0.113	22%	0.216	C	C	.	.	S	Bend	trans	67.6	-145.8	-179.6	0	0	0	0	0	112.9	E219 I222 E442	G217-E219 VanDerWaalsContact C-N 3.26Å; G217-E219 PolarHBondContact O-N 2.93Å; G217-I222 WeakPolarHBondContact O-CD1 3.37Å; G217-E442 WeakPolarHBondContact CA-OE1 3.49Å
218	Q	93.2	Very high	91.7	Very high	11 Å²	11	42 Å²	42	5%	0.051	22%	0.215	C	C	.	.			trans	57.9	34.2	179.1	-51.5	-57.1	-34.9	0	0	114.1	L215 G220 A221 I222 F435 L436	L215-Q218 HydrophobicContact CD2-CB 4.29Å; Q218-G220 VanDerWaalsContact C-N 3.3Å; Q218-G220 PolarHBondContact O-N 2.82Å; Q218-A221 HydrophobicContact CB-CB 4.2Å; Q218-A221 WeakPolarHBondContact O-CB 3.38Å; Q218-A221 PolarHBondContact O-N 3.16Å; Q218-I222 WeakPolarHBondContact O-CG1 3.43Å; Q218-I222 PolarHBondContact O-N 2.91Å; Q218-F435 HydrophobicContact CB-CD1 4.48Å; Q218-F435 HydrophobicContact CG-CD1 4.04Å; Q218-L436 PolarHBondContact NE2-O 2.8Å
219	E	91.3	Very high	91.7	Very high	71 Å²	71	40.2 Å²	40.2	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-51.1	-47.1	-176.8	-66.1	-65.5	170.7	0	0	112.8	K212 G217 A221 I222 S223 E400	K212-E219 VanDerWaalsContact CE-CD 3.46Å; K212-E219 WeakPolarHBondContact CE-OE1 3.26Å; K212-E219 WeakPolarHBondContact CE-OE2 3.47Å; K212-E219 IonicContact NZ-OE1 3.73Å; K212-E219 PolarHBondContact NZ-OE1 3.03Å; K212-E219 IonicContact NZ-OE2 2.63Å; K212-E219 PolarHBondContact NZ-OE2 3.5Å; G217-E219 VanDerWaalsContact C-N 3.26Å; G217-E219 PolarHBondContact O-N 2.93Å; E219-A221 VanDerWaalsContact C-N 3.3Å; E219-A221 PolarHBondContact O-N 3.21Å; E219-I222 PolarHBondContact O-N 2.77Å; E219-S223 WeakPolarHBondContact O-CB 3.5Å; E219-S223 PolarHBondContact O-N 3.16Å; E219-E400 VanDerWaalsContact C-OE1 3.24Å; E219-E400 VanDerWaalsContact CB-OE1 3.24Å; E219-E400 WeakPolarHBondContact CB-OE1 3.42Å
220	G	91.3	Very high	91.8	Very high	36 Å²	36	40.3 Å²	40.3	37%	0.371	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-36.1	179.6	0	0	0	0	0	113.1	Q218 S224 E400	Q218-G220 VanDerWaalsContact C-N 3.3Å; Q218-G220 PolarHBondContact O-N 2.82Å; G220-S224 VanDerWaalsContact O-CB 3.23Å; G220-S224 WeakPolarHBondContact O-CB 3.38Å; G220-S224 PolarHBondContact O-N 3.31Å; G220-E400 WeakPolarHBondContact CA-OE1 3.45Å; G220-E400 PolarHBondContact N-OE1 3.07Å
221	A	94.4	Very high	92	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-70.6	-45	177	0	0	0	0	0	111.6	Q218 E219 S224 V225 L258 V433 F435	Q218-A221 HydrophobicContact CB-CB 4.2Å; Q218-A221 WeakPolarHBondContact O-CB 3.38Å; Q218-A221 PolarHBondContact O-N 3.16Å; E219-A221 VanDerWaalsContact C-N 3.3Å; E219-A221 PolarHBondContact O-N 3.21Å; A221-S224 PolarHBondContact O-N 3.45Å; A221-V225 WeakPolarHBondContact O-CG2 3.29Å; A221-V225 PolarHBondContact O-N 3.09Å; A221-V225 VanDerWaalsContact O-N 3.12Å; A221-L258 HydrophobicContact CB-CD2 4.46Å; A221-V433 VanDerWaalsContact CA-CG1 3.49Å; A221-V433 HydrophobicContact CB-CG1 3.47Å; A221-V433 VanDerWaalsContact CB-CG1 3.47Å; A221-F435 HydrophobicContact CB-CD1 4.39Å; A221-F435 HydrophobicContact CB-CD2 4.45Å; A221-F435 HydrophobicContact CB-CE1 4.2Å; A221-F435 HydrophobicContact CB-CE2 4.23Å; A221-F435 HydrophobicContact CB-CZ 4.13Å
222	I	94.8	Very high	91.9	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-48.3	177	-62.8	170.3	0	0	0	109.8	F207 E208 V211 K212 L215 G217 Q218 E219 S224 V225 A226 L258	F207-I222 HydrophobicContact CD1-CG2 4.48Å; F207-I222 HydrophobicContact CE1-CG2 4.17Å; E208-I222 HydrophobicContact CB-CG2 4.05Å; E208-I222 HydrophobicContact CG-CG2 3.91Å; V211-I222 HydrophobicContact CB-CG2 4.36Å; V211-I222 HydrophobicContact CG1-CD1 3.88Å; V211-I222 HydrophobicContact CG1-CG1 3.94Å; V211-I222 HydrophobicContact CG1-CG2 4.36Å; K212-I222 HydrophobicContact CG-CD1 4.29Å; L215-I222 HydrophobicContact CD2-CD1 4.02Å; L215-I222 HydrophobicContact CD2-CG1 3.98Å; G217-I222 WeakPolarHBondContact O-CD1 3.37Å; Q218-I222 WeakPolarHBondContact O-CG1 3.43Å; Q218-I222 PolarHBondContact O-N 2.91Å; E219-I222 PolarHBondContact O-N 2.77Å; I222-S224 PolarHBondContact O-N 3.36Å; I222-V225 PolarHBondContact O-N 2.83Å; I222-A226 WeakPolarHBondContact O-CB 3.43Å; I222-A226 PolarHBondContact O-N 3.29Å; I222-L258 HydrophobicContact CG1-CD1 4.28Å
223	S	93.1	Very high	91.6	Very high	57 Å²	57	40.8 Å²	40.8	40%	0.399	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-43.2	-179.3	-176.7	0	0	0	0	112.1	E219 A226 A227	E219-S223 WeakPolarHBondContact O-CB 3.5Å; E219-S223 PolarHBondContact O-N 3.16Å; S223-A226 PolarHBondContact O-N 3.03Å; S223-A227 WeakPolarHBondContact O-CB 3.44Å; S223-A227 PolarHBondContact O-N 3.19Å
224	S	92.9	Very high	91.4	Very high	27 Å²	27	37.7 Å²	37.7	19%	0.189	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-49.5	176.8	176.3	0	0	0	0	112.3	G220 A221 I222 A227 A228 E431	G220-S224 VanDerWaalsContact O-CB 3.23Å; G220-S224 WeakPolarHBondContact O-CB 3.38Å; G220-S224 PolarHBondContact O-N 3.31Å; A221-S224 PolarHBondContact O-N 3.45Å; I222-S224 PolarHBondContact O-N 3.36Å; S224-A227 PolarHBondContact O-N 3.15Å; S224-A228 PolarHBondContact O-N 3.31Å; S224-E431 WeakPolarHBondContact OG-CG 3.46Å
225	V	95.3	Very high	91.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65	-43.5	176.8	173.8	0	0	0	0	111	F207 A221 I222 A227 A228 I229 F245 F247 L258 V262 V433	F207-V225 HydrophobicContact CE1-CG1 4.2Å; F207-V225 HydrophobicContact CZ-CG1 4.03Å; A221-V225 WeakPolarHBondContact O-CG2 3.29Å; A221-V225 PolarHBondContact O-N 3.09Å; A221-V225 VanDerWaalsContact O-N 3.12Å; I222-V225 PolarHBondContact O-N 2.83Å; V225-A227 VanDerWaalsContact C-N 3.32Å; V225-A227 PolarHBondContact O-N 3.25Å; V225-A228 PolarHBondContact O-N 3.45Å; V225-I229 HydrophobicContact CG1-CD1 3.64Å; V225-I229 HydrophobicContact CG1-CG1 4.28Å; V225-I229 WeakPolarHBondContact O-CG1 3.46Å; V225-I229 PolarHBondContact O-N 3.42Å; V225-F245 HydrophobicContact CG2-CD1 4.41Å; V225-F245 HydrophobicContact CG2-CE1 4.38Å; V225-F247 HydrophobicContact CG2-CE1 3.78Å; V225-F247 HydrophobicContact CG2-CZ 3.79Å; V225-L258 HydrophobicContact CG2-CD2 3.9Å; V225-V262 HydrophobicContact CG1-CG2 3.71Å; V225-V433 HydrophobicContact CG2-CG1 4.35Å; V225-V433 HydrophobicContact CG2-CG2 3.98Å
226	A	93.1	Very high	91	Very high	1 Å²	1	44 Å²	44	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-41.5	178.6	0	0	0	0	0	112.2	F207 E208 I222 S223 R230	F207-A226 HydrophobicContact CD1-CB 3.45Å; F207-A226 VanDerWaalsContact CD1-CB 3.45Å; F207-A226 HydrophobicContact CE1-CB 3.92Å; F207-A226 HydrophobicContact CG-CB 4.48Å; E208-A226 VanDerWaalsContact CD-CB 3.43Å; E208-A226 HydrophobicContact CG-CB 3.78Å; E208-A226 WeakPolarHBondContact OE1-CB 3.34Å; I222-A226 WeakPolarHBondContact O-CB 3.43Å; I222-A226 PolarHBondContact O-N 3.29Å; S223-A226 PolarHBondContact O-N 3.03Å; A226-R230 VanDerWaalsContact O-CB 3.22Å; A226-R230 WeakPolarHBondContact O-CB 3.44Å; A226-R230 VanDerWaalsContact O-CG 3.23Å; A226-R230 WeakPolarHBondContact O-CG 3.24Å; A226-R230 PolarHBondContact O-N 3.15Å; A226-R230 PolarHBondContact O-NE 3.44Å
227	A	92.3	Very high	90.7	Very high	38 Å²	38	44.6 Å²	44.6	31%	0.314	24%	0.238	S	C	.	.	H	α-helix	trans	-64.9	-40.1	178.1	0	0	0	0	0	111.6	S223 S224 V225 R231	S223-A227 WeakPolarHBondContact O-CB 3.44Å; S223-A227 PolarHBondContact O-N 3.19Å; S224-A227 PolarHBondContact O-N 3.15Å; V225-A227 VanDerWaalsContact C-N 3.32Å; V225-A227 PolarHBondContact O-N 3.25Å; A227-R231 WeakPolarHBondContact O-CG 3.23Å; A227-R231 PolarHBondContact O-N 3.26Å
228	A	92.5	Very high	90.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-69.1	-45.4	177.2	0	0	0	0	0	112.8	S224 V225 R230 R231 Q232 F245	S224-A228 PolarHBondContact O-N 3.31Å; V225-A228 PolarHBondContact O-N 3.45Å; A228-R230 VanDerWaalsContact C-N 3.33Å; A228-R230 PolarHBondContact O-N 2.93Å; A228-R231 WeakPolarHBondContact O-CB 3.49Å; A228-R231 PolarHBondContact O-N 3.48Å; A228-R231 VanDerWaalsContact O-N 3.14Å; A228-Q232 PolarHBondContact O-N 3.32Å; A228-Q232 VanDerWaalsContact O-N 3.08Å; A228-F245 HydrophobicContact CB-CE1 3.49Å; A228-F245 VanDerWaalsContact CB-CE1 3.49Å; A228-F245 HydrophobicContact CB-CZ 3.4Å; A228-F245 VanDerWaalsContact CB-CZ 3.4Å
229	I	91.3	Very high	90.1	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-44.5	174.1	-67.3	171.6	0	0	0	110.3	F207 V225 R231 Q232 E233 V262 L266 I358	F207-I229 HydrophobicContact CE2-CD1 4.2Å; F207-I229 HydrophobicContact CZ-CD1 4.18Å; V225-I229 HydrophobicContact CG1-CD1 3.64Å; V225-I229 HydrophobicContact CG1-CG1 4.28Å; V225-I229 WeakPolarHBondContact O-CG1 3.46Å; V225-I229 PolarHBondContact O-N 3.42Å; I229-R231 PolarHBondContact O-N 3.48Å; I229-Q232 PolarHBondContact O-N 3Å; I229-Q232 VanDerWaalsContact O-N 3.15Å; I229-E233 HydrophobicContact CG2-CG 4.02Å; I229-E233 WeakPolarHBondContact O-CB 3.17Å; I229-E233 WeakPolarHBondContact O-CG 3.38Å; I229-E233 PolarHBondContact O-N 3.11Å; I229-V262 HydrophobicContact CD1-CG1 3.72Å; I229-V262 HydrophobicContact CD1-CG2 4.09Å; I229-L266 HydrophobicContact CG2-CD2 3.96Å; I229-I358 HydrophobicContact CG1-CD1 4.28Å
230	R	89.4	Confident	89.8	Confident	118 Å²	118	55.9 Å²	55.9	45%	0.445	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-33.5	176.2	-81.1	-175.2	-79.7	156.3	-14	112.7	E208 A226 A228 N234	E208-R230 IonicContact OE1-CZ 3.42Å; E208-R230 IonicContact OE1-NE 3.46Å; E208-R230 IonicContact OE1-NH2 2.71Å; E208-R230 PolarHBondContact OE1-NH2 2.96Å; A226-R230 VanDerWaalsContact O-CB 3.22Å; A226-R230 WeakPolarHBondContact O-CB 3.44Å; A226-R230 VanDerWaalsContact O-CG 3.23Å; A226-R230 WeakPolarHBondContact O-CG 3.24Å; A226-R230 PolarHBondContact O-N 3.15Å; A226-R230 PolarHBondContact O-NE 3.44Å; A228-R230 VanDerWaalsContact C-N 3.33Å; A228-R230 PolarHBondContact O-N 2.93Å; R230-N234 WeakPolarHBondContact O-CB 3.44Å; R230-N234 PolarHBondContact O-N 3.06Å; R230-N234 PolarHBondContact O-ND2 2.81Å
231	R	91.1	Very high	89.8	Confident	91 Å²	91	57.2 Å²	57.2	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-49.9	173.6	-77	-178.9	-73.4	123.3	-11.2	110.5	A227 A228 I229 N234 G235 W236 T237	A227-R231 WeakPolarHBondContact O-CG 3.23Å; A227-R231 PolarHBondContact O-N 3.26Å; A228-R231 WeakPolarHBondContact O-CB 3.49Å; A228-R231 PolarHBondContact O-N 3.48Å; A228-R231 VanDerWaalsContact O-N 3.14Å; I229-R231 PolarHBondContact O-N 3.48Å; R231-N234 PolarHBondContact O-N 3.45Å; R231-G235 PolarHBondContact O-N 2.95Å; R231-G235 VanDerWaalsContact O-N 3.16Å; R231-W236 HydrophobicContact CB-CB 4.18Å; R231-W236 HydrophobicContact CG-CB 4.28Å; R231-W236 PolarHBondContact O-N 2.9Å; R231-T237 HydrophobicContact CB-CG2 3.89Å
232	Q	87.9	Confident	89.8	Confident	45 Å²	45	57.3 Å²	57.3	21%	0.21	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-49.9	179.7	-172.1	-175	25.7	0	0	112.1	A228 I229 N234 G235 T237 L243	A228-Q232 PolarHBondContact O-N 3.32Å; A228-Q232 VanDerWaalsContact O-N 3.08Å; I229-Q232 PolarHBondContact O-N 3Å; I229-Q232 VanDerWaalsContact O-N 3.15Å; Q232-N234 PolarHBondContact O-N 3.45Å; Q232-N234 VanDerWaalsContact O-N 3.09Å; Q232-G235 PolarHBondContact O-N 3.23Å; Q232-T237 WeakPolarHBondContact CA-OG1 3.48Å; Q232-T237 HydrophobicContact CB-CG2 3.99Å; Q232-L243 HydrophobicContact CB-CD1 3.87Å; Q232-L243 HydrophobicContact CB-CG 4.33Å; Q232-L243 HydrophobicContact CG-CD1 4.32Å; Q232-L243 HydrophobicContact CG-CG 4.45Å
233	E	84.8	Confident	89.7	Confident	46 Å²	46	57.6 Å²	57.6	22%	0.215	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-21.2	-179.6	-80.4	-170.2	153	0	0	114.4	R202 I229	R202-E233 WeakPolarHBondContact CD-OE2 3.42Å; R202-E233 VanDerWaalsContact CZ-CD 3.44Å; R202-E233 IonicContact CZ-OE1 3.21Å; R202-E233 IonicContact CZ-OE2 3.27Å; R202-E233 IonicContact NE-OE1 2.69Å; R202-E233 PolarHBondContact NE-OE1 3.09Å; R202-E233 IonicContact NE-OE2 3.82Å; R202-E233 PolarHBondContact NE-OE2 3.13Å; R202-E233 IonicContact NH1-OE2 3.96Å; R202-E233 IonicContact NH2-OE1 3.8Å; I229-E233 HydrophobicContact CG2-CG 4.02Å; I229-E233 WeakPolarHBondContact O-CB 3.17Å; I229-E233 WeakPolarHBondContact O-CG 3.38Å; I229-E233 PolarHBondContact O-N 3.11Å
234	N	85.2	Confident	89.8	Confident	85 Å²	85	54.9 Å²	54.9	46%	0.455	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	8.5	178.5	-69.2	-61.9	0	0	0	112.8	R230 R231 Q232 W236	R230-N234 WeakPolarHBondContact O-CB 3.44Å; R230-N234 PolarHBondContact O-N 3.06Å; R230-N234 PolarHBondContact O-ND2 2.81Å; R231-N234 PolarHBondContact O-N 3.45Å; Q232-N234 PolarHBondContact O-N 3.45Å; Q232-N234 VanDerWaalsContact O-N 3.09Å; N234-W236 PolarHBondContact O-N 2.84Å
235	G	85.1	Confident	90	Very high	50 Å²	50	53.6 Å²	53.6	52%	0.515	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	25.3	178.4	0	0	0	0	0	115.1	R231 Q232 T237	R231-G235 PolarHBondContact O-N 2.95Å; R231-G235 VanDerWaalsContact O-N 3.16Å; Q232-G235 PolarHBondContact O-N 3.23Å; G235-T237 VanDerWaalsContact C-N 3.32Å
236	W	89.5	Confident	90.1	Very high	210 Å²	210	53.6 Å²	53.6	80%	0.795	27%	0.265	S	S	*	.			trans	-98	37.5	174.2	-61.7	96.2	0	0	0	111.9	R231 N234	R231-W236 HydrophobicContact CB-CB 4.18Å; R231-W236 HydrophobicContact CG-CB 4.28Å; R231-W236 PolarHBondContact O-N 2.9Å; N234-W236 PolarHBondContact O-N 2.84Å
237	T	86	Confident	90.3	Very high	36 Å²	36	53.6 Å²	53.6	22%	0.221	27%	0.265	C	S	.	.	S	Bend	trans	-129.2	167.2	179.4	45.4	0	0	0	0	110.5	R231 Q232 G235 L243	R231-T237 HydrophobicContact CB-CG2 3.89Å; Q232-T237 WeakPolarHBondContact CA-OG1 3.48Å; Q232-T237 HydrophobicContact CB-CG2 3.99Å; G235-T237 VanDerWaalsContact C-N 3.32Å; T237-L243 HydrophobicContact CG2-CD2 4.25Å
238	N	85.4	Confident	90.5	Very high	83 Å²	83	51.8 Å²	51.8	44%	0.444	25%	0.25	S	C	.	.			trans	-81.7	113.4	167.3	-175.8	-0.3	0	0	0	108.4	E240 H241	N238-E240 PolarHBondContact O-N 3.4Å; N238-E240 WeakPolarHBondContact OD1-CB 3.22Å; N238-E240 PolarHBondContact OD1-N 2.79Å; N238-E240 VanDerWaalsContact OD1-N 3.08Å; N238-H241 PolarHBondContact ND2-CD2 2.82Å; N238-H241 PolarHBondContact ND2-NE2 2.94Å; N238-H241 PolarHBondContact O-N 3.18Å
239	D	84.7	Confident	90.6	Very high	118 Å²	118	51.8 Å²	51.8	63%	0.631	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.3	-177.5	-58.9	-24	0	0	0	113
240	E	86.6	Confident	90.7	Very high	128 Å²	128	52 Å²	52	60%	0.598	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-19	174.4	-62.2	-175.2	161.5	0	0	113.3	N238	N238-E240 PolarHBondContact O-N 3.4Å; N238-E240 WeakPolarHBondContact OD1-CB 3.22Å; N238-E240 PolarHBondContact OD1-N 2.79Å; N238-E240 VanDerWaalsContact OD1-N 3.08Å
241	H	90.3	Very high	90.9	Very high	64 Å²	64	47.5 Å²	47.5	30%	0.296	24%	0.238	S	C	.	.	S	Bend	trans	-130.7	140.1	-173.6	-52.3	-54.8	0	0	0	112.5	N238 D340	N238-H241 PolarHBondContact ND2-CD2 2.82Å; N238-H241 PolarHBondContact ND2-NE2 2.94Å; N238-H241 PolarHBondContact O-N 3.18Å; H241-D340 PolarHBondContact CE1-O 3.42Å; H241-D340 IonicContact CE1-OD1 3.42Å; H241-D340 PolarHBondContact ND1-O 3.46Å
242	P	93.7	Very high	90.9	Very high	4 Å²	4	44 Å²	44	3%	0.026	23%	0.231	C	C	.	.			trans	-72.1	160.5	176.5	31.9	-36.1	0	0	0	112.3	V244 K355 A357 F359	P242-V244 HydrophobicContact CG-CG2 4.49Å; P242-V244 PolarHBondContact O-N 3.2Å; P242-K355 WeakPolarHBondContact CA-O 3.5Å; P242-A357 WeakPolarHBondContact CB-O 3.46Å; P242-F359 HydrophobicContact CB-CD2 3.66Å; P242-F359 HydrophobicContact CB-CE2 3.52Å; P242-F359 HydrophobicContact CG-CD2 3.74Å; P242-F359 HydrophobicContact CG-CE2 3.57Å
243	L	94.4	Very high	91.2	Very high	7 Å²	7	42 Å²	42	4%	0.037	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	127.1	171.4	-71.8	-172.3	0	0	0	110.2	Q232 T237 F245 I358 F359 T430	Q232-L243 HydrophobicContact CB-CD1 3.87Å; Q232-L243 HydrophobicContact CB-CG 4.33Å; Q232-L243 HydrophobicContact CG-CD1 4.32Å; Q232-L243 HydrophobicContact CG-CG 4.45Å; T237-L243 HydrophobicContact CG2-CD2 4.25Å; L243-F245 HydrophobicContact CB-CE2 3.98Å; L243-F245 HydrophobicContact CB-CZ 4.48Å; L243-F245 HydrophobicContact CD1-CE2 4.13Å; L243-F245 HydrophobicContact CD1-CZ 4.1Å; L243-I358 HydrophobicContact CB-CG1 4.3Å; L243-I358 HydrophobicContact CB-CG2 4.33Å; L243-I358 HydrophobicContact CD1-CD1 4.3Å; L243-I358 HydrophobicContact CD1-CG1 4.43Å; L243-F359 PolarHBondContact O-N 2.92Å; L243-T430 HydrophobicContact CD2-CG2 4.01Å
244	V	95.4	Very high	91.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	117.4	-179.9	-176.2	0	0	0	0	110	P242 F339 F359 M361 I429 T430 E431	P242-V244 HydrophobicContact CG-CG2 4.49Å; P242-V244 PolarHBondContact O-N 3.2Å; V244-F339 HydrophobicContact CG1-CD1 4.47Å; V244-F339 HydrophobicContact CG1-CD2 3.96Å; V244-F339 HydrophobicContact CG1-CE1 4.33Å; V244-F339 HydrophobicContact CG1-CE2 3.77Å; V244-F339 HydrophobicContact CG1-CG 4.3Å; V244-F339 HydrophobicContact CG1-CZ 3.96Å; V244-F339 HydrophobicContact CG2-CB 4.01Å; V244-F339 HydrophobicContact CG2-CD1 3.56Å; V244-F339 HydrophobicContact CG2-CD2 4.14Å; V244-F339 HydrophobicContact CG2-CE1 4.02Å; V244-F339 HydrophobicContact CG2-CG 3.64Å; V244-F339 HydrophobicContact CG2-CZ 4.45Å; V244-F359 CarbonylContact C-O 3.56Å; V244-F359 WeakPolarHBondContact CA-O 3.46Å; V244-F359 HydrophobicContact CG2-CB 4.32Å; V244-F359 HydrophobicContact CG2-CD2 4.45Å; V244-M361 HydrophobicContact CG1-CE 3.55Å; V244-I429 HydrophobicContact CG1-CG1 4.36Å; V244-T430 PolarHBondContact N-OG1 3.26Å; V244-T430 WeakPolarHBondContact O-CA 3.31Å; V244-T430 VanDerWaalsContact O-CB 3.26Å; V244-T430 WeakPolarHBondContact O-CB 3.32Å; V244-T430 PolarHBondContact O-N 2.71Å; V244-T430 PolarHBondContact O-OG1 3.28Å; V244-E431 PolarHBondContact O-N 3.29Å
245	F	97.1	Very high	92.2	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.3	177	-60.7	-81.4	0	0	0	111.4	V225 A228 L243 F247 I358 F359 I360 M361 E431 V433	V225-F245 HydrophobicContact CG2-CD1 4.41Å; V225-F245 HydrophobicContact CG2-CE1 4.38Å; A228-F245 HydrophobicContact CB-CE1 3.49Å; A228-F245 VanDerWaalsContact CB-CE1 3.49Å; A228-F245 HydrophobicContact CB-CZ 3.4Å; A228-F245 VanDerWaalsContact CB-CZ 3.4Å; L243-F245 HydrophobicContact CB-CE2 3.98Å; L243-F245 HydrophobicContact CB-CZ 4.48Å; L243-F245 HydrophobicContact CD1-CE2 4.13Å; L243-F245 HydrophobicContact CD1-CZ 4.1Å; F245-F247 HydrophobicContact CB-CD1 3.99Å; F245-F247 HydrophobicContact CB-CE1 3.6Å; F245-F247 HydrophobicContact CB-CZ 4.5Å; F245-F247 HydrophobicContact CD1-CE1 4.48Å; F245-F247 HydrophobicContact CG-CE1 4.13Å; F245-I358 HydrophobicContact CD2-CG2 3.8Å; F245-I358 HydrophobicContact CE2-CG2 3.63Å; F245-F359 PolarHBondContact N-O 3.04Å; F245-I360 HydrophobicContact CB-CG1 4.36Å; F245-I360 HydrophobicContact CD2-CG1 4.09Å; F245-M361 PolarHBondContact O-N 3.42Å; F245-E431 WeakPolarHBondContact CA-O 3.27Å; F245-E431 HydrophobicContact CD1-CB 4.06Å; F245-E431 HydrophobicContact CE1-CB 4.22Å; F245-V433 HydrophobicContact CD1-CG2 3.99Å
246	L	96.5	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.9	166.6	178	63.4	0	0	0	110.2	M248 I324 M361 L416 I429 E431 I432 V433	L246-M248 HydrophobicContact CD1-SD 4.28Å; L246-M248 HydrophobicContact CD2-CG 4.29Å; L246-M248 HydrophobicContact CD2-SD 3.9Å; L246-M248 HydrophobicContact CG-CG 4.06Å; L246-M248 HydrophobicContact CG-SD 3.91Å; L246-I324 HydrophobicContact CD1-CG2 4.2Å; L246-M361 HydrophobicContact CB-CE 4.4Å; L246-M361 HydrophobicContact CD1-CB 3.77Å; L246-L416 HydrophobicContact CD2-CD1 3.9Å; L246-L416 HydrophobicContact CD2-CD2 4.02Å; L246-I429 HydrophobicContact CB-CD1 4Å; L246-I429 HydrophobicContact CB-CG2 3.95Å; L246-I429 HydrophobicContact CD2-CD1 3.85Å; L246-E431 PolarHBondContact N-O 3.42Å; L246-E431 VanDerWaalsContact N-O 3.1Å; L246-I432 HydrophobicContact CB-CG1 4.37Å; L246-I432 HydrophobicContact CD2-CG1 4.46Å; L246-I432 HydrophobicContact CD2-CG2 4.49Å; L246-I432 CarbonylContact O-C 2.98Å; L246-I432 WeakPolarHBondContact O-CA 3.4Å; L246-V433 PolarHBondContact O-N 2.75Å
247	F	97.8	Very high	92.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	112.2	179.9	-70.2	4.7	0	0	0	110.3	V225 F245 K255 L258 A259 I360 M361 T362 S363 V433 F435	V225-F247 HydrophobicContact CG2-CE1 3.78Å; V225-F247 HydrophobicContact CG2-CZ 3.79Å; F245-F247 HydrophobicContact CB-CD1 3.99Å; F245-F247 HydrophobicContact CB-CE1 3.6Å; F245-F247 HydrophobicContact CB-CZ 4.5Å; F245-F247 HydrophobicContact CD1-CE1 4.48Å; F245-F247 HydrophobicContact CG-CE1 4.13Å; F247-K255 HydrophobicContact CB-CB 4.18Å; F247-K255 HydrophobicContact CB-CD 4.18Å; F247-K255 HydrophobicContact CB-CG 4.1Å; F247-K255 HydrophobicContact CD2-CB 4.19Å; F247-K255 WeakPolarHBondContact CD2-O 3.45Å; F247-L258 HydrophobicContact CE2-CB 4.05Å; F247-L258 HydrophobicContact CE2-CD2 3.92Å; F247-L258 HydrophobicContact CE2-CG 4.07Å; F247-L258 HydrophobicContact CZ-CD2 3.83Å; F247-L258 HydrophobicContact CZ-CG 4.2Å; F247-A259 HydrophobicContact CE2-CB 4.46Å; F247-I360 HydrophobicContact CD1-CG2 4.05Å; F247-I360 HydrophobicContact CD2-CG2 3.5Å; F247-I360 HydrophobicContact CE1-CG2 3.98Å; F247-I360 HydrophobicContact CE2-CD1 4.27Å; F247-I360 HydrophobicContact CE2-CG2 3.41Å; F247-I360 VanDerWaalsContact CE2-CG2 3.41Å; F247-I360 HydrophobicContact CG-CG2 3.84Å; F247-I360 HydrophobicContact CZ-CD1 4.06Å; F247-I360 HydrophobicContact CZ-CG1 4.35Å; F247-I360 HydrophobicContact CZ-CG2 3.66Å; F247-M361 WeakPolarHBondContact CB-O 3.09Å; F247-M361 PolarHBondContact N-O 2.93Å; F247-T362 WeakPolarHBondContact O-CA 3.46Å; F247-S363 PolarHBondContact O-N 2.93Å; F247-V433 WeakPolarHBondContact CA-O 3.33Å; F247-V433 HydrophobicContact CD1-CB 3.62Å; F247-V433 HydrophobicContact CD1-CG1 4.29Å; F247-V433 HydrophobicContact CD1-CG2 3.87Å; F247-V433 HydrophobicContact CE1-CB 3.88Å; F247-V433 HydrophobicContact CE1-CG1 4.31Å; F247-V433 HydrophobicContact CE1-CG2 3.71Å; F247-F435 HydrophobicContact CB-CD2 4.28Å; F247-F435 HydrophobicContact CB-CE2 3.65Å; F247-F435 HydrophobicContact CB-CZ 4.47Å; F247-F435 HydrophobicContact CD1-CE2 4.09Å; F247-F435 AromaticContact CD2-CE2 3.74Å; F247-F435 HydrophobicContact CD2-CE2 3.74Å; F247-F435 AromaticContact CD2-CZ 3.76Å; F247-F435 HydrophobicContact CD2-CZ 3.76Å; F247-F435 HydrophobicContact CE2-CE2 4.39Å; F247-F435 HydrophobicContact CE2-CZ 4.1Å; F247-F435 AromaticContact CG-CE2 3.56Å; F247-F435 HydrophobicContact CG-CE2 3.56Å; F247-F435 HydrophobicContact CG-CZ 4.08Å
248	M	95.7	Very high	93.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135	-175.9	-65.3	-66.4	-70	0	0	111	L246 L365 A366 I370 V412 L416 I432 V433 Y434 F435	L246-M248 HydrophobicContact CD1-SD 4.28Å; L246-M248 HydrophobicContact CD2-CG 4.29Å; L246-M248 HydrophobicContact CD2-SD 3.9Å; L246-M248 HydrophobicContact CG-CG 4.06Å; L246-M248 HydrophobicContact CG-SD 3.91Å; M248-L365 HydrophobicContact CE-CB 3.99Å; M248-L365 WeakPolarHBondContact CE-O 3.49Å; M248-A366 HydrophobicContact CE-CB 4.11Å; M248-I370 HydrophobicContact CB-CD1 3.86Å; M248-I370 HydrophobicContact CE-CD1 4.39Å; M248-V412 HydrophobicContact CE-CG1 4.1Å; M248-L416 HydrophobicContact CE-CD1 4.49Å; M248-L416 HydrophobicContact CE-CD2 3.72Å; M248-L416 HydrophobicContact CE-CG 4.26Å; M248-L416 HydrophobicContact SD-CD2 3.92Å; M248-I432 HydrophobicContact CG-CG2 3.65Å; M248-V433 PolarHBondContact N-O 3.24Å; M248-Y434 HydrophobicContact CB-CD1 4.03Å; M248-Y434 HydrophobicContact CB-CE1 4.33Å; M248-F435 PolarHBondContact O-N 2.77Å
249	G	94.5	Very high	93.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	155	-178.7	173.1	0	0	0	0	0	113.2	K255 S363 N364	G249-K255 PolarHBondContact O-NZ 3.38Å; G249-S363 PolarHBondContact N-O 3.32Å; G249-N364 PolarHBondContact O-OD1 3.14Å
250	S	94.4	Very high	94.4	Very high	8 Å²	8	21.5 Å²	21.5	6%	0.056	11%	0.114	C	C	.	.			trans	-57.5	161.6	178.2	-58.2	0	0	0	0	113.5	I253 K255 V482	S250-I253 WeakPolarHBondContact O-CG2 3.14Å; S250-K255 PolarHBondContact O-NZ 3.21Å; S250-V482 WeakPolarHBondContact CB-O 3.36Å; S250-V482 PolarHBondContact OG-O 2.83Å
251	S	92.9	Very high	94.8	Very high	22 Å²	22	16.4 Å²	16.4	15%	0.154	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	148.7	169.7	-169.7	0	0	0	0	110.5	I253 R483 Y484 G485 R487	S251-I253 PolarHBondContact O-N 3.42Å; S251-I253 VanDerWaalsContact O-N 3.13Å; S251-R483 PolarHBondContact N-O 3.18Å; S251-Y484 CarbonylContact O-C 3.55Å; S251-G485 WeakPolarHBondContact O-CA 3.42Å; S251-G485 PolarHBondContact O-N 2.86Å; S251-R487 PolarHBondContact OG-NH1 3.15Å; S251-R487 VanDerWaalsContact OG-NH1 3.14Å
252	G	91.7	Very high	95	Very high	19 Å²	19	13.4 Å²	13.4	20%	0.196	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	12.9	176	0	0	0	0	0	115.9	A486	G252-A486 WeakPolarHBondContact O-CB 3.26Å; G252-A486 PolarHBondContact O-N 3.17Å
253	I	93.7	Very high	95	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.01	8%	0.076	C	C	.	.	S	Bend	trans	-83.4	-9.8	-177.6	-159.1	60.1	0	0	0	114.2	S250 S251 K255 F435 L436 F438	S250-I253 WeakPolarHBondContact O-CG2 3.14Å; S251-I253 PolarHBondContact O-N 3.42Å; S251-I253 VanDerWaalsContact O-N 3.13Å; I253-K255 HydrophobicContact CG2-CD 4.34Å; I253-K255 HydrophobicContact CG2-CG 3.86Å; I253-F435 HydrophobicContact CB-CB 4.35Å; I253-F435 HydrophobicContact CG1-CB 4.04Å; I253-F435 HydrophobicContact CG2-CB 3.39Å; I253-F435 HydrophobicContact CG2-CD1 3.94Å; I253-F435 HydrophobicContact CG2-CG 3.87Å; I253-L436 VanDerWaalsContact CD1-O 3.27Å; I253-L436 WeakPolarHBondContact CD1-O 3.16Å; I253-L436 WeakPolarHBondContact CG1-O 3.41Å; I253-F438 HydrophobicContact CD1-CD1 4.34Å; I253-F438 HydrophobicContact CD1-CD2 3.69Å; I253-F438 HydrophobicContact CD1-CE1 4.15Å; I253-F438 HydrophobicContact CD1-CE2 3.48Å; I253-F438 VanDerWaalsContact CD1-CE2 3.48Å; I253-F438 HydrophobicContact CD1-CG 4.13Å; I253-F438 HydrophobicContact CD1-CZ 3.72Å; I253-F438 HydrophobicContact CG1-CZ 4.47Å; I253-F438 WeakPolarHBondContact O-CZ 3.39Å
254	G	94.5	Very high	94.9	Very high	15 Å²	15	18.8 Å²	18.8	16%	0.155	10%	0.097	C	C	.	.	S	Bend	trans	117.7	6.4	178	0	0	0	0	0	116.2	E257 L258	G254-E257 PolarHBondContact O-N 3.18Å; G254-L258 PolarHBondContact O-N 3.02Å
255	K	96.1	Very high	94.6	Very high	10 Å²	10	20.5 Å²	20.5	4%	0.043	10%	0.103	C	C	.	.	H	α-helix	trans	-53.2	-58	-180	-62.1	-178.9	-64.6	-162.3	0	113.1	F247 G249 S250 I253 E257 L258 A259 T362 S363 N364 F435	F247-K255 HydrophobicContact CB-CB 4.18Å; F247-K255 HydrophobicContact CB-CD 4.18Å; F247-K255 HydrophobicContact CB-CG 4.1Å; F247-K255 HydrophobicContact CD2-CB 4.19Å; F247-K255 WeakPolarHBondContact CD2-O 3.45Å; G249-K255 PolarHBondContact O-NZ 3.38Å; S250-K255 PolarHBondContact O-NZ 3.21Å; I253-K255 HydrophobicContact CG2-CD 4.34Å; I253-K255 HydrophobicContact CG2-CG 3.86Å; K255-E257 VanDerWaalsContact C-N 3.26Å; K255-E257 PolarHBondContact O-N 3.25Å; K255-L258 PolarHBondContact O-N 2.88Å; K255-A259 PolarHBondContact O-N 3.18Å; K255-T362 HydrophobicContact CB-CG2 4.05Å; K255-S363 PolarHBondContact NZ-O 2.88Å; K255-N364 PolarHBondContact NZ-OD1 2.97Å; K255-F435 HydrophobicContact CB-CE2 4.47Å; K255-F435 HydrophobicContact CB-CZ 4.38Å; K255-F435 HydrophobicContact CD-CD2 4.4Å; K255-F435 HydrophobicContact CG-CD1 4.13Å; K255-F435 HydrophobicContact CG-CD2 3.71Å; K255-F435 HydrophobicContact CG-CE1 4.25Å; K255-F435 HydrophobicContact CG-CE2 3.86Å; K255-F435 HydrophobicContact CG-CG 3.86Å; K255-F435 HydrophobicContact CG-CZ 4.1Å
256	T	94.8	Very high	94.3	Very high	26 Å²	26	22.6 Å²	22.6	16%	0.16	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-32	178.6	-42.4	0	0	0	0	111.9	A259 K260 L320	T256-A259 PolarHBondContact O-N 2.91Å; T256-K260 WeakPolarHBondContact O-CG 3.48Å; T256-K260 PolarHBondContact O-N 3.29Å; T256-K260 VanDerWaalsContact O-N 3.16Å; T256-L320 HydrophobicContact CG2-CD2 3.5Å; T256-L320 VanDerWaalsContact CG2-CD2 3.5Å
257	E	94.7	Very high	93.9	Very high	63 Å²	63	24.4 Å²	24.4	29%	0.294	12%	0.123	S	C	.	.	H	α-helix	trans	-70.9	-44	179.5	-168.7	56.1	-147.8	0	0	111	L215 G254 K255 A259 K260 Q261	L215-E257 HydrophobicContact CD1-CB 4.4Å; L215-E257 HydrophobicContact CD1-CG 4.48Å; G254-E257 PolarHBondContact O-N 3.18Å; K255-E257 VanDerWaalsContact C-N 3.26Å; K255-E257 PolarHBondContact O-N 3.25Å; E257-A259 VanDerWaalsContact C-N 3.28Å; E257-A259 PolarHBondContact O-N 2.98Å; E257-K260 WeakPolarHBondContact O-CB 3.4Å; E257-K260 PolarHBondContact O-N 3.4Å; E257-K260 VanDerWaalsContact O-N 3.15Å; E257-K260 IonicContact OE2-NZ 3.38Å; E257-Q261 WeakPolarHBondContact O-CG 3.3Å; E257-Q261 PolarHBondContact O-N 3.49Å; E257-Q261 PolarHBondContact OE1-NE2 3.49Å
258	L	96.6	Very high	93.3	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.9	-43.5	174.2	-176.4	59.3	0	0	0	111.2	F207 V211 L215 A221 I222 V225 F247 G254 K255 K260 Q261 V262 F435	F207-L258 HydrophobicContact CZ-CD1 4.35Å; V211-L258 HydrophobicContact CG1-CD1 3.67Å; V211-L258 HydrophobicContact CG2-CD1 4.46Å; L215-L258 HydrophobicContact CD2-CB 4.15Å; L215-L258 HydrophobicContact CD2-CD1 4.08Å; A221-L258 HydrophobicContact CB-CD2 4.46Å; I222-L258 HydrophobicContact CG1-CD1 4.28Å; V225-L258 HydrophobicContact CG2-CD2 3.9Å; F247-L258 HydrophobicContact CE2-CB 4.05Å; F247-L258 HydrophobicContact CE2-CD2 3.92Å; F247-L258 HydrophobicContact CE2-CG 4.07Å; F247-L258 HydrophobicContact CZ-CD2 3.83Å; F247-L258 HydrophobicContact CZ-CG 4.2Å; G254-L258 PolarHBondContact O-N 3.02Å; K255-L258 PolarHBondContact O-N 2.88Å; L258-K260 PolarHBondContact O-N 2.76Å; L258-Q261 PolarHBondContact O-N 3.39Å; L258-Q261 VanDerWaalsContact O-N 3.16Å; L258-V262 VanDerWaalsContact O-CG2 3.32Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 3.44Å; L258-F435 HydrophobicContact CB-CE1 4.34Å; L258-F435 HydrophobicContact CB-CZ 4.13Å; L258-F435 HydrophobicContact CD2-CE1 4.16Å; L258-F435 HydrophobicContact CD2-CZ 3.58Å; L258-F435 HydrophobicContact CG-CZ 4.49Å
259	A	96.4	Very high	92.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.6	-43.2	177	0	0	0	0	0	112.9	F247 K255 T256 E257 Q261 V262 A263 F274 L320 I360	F247-A259 HydrophobicContact CE2-CB 4.46Å; K255-A259 PolarHBondContact O-N 3.18Å; T256-A259 PolarHBondContact O-N 2.91Å; E257-A259 VanDerWaalsContact C-N 3.28Å; E257-A259 PolarHBondContact O-N 2.98Å; A259-Q261 VanDerWaalsContact C-N 3.34Å; A259-Q261 PolarHBondContact O-N 2.95Å; A259-V262 PolarHBondContact O-N 3.34Å; A259-A263 PolarHBondContact O-N 3.4Å; A259-A263 VanDerWaalsContact O-N 3.13Å; A259-F274 HydrophobicContact CB-CE2 4.12Å; A259-L320 HydrophobicContact CB-CD1 3.78Å; A259-L320 HydrophobicContact CB-CD2 4.13Å; A259-L320 HydrophobicContact CB-CG 4.39Å; A259-I360 HydrophobicContact CB-CD1 3.68Å; A259-I360 HydrophobicContact CB-CG2 4.21Å
260	K	95	Very high	92	Very high	84 Å²	84	35.6 Å²	35.6	37%	0.365	18%	0.183	S	C	.	.	H	α-helix	trans	-62.7	-41.2	174.5	-70	173.2	-173.4	172.9	0	111.9	T256 E257 L258 V262 A263 Y264 F274	T256-K260 WeakPolarHBondContact O-CG 3.48Å; T256-K260 PolarHBondContact O-N 3.29Å; T256-K260 VanDerWaalsContact O-N 3.16Å; E257-K260 WeakPolarHBondContact O-CB 3.4Å; E257-K260 PolarHBondContact O-N 3.4Å; E257-K260 VanDerWaalsContact O-N 3.15Å; E257-K260 IonicContact OE2-NZ 3.38Å; L258-K260 PolarHBondContact O-N 2.76Å; K260-V262 VanDerWaalsContact C-N 3.34Å; K260-A263 PolarHBondContact O-N 2.88Å; K260-Y264 WeakPolarHBondContact O-CB 3.11Å; K260-Y264 PolarHBondContact O-N 3.08Å; K260-F274 HydrophobicContact CG-CD1 4.33Å; K260-F274 HydrophobicContact CG-CE1 3.72Å; K260-F274 HydrophobicContact CG-CE2 4.17Å; K260-F274 HydrophobicContact CG-CZ 3.62Å
261	Q	94.4	Very high	91.6	Very high	21 Å²	21	44.3 Å²	44.3	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-68	-34.1	179.4	-62.2	-51.9	-42	0	0	112.1	V211 Y214 E257 L258 A259 Y264 Y265	V211-Q261 HydrophobicContact CG1-CB 4.44Å; V211-Q261 HydrophobicContact CG2-CB 4.03Å; Y214-Q261 VanDerWaalsContact CD2-OE1 3.28Å; E257-Q261 WeakPolarHBondContact O-CG 3.3Å; E257-Q261 PolarHBondContact O-N 3.49Å; E257-Q261 PolarHBondContact OE1-NE2 3.49Å; L258-Q261 PolarHBondContact O-N 3.39Å; L258-Q261 VanDerWaalsContact O-N 3.16Å; A259-Q261 VanDerWaalsContact C-N 3.34Å; A259-Q261 PolarHBondContact O-N 2.95Å; Q261-Y264 PolarHBondContact O-N 3.37Å; Q261-Y265 VanDerWaalsContact O-CB 3.29Å; Q261-Y265 WeakPolarHBondContact O-CB 3.46Å; Q261-Y265 PolarHBondContact O-N 3.48Å
262	V	94.8	Very high	91.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-50.6	170.7	173	0	0	0	0	110.8	F207 V225 I229 L258 A259 K260 Y264 Y265 L266 V318 I358	F207-V262 HydrophobicContact CE2-CB 4.5Å; F207-V262 HydrophobicContact CE2-CG2 3.88Å; F207-V262 HydrophobicContact CZ-CG2 3.64Å; V225-V262 HydrophobicContact CG1-CG2 3.71Å; I229-V262 HydrophobicContact CD1-CG1 3.72Å; I229-V262 HydrophobicContact CD1-CG2 4.09Å; L258-V262 VanDerWaalsContact O-CG2 3.32Å; L258-V262 WeakPolarHBondContact O-CG2 3.45Å; L258-V262 PolarHBondContact O-N 3.44Å; A259-V262 PolarHBondContact O-N 3.34Å; K260-V262 VanDerWaalsContact C-N 3.34Å; V262-Y264 PolarHBondContact O-N 2.9Å; V262-Y265 PolarHBondContact O-N 3.19Å; V262-L266 HydrophobicContact CG1-CD1 3.82Å; V262-L266 WeakPolarHBondContact O-CG 3.37Å; V262-L266 PolarHBondContact O-N 3.31Å; V262-V318 HydrophobicContact CG1-CG1 4.37Å; V262-V318 HydrophobicContact CG1-CG2 4.09Å; V262-I358 HydrophobicContact CG1-CD1 4.39Å
263	A	94	Very high	91.3	Very high	3 Å²	3	47.6 Å²	47.6	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-42.7	178.6	0	0	0	0	0	112.7	A259 K260 Y265 L266 H267 F274 V318	A259-A263 PolarHBondContact O-N 3.4Å; A259-A263 VanDerWaalsContact O-N 3.13Å; K260-A263 PolarHBondContact O-N 2.88Å; A263-Y265 VanDerWaalsContact C-N 3.31Å; A263-Y265 PolarHBondContact O-N 2.78Å; A263-L266 PolarHBondContact O-N 2.88Å; A263-H267 PolarHBondContact O-CD2 3.05Å; A263-H267 PolarHBondContact O-N 3.14Å; A263-F274 HydrophobicContact CB-CB 3.73Å; A263-F274 HydrophobicContact CB-CD2 3.7Å; A263-F274 HydrophobicContact CB-CG 4.09Å; A263-V318 HydrophobicContact CB-CB 3.77Å; A263-V318 HydrophobicContact CB-CG1 4.31Å; A263-V318 HydrophobicContact CB-CG2 3.83Å
264	Y	91.8	Very high	91.4	Very high	122 Å²	122	49.8 Å²	49.8	48%	0.478	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-40.3	177.4	-173.8	-91.4	0	0	0	111.9	K260 Q261 V262 K268 G269	K260-Y264 WeakPolarHBondContact O-CB 3.11Å; K260-Y264 PolarHBondContact O-N 3.08Å; Q261-Y264 PolarHBondContact O-N 3.37Å; V262-Y264 PolarHBondContact O-N 2.9Å; Y264-K268 WeakPolarHBondContact O-CA 3.49Å; Y264-K268 PolarHBondContact O-N 2.92Å; Y264-K268 VanDerWaalsContact O-N 3.08Å; Y264-G269 PolarHBondContact O-N 3.08Å
265	Y	89.9	Confident	91.5	Very high	35 Å²	35	49.6 Å²	49.6	14%	0.137	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-51.9	177.1	174.3	-101	0	0	0	112.2	F207 Q261 V262 A263	F207-Y265 HydrophobicContact CB-CD1 4.49Å; F207-Y265 HydrophobicContact CB-CD2 4.38Å; F207-Y265 HydrophobicContact CB-CE1 4.11Å; F207-Y265 HydrophobicContact CB-CE2 3.97Å; F207-Y265 AromaticContact CD2-CD1 3.61Å; F207-Y265 HydrophobicContact CD2-CD1 3.61Å; F207-Y265 HydrophobicContact CD2-CD2 4.01Å; F207-Y265 HydrophobicContact CD2-CE1 4.06Å; F207-Y265 HydrophobicContact CD2-CE2 4.4Å; F207-Y265 AromaticContact CD2-CG 3.59Å; F207-Y265 HydrophobicContact CD2-CG 3.59Å; F207-Y265 HydrophobicContact CE2-CD1 4.36Å; F207-Y265 HydrophobicContact CE2-CG 4.32Å; F207-Y265 HydrophobicContact CG-CD1 4.47Å; Q261-Y265 VanDerWaalsContact O-CB 3.29Å; Q261-Y265 WeakPolarHBondContact O-CB 3.46Å; Q261-Y265 PolarHBondContact O-N 3.48Å; V262-Y265 PolarHBondContact O-N 3.19Å; A263-Y265 VanDerWaalsContact C-N 3.31Å; A263-Y265 PolarHBondContact O-N 2.78Å
266	L	89.1	Confident	91.5	Very high	45 Å²	45	54.8 Å²	54.8	24%	0.236	25%	0.251	C	S	.	.	H	α-helix	trans	-70.6	-36.2	-174.2	-67.8	173.2	0	0	0	112.7	I229 V262 A263 V318 I358	I229-L266 HydrophobicContact CG2-CD2 3.96Å; V262-L266 HydrophobicContact CG1-CD1 3.82Å; V262-L266 WeakPolarHBondContact O-CG 3.37Å; V262-L266 PolarHBondContact O-N 3.31Å; A263-L266 PolarHBondContact O-N 2.88Å; L266-V318 HydrophobicContact CD1-CG2 4.15Å; L266-I358 HydrophobicContact CD1-CD1 3.32Å; L266-I358 HydrophobicContact CD1-CG1 4.46Å
267	H	89.2	Confident	91.6	Very high	38 Å²	38	53.7 Å²	53.7	18%	0.176	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	20.4	-172.4	-51.5	-74.6	0	0	0	113.7	A263 G269 N270 A273 N316	A263-H267 PolarHBondContact O-CD2 3.05Å; A263-H267 PolarHBondContact O-N 3.14Å; H267-G269 PolarHBondContact O-N 3.29Å; H267-N270 HydrophobicContact CB-CB 4.17Å; H267-N270 WeakPolarHBondContact O-CB 3.43Å; H267-N270 PolarHBondContact O-N 2.67Å; H267-A273 HydrophobicContact CB-CB 3.54Å; H267-A273 VanDerWaalsContact CD2-CB 3.43Å; H267-A273 WeakPolarHBondContact CD2-CB 3.43Å; H267-N316 PolarHBondContact CE1-O 3.46Å; H267-N316 PolarHBondContact NE2-O 3.38Å; H267-N316 VanDerWaalsContact NE2-O 3.13Å
268	K	84.1	Confident	91.6	Very high	143 Å²	143	52.9 Å²	52.9	62%	0.622	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	37.7	173.9	-59.2	-178.2	176.8	-176.3	0	113.7	E201 Y264	E201-K268 IonicContact OE2-NZ 3.14Å; E201-K268 PolarHBondContact OE2-NZ 2.99Å; Y264-K268 WeakPolarHBondContact O-CA 3.49Å; Y264-K268 PolarHBondContact O-N 2.92Å; Y264-K268 VanDerWaalsContact O-N 3.08Å
269	G	78.6	Confident	91.5	Very high	31 Å²	31	52.9 Å²	52.9	32%	0.32	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	13.5	178.3	0	0	0	0	0	116.5	Y264 H267 K271	Y264-G269 PolarHBondContact O-N 3.08Å; H267-G269 PolarHBondContact O-N 3.29Å; G269-K271 PolarHBondContact O-N 2.92Å; G269-K271 VanDerWaalsContact O-N 3.15Å
270	N	85.8	Confident	91.3	Very high	61 Å²	61	54.1 Å²	54.1	33%	0.326	25%	0.25	S	S	.	.			trans	-64.4	114.2	170.5	-170.9	-14.8	0	0	0	110.8	H267 K272 A273 Y314	H267-N270 HydrophobicContact CB-CB 4.17Å; H267-N270 WeakPolarHBondContact O-CB 3.43Å; H267-N270 PolarHBondContact O-N 2.67Å; N270-K272 VanDerWaalsContact C-N 3.26Å; N270-K272 PolarHBondContact O-N 3.29Å; N270-K272 PolarHBondContact OD1-N 3.46Å; N270-A273 HydrophobicContact CB-CB 4.25Å; N270-A273 PolarHBondContact O-N 2.99Å; N270-Y314 WeakPolarHBondContact ND2-CE1 3.18Å; N270-Y314 VanDerWaalsContact ND2-CZ 3.31Å; N270-Y314 PolarHBondContact ND2-OH 3.45Å
271	K	85	Confident	91.2	Very high	190 Å²	190	55.3 Å²	55.3	83%	0.826	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-64.3	-29.8	-178.3	-66.2	-176.7	-179.5	178.5	0	113.3	G269 A273 F274	G269-K271 PolarHBondContact O-N 2.92Å; G269-K271 VanDerWaalsContact O-N 3.15Å; K271-A273 VanDerWaalsContact C-N 3.26Å; K271-A273 PolarHBondContact O-N 2.96Å; K271-F274 PolarHBondContact O-N 3.06Å
272	K	87.7	Confident	91.1	Very high	111 Å²	111	54.4 Å²	54.4	48%	0.483	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-74.3	-20.2	-178.8	-60.9	-174.2	174.4	-171.9	0	112.7	N270 F274 E313 Y314	N270-K272 VanDerWaalsContact C-N 3.26Å; N270-K272 PolarHBondContact O-N 3.29Å; N270-K272 PolarHBondContact OD1-N 3.46Å; K272-F274 VanDerWaalsContact C-N 3.25Å; K272-F274 PolarHBondContact O-N 2.81Å; K272-E313 VanDerWaalsContact CD-OE1 3.26Å; K272-E313 WeakPolarHBondContact CD-OE1 3.16Å; K272-E313 WeakPolarHBondContact CE-OE1 3.36Å; K272-E313 IonicContact NZ-OE1 2.7Å; K272-E313 PolarHBondContact NZ-OE1 3.12Å; K272-Y314 HydrophobicContact CB-CD2 3.46Å; K272-Y314 VanDerWaalsContact CB-CD2 3.46Å; K272-Y314 HydrophobicContact CB-CE2 3.2Å; K272-Y314 HydrophobicContact CB-CG 4.27Å; K272-Y314 HydrophobicContact CD-CD2 4.3Å; K272-Y314 HydrophobicContact CD-CE2 3.43Å; K272-Y314 VanDerWaalsContact CD-CE2 3.43Å; K272-Y314 HydrophobicContact CG-CE2 3.97Å
273	A	91.3	Very high	91	Very high	0 Å²	0	59 Å²	59	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-80.7	-2.6	176.9	0	0	0	0	0	113.7	H267 N270 K271 Y314 A317 V318	H267-A273 HydrophobicContact CB-CB 3.54Å; H267-A273 VanDerWaalsContact CD2-CB 3.43Å; H267-A273 WeakPolarHBondContact CD2-CB 3.43Å; N270-A273 HydrophobicContact CB-CB 4.25Å; N270-A273 PolarHBondContact O-N 2.99Å; K271-A273 VanDerWaalsContact C-N 3.26Å; K271-A273 PolarHBondContact O-N 2.96Å; A273-Y314 HydrophobicContact CB-CD1 4.28Å; A273-A317 WeakPolarHBondContact O-CA 3.44Å; A273-A317 WeakPolarHBondContact O-CB 3.36Å; A273-V318 PolarHBondContact O-N 3.39Å
274	F	96.6	Very high	90.9	Very high	47 Å²	47	64.1 Å²	64.1	21%	0.206	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	107.7	171.6	-179.1	-110.2	0	0	0	109.9	A259 K260 A263 K271 K272 R276 V318 L320	A259-F274 HydrophobicContact CB-CE2 4.12Å; K260-F274 HydrophobicContact CG-CD1 4.33Å; K260-F274 HydrophobicContact CG-CE1 3.72Å; K260-F274 HydrophobicContact CG-CE2 4.17Å; K260-F274 HydrophobicContact CG-CZ 3.62Å; A263-F274 HydrophobicContact CB-CB 3.73Å; A263-F274 HydrophobicContact CB-CD2 3.7Å; A263-F274 HydrophobicContact CB-CG 4.09Å; K271-F274 PolarHBondContact O-N 3.06Å; K272-F274 VanDerWaalsContact C-N 3.25Å; K272-F274 PolarHBondContact O-N 2.81Å; F274-R276 HydrophobicContact CE1-CB 3.95Å; F274-R276 HydrophobicContact CZ-CB 4.24Å; F274-V318 WeakPolarHBondContact CA-O 3.47Å; F274-V318 HydrophobicContact CD2-CG1 4.45Å; F274-L320 HydrophobicContact CE2-CB 3.97Å; F274-L320 HydrophobicContact CE2-CD2 4.38Å; F274-L320 HydrophobicContact CZ-CB 4.03Å; F274-L320 HydrophobicContact CZ-CD2 3.83Å
275	I	96.1	Very high	90.7	Very high	12 Å²	12	65.3 Å²	65.3	6%	0.062	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.3	179	-58.9	164.7	0	0	0	107.3	L277 L311 A317 V318 V319 L320	I275-L277 HydrophobicContact CG2-CG 4.26Å; I275-L311 HydrophobicContact CD1-CD2 4.14Å; I275-L311 HydrophobicContact CD1-CG 4.38Å; I275-A317 HydrophobicContact CD1-CB 3.63Å; I275-A317 HydrophobicContact CG1-CB 4.18Å; I275-V318 PolarHBondContact N-O 3.32Å; I275-V319 HydrophobicContact CB-CG1 4.45Å; I275-V319 HydrophobicContact CB-CG2 4.23Å; I275-V319 HydrophobicContact CD1-CG2 4.04Å; I275-V319 HydrophobicContact CG2-CG1 4.38Å; I275-V319 CarbonylContact O-C 3.57Å; I275-V319 WeakPolarHBondContact O-CA 3.43Å; I275-L320 PolarHBondContact O-N 3.34Å
276	R	96.3	Very high	90.5	Very high	119 Å²	119	69.7 Å²	69.7	45%	0.449	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.4	175.6	-179.9	179.1	-179	-146	-2	109.8	F274 L320 D322	F274-R276 HydrophobicContact CE1-CB 3.95Å; F274-R276 HydrophobicContact CZ-CB 4.24Å; R276-L320 HydrophobicContact CG-CD2 4.14Å; R276-D322 IonicContact CZ-OD2 2.66Å; R276-D322 IonicContact NE-OD2 3.16Å; R276-D322 PolarHBondContact NE-OD2 3.17Å; R276-D322 IonicContact NH2-OD2 3.42Å; R276-D322 PolarHBondContact NH2-OD2 3.31Å
277	L	95.9	Very high	90.5	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.4	176.5	-60.2	176	0	0	0	108.2	I275 M279 Y282 F291 Q306 L307 L320 F321 D322	I275-L277 HydrophobicContact CG2-CG 4.26Å; L277-M279 HydrophobicContact CB-CE 3.5Å; L277-Y282 HydrophobicContact CB-CE2 4.28Å; L277-F291 HydrophobicContact CD1-CD2 4.23Å; L277-F291 HydrophobicContact CD1-CE2 3.69Å; L277-Q306 HydrophobicContact CD2-CG 3.76Å; L277-Q306 VanDerWaalsContact CD2-NE2 3.33Å; L277-L307 HydrophobicContact CD1-CB 4Å; L277-L307 HydrophobicContact CD1-CD1 3.92Å; L277-L307 HydrophobicContact CD1-CG 4.42Å; L277-L320 PolarHBondContact N-O 3.1Å; L277-F321 HydrophobicContact CB-CD1 4.22Å; L277-F321 HydrophobicContact CD1-CD1 4.14Å; L277-F321 HydrophobicContact CD1-CE1 3.78Å; L277-F321 WeakPolarHBondContact O-CA 3.49Å; L277-D322 PolarHBondContact O-N 3.45Å
278	D	95.3	Very high	90.5	Very high	46 Å²	46	68.3 Å²	68.3	25%	0.246	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.8	172.9	-169.3	-27.6	0	0	0	108.5	S280 E281 Y282	D278-S280 PolarHBondContact O-N 2.85Å; D278-S280 WeakPolarHBondContact OD1-CB 3.13Å; D278-S280 PolarHBondContact OD1-N 2.99Å; D278-S280 PolarHBondContact OD1-OG 3.19Å; D278-E281 HydrophobicContact CB-CG 4.35Å; D278-E281 WeakPolarHBondContact O-CB 3.3Å; D278-E281 PolarHBondContact O-N 2.75Å; D278-E281 VanDerWaalsContact O-N 3.08Å; D278-Y282 WeakPolarHBondContact O-CD2 3.47Å
279	M	94.5	Very high	90.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-71	-13.8	-178.5	-62.8	-62.8	95.7	0	0	112.8	L277 E281 Y282 F291 F321 D322 E323 I324 A327 V331	L277-M279 HydrophobicContact CB-CE 3.5Å; M279-E281 PolarHBondContact O-N 3.07Å; M279-Y282 HydrophobicContact CE-CD2 3.66Å; M279-Y282 HydrophobicContact CE-CE2 3.8Å; M279-Y282 PolarHBondContact O-N 2.84Å; M279-Y282 VanDerWaalsContact O-N 3.13Å; M279-Y282 HydrophobicContact SD-CD2 4.39Å; M279-F291 HydrophobicContact CE-CE2 4.36Å; M279-F321 HydrophobicContact CE-CB 4.23Å; M279-F321 HydrophobicContact CE-CD1 3.69Å; M279-F321 HydrophobicContact CE-CG 4.44Å; M279-F321 HydrophobicContact CG-CB 4.2Å; M279-F321 HydrophobicContact SD-CB 4.16Å; M279-F321 HydrophobicContact SD-CD1 4.12Å; M279-D322 VanDerWaalsContact CB-O 3.23Å; M279-D322 WeakPolarHBondContact CB-O 3.36Å; M279-D322 VanDerWaalsContact CG-O 3.24Å; M279-D322 WeakPolarHBondContact CG-O 3.36Å; M279-D322 PolarHBondContact N-O 2.89Å; M279-E323 WeakPolarHBondContact CB-O 3.37Å; M279-I324 HydrophobicContact CG-CD1 4Å; M279-I324 HydrophobicContact SD-CD1 4.18Å; M279-A327 HydrophobicContact CB-CB 3.98Å; M279-A327 HydrophobicContact CG-CB 4.22Å; M279-A327 HydrophobicContact SD-CB 4.16Å; M279-V331 HydrophobicContact SD-CG1 4.27Å
280	S	92.2	Very high	91	Very high	27 Å²	27	67.4 Å²	67.4	19%	0.189	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.5	168.3	-51.1	0	0	0	0	112.6	D278 Y282 Q283 E323 K326	D278-S280 PolarHBondContact O-N 2.85Å; D278-S280 WeakPolarHBondContact OD1-CB 3.13Å; D278-S280 PolarHBondContact OD1-N 2.99Å; D278-S280 PolarHBondContact OD1-OG 3.19Å; S280-Y282 VanDerWaalsContact C-N 3.28Å; S280-Q283 PolarHBondContact O-NE2 3.16Å; S280-E323 PolarHBondContact OG-OE2 3.35Å; S280-K326 WeakPolarHBondContact OG-CD 3.05Å; S280-K326 PolarHBondContact OG-NZ 3.14Å
281	E	92.1	Very high	91.2	Very high	108 Å²	108	64.5 Å²	64.5	51%	0.505	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-81.8	-3.6	176.8	-62.9	-177.3	-166.3	0	0	113.5	D278 M279 E287	D278-E281 HydrophobicContact CB-CG 4.35Å; D278-E281 WeakPolarHBondContact O-CB 3.3Å; D278-E281 PolarHBondContact O-N 2.75Å; D278-E281 VanDerWaalsContact O-N 3.08Å; M279-E281 PolarHBondContact O-N 3.07Å; E281-E287 WeakPolarHBondContact O-CB 3.37Å; E281-E287 VanDerWaalsContact O-OE2 3.13Å
282	Y	93.8	Very high	91.2	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.012	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-128	42.1	-178.8	-52.1	-82.1	0	0	0	111.4	L277 D278 M279 S280 E287 K290 F291 Q306 H328	L277-Y282 HydrophobicContact CB-CE2 4.28Å; D278-Y282 WeakPolarHBondContact O-CD2 3.47Å; M279-Y282 HydrophobicContact CE-CD2 3.66Å; M279-Y282 HydrophobicContact CE-CE2 3.8Å; M279-Y282 PolarHBondContact O-N 2.84Å; M279-Y282 VanDerWaalsContact O-N 3.13Å; M279-Y282 HydrophobicContact SD-CD2 4.39Å; S280-Y282 VanDerWaalsContact C-N 3.28Å; Y282-E287 HydrophobicContact CD1-CB 4.43Å; Y282-E287 WeakPolarHBondContact CD1-O 3.43Å; Y282-K290 HydrophobicContact CE1-CB 4.44Å; Y282-F291 HydrophobicContact CD1-CB 4.04Å; Y282-F291 HydrophobicContact CD1-CD2 4.28Å; Y282-F291 HydrophobicContact CD2-CD2 4.44Å; Y282-F291 HydrophobicContact CE1-CB 3.83Å; Y282-F291 AromaticContact CE1-CD2 3.94Å; Y282-F291 HydrophobicContact CE1-CD2 3.94Å; Y282-F291 HydrophobicContact CE1-CG 4.39Å; Y282-F291 HydrophobicContact CE2-CD2 4.1Å; Y282-F291 AromaticContact CZ-CD2 3.83Å; Y282-Q306 PolarHBondContact OH-OE1 3.32Å; Y282-H328 WeakPolarHBondContact O-CB 3.48Å; Y282-H328 PolarHBondContact O-N 2.88Å
283	Q	92.6	Very high	91.2	Very high	97 Å²	97	52.3 Å²	52.3	45%	0.453	25%	0.247	S	C	.	.			trans	-80.7	-30.1	178.5	-82	176.6	88	0	0	111.5	S280 E287 K326 H328	S280-Q283 PolarHBondContact O-NE2 3.16Å; Q283-E287 PolarHBondContact N-OE2 3.25Å; Q283-K326 HydrophobicContact CG-CB 4.4Å; Q283-K326 WeakPolarHBondContact CG-O 3.35Å; Q283-H328 PolarHBondContact O-CD2 3.46Å
284	E	92.1	Very high	90.8	Very high	109 Å²	109	53.1 Å²	53.1	51%	0.509	25%	0.252	S	S	.	.	S	Bend	trans	-102.9	149.1	-175.3	-65.2	-64	156.2	0	0	112.7	H286 E287 V288	E284-H286 WeakPolarHBondContact CB-CE1 3.47Å; E284-H286 WeakPolarHBondContact CB-ND1 3.33Å; E284-H286 PolarHBondContact O-N 2.88Å; E284-H286 VanDerWaalsContact O-N 3.12Å; E284-E287 HydrophobicContact CB-CG 4.12Å; E284-E287 PolarHBondContact N-OE2 2.8Å; E284-E287 WeakPolarHBondContact O-CB 3.43Å; E284-E287 PolarHBondContact O-N 2.91Å; E284-V288 WeakPolarHBondContact O-CG2 3.07Å; E284-V288 PolarHBondContact O-N 3.36Å
285	K	87.5	Confident	89.8	Confident	147 Å²	147	53.7 Å²	53.7	64%	0.639	26%	0.261	S	S	*	.	H	α-helix	trans	-56.1	-34.9	-177.6	-173.7	174	-177.5	176.7	0	113.9	E287 V288	K285-E287 VanDerWaalsContact C-N 3.35Å; K285-V288 WeakPolarHBondContact O-CB 3.4Å
286	H	85.4	Confident	88.8	Confident	128 Å²	128	57.6 Å²	57.6	59%	0.593	29%	0.287	S	S	*	.	H	α-helix	trans	-76.9	-22.2	180	66.3	-84.2	0	0	0	112.9	E284	E284-H286 WeakPolarHBondContact CB-CE1 3.47Å; E284-H286 WeakPolarHBondContact CB-ND1 3.33Å; E284-H286 PolarHBondContact O-N 2.88Å; E284-H286 VanDerWaalsContact O-N 3.12Å
287	E	88.4	Confident	88	Confident	42 Å²	42	56 Å²	56	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-75.7	-31	174.7	-63.9	173.2	152.8	0	0	111.2	E281 Y282 Q283 E284 K285 A289 K290	E281-E287 WeakPolarHBondContact O-CB 3.37Å; E281-E287 VanDerWaalsContact O-OE2 3.13Å; Y282-E287 HydrophobicContact CD1-CB 4.43Å; Y282-E287 WeakPolarHBondContact CD1-O 3.43Å; Q283-E287 PolarHBondContact N-OE2 3.25Å; E284-E287 HydrophobicContact CB-CG 4.12Å; E284-E287 PolarHBondContact N-OE2 2.8Å; E284-E287 WeakPolarHBondContact O-CB 3.43Å; E284-E287 PolarHBondContact O-N 2.91Å; K285-E287 VanDerWaalsContact C-N 3.35Å; E287-A289 PolarHBondContact O-N 3.49Å; E287-A289 VanDerWaalsContact O-N 3.16Å; E287-K290 VanDerWaalsContact O-CB 3.3Å; E287-K290 WeakPolarHBondContact O-CB 3.23Å; E287-K290 PolarHBondContact O-N 3.39Å
288	V	88.9	Confident	87	Confident	12 Å²	12	63.6 Å²	63.6	7%	0.073	34%	0.337	C	S	.	.	H	α-helix	trans	-54.8	-34.7	174.8	-173.8	0	0	0	0	112	E284 K285 K290 F291 H328 D330 V331 I334	E284-V288 WeakPolarHBondContact O-CG2 3.07Å; E284-V288 PolarHBondContact O-N 3.36Å; K285-V288 WeakPolarHBondContact O-CB 3.4Å; V288-K290 VanDerWaalsContact C-N 3.25Å; V288-K290 PolarHBondContact O-N 2.79Å; V288-F291 WeakPolarHBondContact O-CB 3.18Å; V288-F291 PolarHBondContact O-N 3.16Å; V288-H328 HydrophobicContact CG2-CB 3.87Å; V288-D330 HydrophobicContact CG1-CB 4.01Å; V288-D330 HydrophobicContact CG2-CB 4.35Å; V288-V331 HydrophobicContact CB-CG2 4.24Å; V288-V331 HydrophobicContact CG1-CG2 3.91Å; V288-V331 HydrophobicContact CG2-CG2 3.69Å; V288-I334 HydrophobicContact CG1-CD1 3.82Å
289	A	86.6	Confident	85.8	Confident	28 Å²	28	68.5 Å²	68.5	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-62.2	-31.9	175.8	0	0	0	0	0	112.6	E287 F291 G293 S294	E287-A289 PolarHBondContact O-N 3.49Å; E287-A289 VanDerWaalsContact O-N 3.16Å; A289-F291 PolarHBondContact O-N 2.82Å; A289-G293 CarbonylContact O-C 3.13Å; A289-G293 WeakPolarHBondContact O-CA 3.4Å; A289-G293 PolarHBondContact O-N 3.34Å; A289-S294 PolarHBondContact O-N 2.96Å
290	K	87.2	Confident	84.5	Confident	126 Å²	126	69.6 Å²	69.6	55%	0.548	38%	0.379	S	S	.	.	H	α-helix	trans	-70.1	-19.9	176.1	-59.5	177	-179.7	170	0	112.7	Y282 E287 V288 G305 Q306	Y282-K290 HydrophobicContact CE1-CB 4.44Å; E287-K290 VanDerWaalsContact O-CB 3.3Å; E287-K290 WeakPolarHBondContact O-CB 3.23Å; E287-K290 PolarHBondContact O-N 3.39Å; V288-K290 VanDerWaalsContact C-N 3.25Å; V288-K290 PolarHBondContact O-N 2.79Å; K290-G305 WeakPolarHBondContact O-CA 3.22Å; K290-Q306 PolarHBondContact O-N 3.17Å
291	F	89.3	Confident	83	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-67.5	-52.8	-179.1	-170	-112.3	0	0	0	111.6	L277 M279 Y282 V288 A289 Q306 L307 F321 V331 I334 M335	L277-F291 HydrophobicContact CD1-CD2 4.23Å; L277-F291 HydrophobicContact CD1-CE2 3.69Å; M279-F291 HydrophobicContact CE-CE2 4.36Å; Y282-F291 HydrophobicContact CD1-CB 4.04Å; Y282-F291 HydrophobicContact CD1-CD2 4.28Å; Y282-F291 HydrophobicContact CD2-CD2 4.44Å; Y282-F291 HydrophobicContact CE1-CB 3.83Å; Y282-F291 AromaticContact CE1-CD2 3.94Å; Y282-F291 HydrophobicContact CE1-CD2 3.94Å; Y282-F291 HydrophobicContact CE1-CG 4.39Å; Y282-F291 HydrophobicContact CE2-CD2 4.1Å; Y282-F291 AromaticContact CZ-CD2 3.83Å; V288-F291 WeakPolarHBondContact O-CB 3.18Å; V288-F291 PolarHBondContact O-N 3.16Å; A289-F291 PolarHBondContact O-N 2.82Å; F291-Q306 PolarHBondContact O-N 2.97Å; F291-L307 HydrophobicContact CD1-CD2 4.4Å; F291-L307 HydrophobicContact CD2-CB 4.42Å; F291-L307 HydrophobicContact CE1-CD2 3.62Å; F291-L307 HydrophobicContact CE2-CB 4.33Å; F291-L307 HydrophobicContact CE2-CD2 4.02Å; F291-L307 HydrophobicContact CZ-CB 4.48Å; F291-L307 HydrophobicContact CZ-CD2 3.41Å; F291-L307 VanDerWaalsContact CZ-CD2 3.41Å; F291-L307 WeakPolarHBondContact O-CB 3.26Å; F291-L307 PolarHBondContact O-N 3.46Å; F291-L307 VanDerWaalsContact O-N 3.09Å; F291-F321 HydrophobicContact CE2-CD1 4.26Å; F291-F321 AromaticContact CE2-CE1 3.72Å; F291-F321 HydrophobicContact CE2-CE1 3.72Å; F291-F321 HydrophobicContact CZ-CD1 4.34Å; F291-F321 AromaticContact CZ-CE1 3.55Å; F291-F321 HydrophobicContact CZ-CE1 3.55Å; F291-F321 HydrophobicContact CZ-CZ 4.18Å; F291-V331 HydrophobicContact CD1-CG1 4.3Å; F291-V331 HydrophobicContact CD2-CG1 4.48Å; F291-V331 HydrophobicContact CE1-CG1 4.04Å; F291-V331 HydrophobicContact CE2-CG1 4.2Å; F291-V331 HydrophobicContact CZ-CG1 3.96Å; F291-I334 HydrophobicContact CD1-CD1 4.23Å; F291-I334 HydrophobicContact CD1-CG2 4.11Å; F291-I334 HydrophobicContact CE1-CB 4.41Å; F291-I334 HydrophobicContact CE1-CG2 3.92Å; F291-M335 HydrophobicContact CE1-CG 4.46Å; F291-M335 HydrophobicContact CZ-CG 4.32Å
292	I	86.6	Confident	81.8	Confident	40 Å²	40	74.4 Å²	74.4	21%	0.205	40%	0.399	C	S	.	.	H	α-helix	trans	-100.8	-24.1	-180	52.3	169.7	0	0	0	114.5	G305 T308 I334 L344	I292-G305 WeakPolarHBondContact O-CA 3.42Å; I292-G305 PolarHBondContact O-N 3.49Å; I292-T308 HydrophobicContact CB-CG2 4.37Å; I292-T308 HydrophobicContact CG2-CG2 4.45Å; I292-T308 WeakPolarHBondContact O-CG2 3.44Å; I292-T308 PolarHBondContact O-OG1 3Å; I292-I334 HydrophobicContact CD1-CD1 3.93Å; I292-I334 HydrophobicContact CG1-CD1 4.2Å; I292-I334 HydrophobicContact CG2-CD1 4.05Å; I292-I334 HydrophobicContact CG2-CG2 3.64Å; I292-L344 HydrophobicContact CG2-CD1 3.96Å; I292-L344 HydrophobicContact CG2-CD2 4.28Å; I292-L344 HydrophobicContact CG2-CG 4.3Å
293	G	85.9	Confident	80.6	Confident	5 Å²	5	81.6 Å²	81.6	5%	0.052	43%	0.432	C	S	.	.			trans	119.8	138.5	-173.3	0	0	0	0	0	111	A289 G305	A289-G293 CarbonylContact O-C 3.13Å; A289-G293 WeakPolarHBondContact O-CA 3.4Å; A289-G293 PolarHBondContact O-N 3.34Å; G293-G305 VanDerWaalsContact N-CA 3.3Å
294	S	83	Confident	79.8	Confident	17 Å²	17	78.1 Å²	78.1	12%	0.119	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-62.5	141.1	176.1	-63.5	0	0	0	0	110.6	A289 V299 H301	A289-S294 PolarHBondContact O-N 2.96Å; S294-V299 PolarHBondContact OG-O 3.43Å; S294-H301 PolarHBondContact O-CD2 3.35Å
295	P	77.3	Confident	79.5	Confident	60 Å²	60	73 Å²	73	39%	0.39	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-67.1	165.2	176.8	25.8	-31.1	0	0	0	112.1	G297 Y298	P295-G297 PolarHBondContact O-N 3.13Å; P295-Y298 HydrophobicContact CG-CD2 3.66Å; P295-Y298 HydrophobicContact CG-CE2 3.92Å; P295-Y298 HydrophobicContact CG-CG 4.36Å; P295-Y298 PolarHBondContact O-N 3.16Å
296	P	75.2	Confident	79.6	Confident	94 Å²	94	69.9 Å²	69.9	61%	0.61	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	130.9	179.7	-24.1	34.3	0	0	0	111.8	H301 G347	P296-H301 VanDerWaalsContact CA-CD2 3.46Å; P296-H301 WeakPolarHBondContact CA-CD2 3.39Å; P296-G347 WeakPolarHBondContact CD-O 3.37Å
297	G	77.7	Confident	79.9	Confident	84 Å²	84	63.8 Å²	63.8	87%	0.866	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	-2.7	-179.5	0	0	0	0	0	115.8	P295	P295-G297 PolarHBondContact O-N 3.13Å
298	Y	76.5	Confident	80.1	Confident	163 Å²	163	62 Å²	62	64%	0.639	35%	0.35	S	S	*	.	S	Bend	trans	-102.9	151.8	175.8	-75	-100.5	0	0	0	112.6	P295 G300 H301	P295-Y298 HydrophobicContact CG-CD2 3.66Å; P295-Y298 HydrophobicContact CG-CE2 3.92Å; P295-Y298 HydrophobicContact CG-CG 4.36Å; P295-Y298 PolarHBondContact O-N 3.16Å; Y298-G300 PolarHBondContact O-N 3.15Å; Y298-H301 WeakPolarHBondContact O-CB 3.19Å; Y298-H301 PolarHBondContact O-N 3.09Å
299	V	69.5	Low	80.2	Confident	148 Å²	148	68 Å²	68	90%	0.897	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	130.9	173.5	-176.3	0	0	0	0	109.2	S294	S294-V299 PolarHBondContact OG-O 3.43Å
300	G	66	Low	80.4	Confident	23 Å²	23	68.4 Å²	68.4	24%	0.237	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	3.4	-177.6	0	0	0	0	0	115.5	Y298 E302 Q303	Y298-G300 PolarHBondContact O-N 3.15Å; G300-E302 PolarHBondContact O-N 2.94Å; G300-Q303 WeakPolarHBondContact O-CB 3.32Å; G300-Q303 PolarHBondContact O-N 3.33Å
301	H	61.3	Low	80.7	Confident	57 Å²	57	62.4 Å²	62.4	26%	0.264	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-52.2	-35.7	174.6	177.1	-99.2	0	0	0	113.6	S294 P296 Y298 Q348	S294-H301 PolarHBondContact O-CD2 3.35Å; P296-H301 VanDerWaalsContact CA-CD2 3.46Å; P296-H301 WeakPolarHBondContact CA-CD2 3.39Å; Y298-H301 WeakPolarHBondContact O-CB 3.19Å; Y298-H301 PolarHBondContact O-N 3.09Å; H301-Q348 PolarHBondContact O-NE2 3.37Å
302	E	66.5	Low	80.7	Confident	179 Å²	179	66.5 Å²	66.5	84%	0.836	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-77.6	-17.6	178.2	-62.9	-168.2	166.9	0	0	114	G300 G304	G300-E302 PolarHBondContact O-N 2.94Å; E302-G304 VanDerWaalsContact C-N 3.27Å; E302-G304 PolarHBondContact O-N 3.08Å
303	Q	69.7	Low	80.8	Confident	154 Å²	154	69.7 Å²	69.7	72%	0.72	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-75.4	-18.7	-177.2	-66.7	-176.6	-6.9	0	0	112.8	G300	G300-Q303 WeakPolarHBondContact O-CB 3.32Å; G300-Q303 PolarHBondContact O-N 3.33Å
304	G	75.6	Confident	81	Confident	25 Å²	25	72.2 Å²	72.2	26%	0.258	40%	0.398	S	S	.	.			trans	67.2	175.6	-170.1	0	0	0	0	0	112.3	E302	E302-G304 VanDerWaalsContact C-N 3.27Å; E302-G304 PolarHBondContact O-N 3.08Å
305	G	85.9	Confident	81.4	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.01	41%	0.41	C	S	.	.			trans	-81.8	150.2	172.6	0	0	0	0	0	112.2	K290 I292 G293 T308 K309	K290-G305 WeakPolarHBondContact O-CA 3.22Å; I292-G305 WeakPolarHBondContact O-CA 3.42Å; I292-G305 PolarHBondContact O-N 3.49Å; G293-G305 VanDerWaalsContact N-CA 3.3Å; G305-T308 WeakPolarHBondContact CA-OG1 3.5Å; G305-T308 PolarHBondContact N-OG1 2.74Å; G305-T308 VanDerWaalsContact N-OG1 3.14Å; G305-T308 PolarHBondContact O-OG1 2.94Å; G305-K309 WeakPolarHBondContact O-CB 3.45Å; G305-K309 PolarHBondContact O-N 2.83Å
306	Q	89.4	Confident	82.1	Confident	82 Å²	82	74.2 Å²	74.2	38%	0.383	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-42.1	177.1	-171.4	174.7	-10.5	0	0	111.9	L277 Y282 K290 F291 S310	L277-Q306 HydrophobicContact CD2-CG 3.76Å; L277-Q306 VanDerWaalsContact CD2-NE2 3.33Å; Y282-Q306 PolarHBondContact OH-OE1 3.32Å; K290-Q306 PolarHBondContact O-N 3.17Å; F291-Q306 PolarHBondContact O-N 2.97Å; Q306-S310 WeakPolarHBondContact O-CB 3.32Å; Q306-S310 PolarHBondContact O-N 3.34Å; Q306-S310 PolarHBondContact O-OG 3.35Å
307	L	92.6	Very high	83.1	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-73	-48.6	177.5	179.3	61.4	0	0	0	110.9	L277 F291 S310 L311 V319 F321 L338 L344	L277-L307 HydrophobicContact CD1-CB 4Å; L277-L307 HydrophobicContact CD1-CD1 3.92Å; L277-L307 HydrophobicContact CD1-CG 4.42Å; F291-L307 HydrophobicContact CD1-CD2 4.4Å; F291-L307 HydrophobicContact CD2-CB 4.42Å; F291-L307 HydrophobicContact CE1-CD2 3.62Å; F291-L307 HydrophobicContact CE2-CB 4.33Å; F291-L307 HydrophobicContact CE2-CD2 4.02Å; F291-L307 HydrophobicContact CZ-CB 4.48Å; F291-L307 HydrophobicContact CZ-CD2 3.41Å; F291-L307 VanDerWaalsContact CZ-CD2 3.41Å; F291-L307 WeakPolarHBondContact O-CB 3.26Å; F291-L307 PolarHBondContact O-N 3.46Å; F291-L307 VanDerWaalsContact O-N 3.09Å; L307-S310 PolarHBondContact O-N 3.32Å; L307-L311 HydrophobicContact CD1-CD1 3.68Å; L307-L311 HydrophobicContact CD1-CG 3.96Å; L307-L311 HydrophobicContact CD2-CD1 4.44Å; L307-L311 HydrophobicContact CG-CD1 3.83Å; L307-L311 HydrophobicContact CG-CG 4.42Å; L307-L311 WeakPolarHBondContact O-CB 3.36Å; L307-L311 PolarHBondContact O-N 3.11Å; L307-V319 HydrophobicContact CD1-CG1 3.86Å; L307-V319 HydrophobicContact CD1-CG2 4.4Å; L307-F321 HydrophobicContact CD1-CE1 4.46Å; L307-F321 HydrophobicContact CD1-CZ 4.45Å; L307-F321 HydrophobicContact CD2-CE1 4.2Å; L307-F321 HydrophobicContact CD2-CZ 4.11Å; L307-L338 HydrophobicContact CD2-CD2 4.15Å; L307-L344 HydrophobicContact CD2-CD2 3.67Å; L307-L344 HydrophobicContact CG-CD2 3.9Å
308	T	91	Very high	84	Confident	3 Å²	3	65.8 Å²	65.8	2%	0.018	34%	0.337	C	S	.	.	H	α-helix	trans	-60.2	-50.7	-177.5	46.7	0	0	0	0	111.1	I292 G305 S310 L311 T312 L344 D346 I352	I292-T308 HydrophobicContact CB-CG2 4.37Å; I292-T308 HydrophobicContact CG2-CG2 4.45Å; I292-T308 WeakPolarHBondContact O-CG2 3.44Å; I292-T308 PolarHBondContact O-OG1 3Å; G305-T308 WeakPolarHBondContact CA-OG1 3.5Å; G305-T308 PolarHBondContact N-OG1 2.74Å; G305-T308 VanDerWaalsContact N-OG1 3.14Å; G305-T308 PolarHBondContact O-OG1 2.94Å; T308-S310 VanDerWaalsContact C-N 3.3Å; T308-S310 PolarHBondContact O-N 3.27Å; T308-L311 PolarHBondContact O-N 2.71Å; T308-T312 PolarHBondContact O-N 3.38Å; T308-T312 PolarHBondContact O-OG1 3.2Å; T308-L344 HydrophobicContact CG2-CD2 3.46Å; T308-L344 VanDerWaalsContact CG2-CD2 3.46Å; T308-L344 HydrophobicContact CG2-CG 3.82Å; T308-D346 HydrophobicContact CG2-CB 3.87Å; T308-I352 HydrophobicContact CG2-CD1 3.99Å; T308-I352 WeakPolarHBondContact O-CD1 3.41Å
309	K	90.5	Very high	85	Confident	140 Å²	140	58 Å²	58	61%	0.609	31%	0.307	S	S	*	.	H	α-helix	trans	-57.6	-42.1	177.9	-174.8	177.1	-177.8	173.8	0	113	G305 T312 E313	G305-K309 WeakPolarHBondContact O-CB 3.45Å; G305-K309 PolarHBondContact O-N 2.83Å; K309-T312 PolarHBondContact O-N 2.92Å; K309-E313 PolarHBondContact O-N 3.36Å; K309-E313 VanDerWaalsContact O-N 3.16Å
310	S	92	Very high	86.4	Confident	35 Å²	35	51 Å²	51	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-69.3	-39.6	-179.3	-54.8	0	0	0	0	111.7	Q306 L307 T308 E313 Y314	Q306-S310 WeakPolarHBondContact O-CB 3.32Å; Q306-S310 PolarHBondContact O-N 3.34Å; Q306-S310 PolarHBondContact O-OG 3.35Å; L307-S310 PolarHBondContact O-N 3.32Å; T308-S310 VanDerWaalsContact C-N 3.3Å; T308-S310 PolarHBondContact O-N 3.27Å; S310-E313 PolarHBondContact O-N 2.82Å; S310-Y314 PolarHBondContact O-N 3.36Å
311	L	92.5	Very high	87.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-72.9	-32.1	175.2	-75.4	176.3	0	0	0	113	I275 L307 T308 E313 Y314 P315 V319 L344 I352 C354	I275-L311 HydrophobicContact CD1-CD2 4.14Å; I275-L311 HydrophobicContact CD1-CG 4.38Å; L307-L311 HydrophobicContact CD1-CD1 3.68Å; L307-L311 HydrophobicContact CD1-CG 3.96Å; L307-L311 HydrophobicContact CD2-CD1 4.44Å; L307-L311 HydrophobicContact CG-CD1 3.83Å; L307-L311 HydrophobicContact CG-CG 4.42Å; L307-L311 WeakPolarHBondContact O-CB 3.36Å; L307-L311 PolarHBondContact O-N 3.11Å; T308-L311 PolarHBondContact O-N 2.71Å; L311-E313 PolarHBondContact O-N 2.75Å; L311-Y314 CarbonylContact O-C 3.58Å; L311-Y314 PolarHBondContact O-N 3.04Å; L311-P315 WeakPolarHBondContact O-CA 3.34Å; L311-P315 WeakPolarHBondContact O-CD 3.5Å; L311-P315 WeakPolarHBondContact O-CG 3.41Å; L311-V319 HydrophobicContact CD2-CG2 3.85Å; L311-L344 HydrophobicContact CD1-CD2 4.45Å; L311-I352 HydrophobicContact CB-CG2 4.16Å; L311-C354 HydrophobicContact CD1-CB 4.4Å; L311-C354 HydrophobicContact CD2-CB 4.39Å
312	T	90.1	Very high	89.5	Confident	86 Å²	86	47.7 Å²	47.7	53%	0.528	24%	0.243	S	C	.	.	H	α-helix	trans	-62	-38.2	171	-55.7	0	0	0	0	110.7	T308 K309 I352	T308-T312 PolarHBondContact O-N 3.38Å; T308-T312 PolarHBondContact O-OG1 3.2Å; K309-T312 PolarHBondContact O-N 2.92Å; T312-I352 WeakPolarHBondContact OG1-CD1 3.44Å; T312-I352 WeakPolarHBondContact OG1-CG1 3.35Å
313	E	88.9	Confident	90.8	Very high	107 Å²	107	41.1 Å²	41.1	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-73.6	-39.3	177.2	-161.1	-177.3	-178.1	0	0	112.1	K272 K309 S310 L311	K272-E313 VanDerWaalsContact CD-OE1 3.26Å; K272-E313 WeakPolarHBondContact CD-OE1 3.16Å; K272-E313 WeakPolarHBondContact CE-OE1 3.36Å; K272-E313 IonicContact NZ-OE1 2.7Å; K272-E313 PolarHBondContact NZ-OE1 3.12Å; K309-E313 PolarHBondContact O-N 3.36Å; K309-E313 VanDerWaalsContact O-N 3.16Å; S310-E313 PolarHBondContact O-N 2.82Å; L311-E313 PolarHBondContact O-N 2.75Å
314	Y	90.9	Very high	92	Very high	59 Å²	59	33.9 Å²	33.9	23%	0.231	18%	0.178	C	C	.	.			trans	-136.5	87.6	178.7	-77.9	-91.8	0	0	0	111.9	N270 K272 A273 S310 L311 N316 A317	N270-Y314 WeakPolarHBondContact ND2-CE1 3.18Å; N270-Y314 VanDerWaalsContact ND2-CZ 3.31Å; N270-Y314 PolarHBondContact ND2-OH 3.45Å; K272-Y314 HydrophobicContact CB-CD2 3.46Å; K272-Y314 VanDerWaalsContact CB-CD2 3.46Å; K272-Y314 HydrophobicContact CB-CE2 3.2Å; K272-Y314 HydrophobicContact CB-CG 4.27Å; K272-Y314 HydrophobicContact CD-CD2 4.3Å; K272-Y314 HydrophobicContact CD-CE2 3.43Å; K272-Y314 VanDerWaalsContact CD-CE2 3.43Å; K272-Y314 HydrophobicContact CG-CE2 3.97Å; A273-Y314 HydrophobicContact CB-CD1 4.28Å; S310-Y314 PolarHBondContact O-N 3.36Å; L311-Y314 CarbonylContact O-C 3.58Å; L311-Y314 PolarHBondContact O-N 3.04Å; Y314-N316 VanDerWaalsContact C-N 3.27Å; Y314-N316 PolarHBondContact O-N 3.38Å; Y314-A317 VanDerWaalsContact O-CB 3.22Å; Y314-A317 WeakPolarHBondContact O-CB 3.41Å; Y314-A317 PolarHBondContact O-N 2.95Å
315	P	91.2	Very high	92.8	Very high	58 Å²	58	35.3 Å²	35.3	38%	0.377	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.4	-176.1	-25.5	34.8	0	0	0	115.2	L311 A357	L311-P315 WeakPolarHBondContact O-CA 3.34Å; L311-P315 WeakPolarHBondContact O-CD 3.5Å; L311-P315 WeakPolarHBondContact O-CG 3.41Å; P315-A357 WeakPolarHBondContact O-CB 3.4Å
316	N	91.9	Very high	93.1	Very high	61 Å²	61	39.4 Å²	39.4	33%	0.326	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	21.7	178.2	64.6	-7.5	0	0	0	112.8	H267 Y314 E356	H267-N316 PolarHBondContact CE1-O 3.46Å; H267-N316 PolarHBondContact NE2-O 3.38Å; H267-N316 VanDerWaalsContact NE2-O 3.13Å; Y314-N316 VanDerWaalsContact C-N 3.27Å; Y314-N316 PolarHBondContact O-N 3.38Å; N316-E356 HydrophobicContact CB-CB 3.87Å
317	A	95.3	Very high	93.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.			trans	-65.2	159.5	-179.8	0	0	0	0	0	113.2	A273 I275 Y314 A357 I358	A273-A317 WeakPolarHBondContact O-CA 3.44Å; A273-A317 WeakPolarHBondContact O-CB 3.36Å; I275-A317 HydrophobicContact CD1-CB 3.63Å; I275-A317 HydrophobicContact CG1-CB 4.18Å; Y314-A317 VanDerWaalsContact O-CB 3.22Å; Y314-A317 WeakPolarHBondContact O-CB 3.41Å; Y314-A317 PolarHBondContact O-N 2.95Å; A317-A357 WeakPolarHBondContact O-CA 3.48Å; A317-A357 WeakPolarHBondContact O-CB 3.15Å; A317-I358 PolarHBondContact O-N 2.8Å; A317-I358 VanDerWaalsContact O-N 3.11Å
318	V	97.1	Very high	93.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.6	164.6	-177.8	0	0	0	0	108.4	V262 A263 L266 A273 F274 I275 I358 I360	V262-V318 HydrophobicContact CG1-CG1 4.37Å; V262-V318 HydrophobicContact CG1-CG2 4.09Å; A263-V318 HydrophobicContact CB-CB 3.77Å; A263-V318 HydrophobicContact CB-CG1 4.31Å; A263-V318 HydrophobicContact CB-CG2 3.83Å; L266-V318 HydrophobicContact CD1-CG2 4.15Å; A273-V318 PolarHBondContact O-N 3.39Å; F274-V318 WeakPolarHBondContact CA-O 3.47Å; F274-V318 HydrophobicContact CD2-CG1 4.45Å; I275-V318 PolarHBondContact N-O 3.32Å; V318-I358 CarbonylContact C-O 3.59Å; V318-I358 WeakPolarHBondContact CA-O 3.39Å; V318-I358 HydrophobicContact CG2-CB 4.32Å; V318-I360 HydrophobicContact CG1-CD1 3.81Å; V318-I360 HydrophobicContact CG1-CG1 4.44Å
319	V	97.5	Very high	93.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.3	-177.6	-176	0	0	0	0	109.7	I275 L307 L311 F321 I358 F359 I360	I275-V319 HydrophobicContact CB-CG1 4.45Å; I275-V319 HydrophobicContact CB-CG2 4.23Å; I275-V319 HydrophobicContact CD1-CG2 4.04Å; I275-V319 HydrophobicContact CG2-CG1 4.38Å; I275-V319 CarbonylContact O-C 3.57Å; I275-V319 WeakPolarHBondContact O-CA 3.43Å; L307-V319 HydrophobicContact CD1-CG1 3.86Å; L307-V319 HydrophobicContact CD1-CG2 4.4Å; L311-V319 HydrophobicContact CD2-CG2 3.85Å; V319-F321 HydrophobicContact CG1-CD1 4.37Å; V319-F321 HydrophobicContact CG1-CD2 4.44Å; V319-F321 HydrophobicContact CG1-CE1 3.82Å; V319-F321 HydrophobicContact CG1-CE2 3.93Å; V319-F321 HydrophobicContact CG1-CZ 3.58Å; V319-I358 PolarHBondContact N-O 3.23Å; V319-F359 HydrophobicContact CB-CD1 3.65Å; V319-F359 HydrophobicContact CB-CE1 3.89Å; V319-F359 HydrophobicContact CG1-CD1 4.11Å; V319-F359 HydrophobicContact CG1-CE1 4.29Å; V319-F359 HydrophobicContact CG2-CD1 4.05Å; V319-F359 HydrophobicContact CG2-CE1 3.77Å; V319-I360 PolarHBondContact O-N 3.44Å
320	L	97.9	Very high	93.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	113.5	176.3	-177.4	66.2	0	0	0	110.7	T256 A259 F274 I275 R276 L277 I360 T362	T256-L320 HydrophobicContact CG2-CD2 3.5Å; T256-L320 VanDerWaalsContact CG2-CD2 3.5Å; A259-L320 HydrophobicContact CB-CD1 3.78Å; A259-L320 HydrophobicContact CB-CD2 4.13Å; A259-L320 HydrophobicContact CB-CG 4.39Å; F274-L320 HydrophobicContact CE2-CB 3.97Å; F274-L320 HydrophobicContact CE2-CD2 4.38Å; F274-L320 HydrophobicContact CZ-CB 4.03Å; F274-L320 HydrophobicContact CZ-CD2 3.83Å; I275-L320 PolarHBondContact O-N 3.34Å; R276-L320 HydrophobicContact CG-CD2 4.14Å; L277-L320 PolarHBondContact N-O 3.1Å; L320-I360 CarbonylContact C-O 3.55Å; L320-I360 VanDerWaalsContact CA-O 3.28Å; L320-I360 WeakPolarHBondContact CA-O 3.3Å; L320-I360 HydrophobicContact CD1-CB 3.94Å; L320-I360 HydrophobicContact CD1-CG2 3.63Å; L320-T362 HydrophobicContact CD1-CG2 3.54Å; L320-T362 HydrophobicContact CG-CG2 4.46Å
321	F	97	Very high	93.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	100.7	166.9	-54.5	-70.3	0	0	0	109.1	L277 M279 F291 L307 V319 I324 M335 F339 F359 I360 M361 T362	L277-F321 HydrophobicContact CB-CD1 4.22Å; L277-F321 HydrophobicContact CD1-CD1 4.14Å; L277-F321 HydrophobicContact CD1-CE1 3.78Å; L277-F321 WeakPolarHBondContact O-CA 3.49Å; M279-F321 HydrophobicContact CE-CB 4.23Å; M279-F321 HydrophobicContact CE-CD1 3.69Å; M279-F321 HydrophobicContact CE-CG 4.44Å; M279-F321 HydrophobicContact CG-CB 4.2Å; M279-F321 HydrophobicContact SD-CB 4.16Å; M279-F321 HydrophobicContact SD-CD1 4.12Å; F291-F321 HydrophobicContact CE2-CD1 4.26Å; F291-F321 AromaticContact CE2-CE1 3.72Å; F291-F321 HydrophobicContact CE2-CE1 3.72Å; F291-F321 HydrophobicContact CZ-CD1 4.34Å; F291-F321 AromaticContact CZ-CE1 3.55Å; F291-F321 HydrophobicContact CZ-CE1 3.55Å; F291-F321 HydrophobicContact CZ-CZ 4.18Å; L307-F321 HydrophobicContact CD1-CE1 4.46Å; L307-F321 HydrophobicContact CD1-CZ 4.45Å; L307-F321 HydrophobicContact CD2-CE1 4.2Å; L307-F321 HydrophobicContact CD2-CZ 4.11Å; V319-F321 HydrophobicContact CG1-CD1 4.37Å; V319-F321 HydrophobicContact CG1-CD2 4.44Å; V319-F321 HydrophobicContact CG1-CE1 3.82Å; V319-F321 HydrophobicContact CG1-CE2 3.93Å; V319-F321 HydrophobicContact CG1-CZ 3.58Å; F321-I324 HydrophobicContact CB-CD1 4.43Å; F321-M335 HydrophobicContact CB-CE 4.38Å; F321-M335 HydrophobicContact CD1-CE 4.38Å; F321-M335 HydrophobicContact CD2-CE 3.4Å; F321-M335 VanDerWaalsContact CD2-CE 3.4Å; F321-M335 HydrophobicContact CE2-CE 3.59Å; F321-M335 HydrophobicContact CG-CE 3.82Å; F321-M335 HydrophobicContact CZ-CE 4.19Å; F321-F339 HydrophobicContact CE2-CE1 4.32Å; F321-F339 HydrophobicContact CE2-CZ 4.15Å; F321-F359 HydrophobicContact CE2-CB 4.33Å; F321-F359 AromaticContact CE2-CD1 3.56Å; F321-F359 HydrophobicContact CE2-CD1 3.56Å; F321-F359 HydrophobicContact CE2-CE1 4.36Å; F321-F359 HydrophobicContact CE2-CG 4.33Å; F321-F359 AromaticContact CZ-CD1 3.99Å; F321-F359 HydrophobicContact CZ-CD1 3.99Å; F321-F359 HydrophobicContact CZ-CE1 4.36Å; F321-I360 PolarHBondContact N-O 3.42Å; F321-M361 HydrophobicContact CB-CG 4.13Å; F321-M361 HydrophobicContact CD2-CG 3.96Å; F321-M361 CarbonylContact O-C 3.57Å; F321-M361 WeakPolarHBondContact O-CA 3.42Å; F321-T362 PolarHBondContact O-N 2.83Å
322	D	95.9	Very high	93.3	Very high	12 Å²	12	35.5 Å²	35.5	6%	0.064	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	136.5	-176.7	-142.7	4.8	0	0	0	110.5	R276 L277 M279 T362	R276-D322 IonicContact CZ-OD2 2.66Å; R276-D322 IonicContact NE-OD2 3.16Å; R276-D322 PolarHBondContact NE-OD2 3.17Å; R276-D322 IonicContact NH2-OD2 3.42Å; R276-D322 PolarHBondContact NH2-OD2 3.31Å; L277-D322 PolarHBondContact O-N 3.45Å; M279-D322 VanDerWaalsContact CB-O 3.23Å; M279-D322 WeakPolarHBondContact CB-O 3.36Å; M279-D322 VanDerWaalsContact CG-O 3.24Å; M279-D322 WeakPolarHBondContact CG-O 3.36Å; M279-D322 PolarHBondContact N-O 2.89Å; D322-T362 WeakPolarHBondContact CA-OG1 3.5Å; D322-T362 WeakPolarHBondContact OD1-CG2 3.28Å; D322-T362 PolarHBondContact OD1-OG1 2.99Å
323	E	94.8	Very high	93.2	Very high	40 Å²	40	34.5 Å²	34.5	19%	0.187	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	51.4	176.2	-54	-167.2	145.2	0	0	114.8	M279 S280 E325 K326 T362	M279-E323 WeakPolarHBondContact CB-O 3.37Å; S280-E323 PolarHBondContact OG-OE2 3.35Å; E323-E325 PolarHBondContact O-N 3.3Å; E323-K326 HydrophobicContact CB-CD 4.16Å; E323-K326 WeakPolarHBondContact O-CB 3.27Å; E323-K326 PolarHBondContact O-N 3.33Å; E323-K326 VanDerWaalsContact OE2-CE 3.29Å; E323-K326 WeakPolarHBondContact OE2-CE 3.11Å; E323-K326 IonicContact OE2-NZ 3.65Å; E323-K326 PolarHBondContact OE2-NZ 2.85Å; E323-T362 WeakPolarHBondContact CA-O 3.41Å; E323-T362 PolarHBondContact N-O 3.25Å; E323-T362 PolarHBondContact N-OG1 3.06Å
324	I	94	Very high	93.3	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-54.7	-25.9	-174.2	-164.6	61.8	0	0	0	114.9	L246 M279 F321 K326 A327 L332 M335 M361 T362 L420	L246-I324 HydrophobicContact CD1-CG2 4.2Å; M279-I324 HydrophobicContact CG-CD1 4Å; M279-I324 HydrophobicContact SD-CD1 4.18Å; F321-I324 HydrophobicContact CB-CD1 4.43Å; I324-K326 PolarHBondContact O-N 3.14Å; I324-A327 HydrophobicContact CD1-CB 4.15Å; I324-A327 WeakPolarHBondContact O-CB 3.33Å; I324-A327 PolarHBondContact O-N 2.95Å; I324-A327 VanDerWaalsContact O-N 3.12Å; I324-L332 HydrophobicContact CD1-CD2 3.77Å; I324-L332 HydrophobicContact CG1-CD2 4.01Å; I324-M335 HydrophobicContact CD1-CE 3.77Å; I324-M335 HydrophobicContact CD1-SD 3.77Å; I324-M361 HydrophobicContact CB-CB 4.44Å; I324-M361 HydrophobicContact CD1-SD 4.28Å; I324-M361 HydrophobicContact CG1-SD 4.07Å; I324-T362 PolarHBondContact N-O 3.12Å; I324-L420 HydrophobicContact CG2-CD2 4.44Å
325	E	92.3	Very high	93.3	Very high	56 Å²	56	27.7 Å²	27.7	26%	0.262	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-62.3	-19	175.3	62.7	-88.1	-157.5	0	0	114.3	E323 S363 N364 L365	E323-E325 PolarHBondContact O-N 3.3Å; E325-S363 WeakPolarHBondContact OE2-CA 3.45Å; E325-S363 VanDerWaalsContact OE2-CB 3.25Å; E325-S363 WeakPolarHBondContact OE2-CB 3.29Å; E325-S363 PolarHBondContact OE2-OG 3.16Å; E325-N364 PolarHBondContact OE1-N 2.88Å; E325-N364 VanDerWaalsContact OE1-N 3.09Å; E325-L365 HydrophobicContact CB-CD1 3.86Å; E325-L365 HydrophobicContact CB-CD2 4.08Å; E325-L365 HydrophobicContact CB-CG 3.83Å; E325-L365 HydrophobicContact CG-CD2 4.48Å; E325-L365 HydrophobicContact CG-CG 4.31Å
326	K	93.5	Very high	93.2	Very high	87 Å²	87	26 Å²	26	38%	0.378	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-91.5	-10	177.6	-62.8	179.7	177.4	177.2	0	113.2	S280 Q283 E323 I324	S280-K326 WeakPolarHBondContact OG-CD 3.05Å; S280-K326 PolarHBondContact OG-NZ 3.14Å; Q283-K326 HydrophobicContact CG-CB 4.4Å; Q283-K326 WeakPolarHBondContact CG-O 3.35Å; E323-K326 HydrophobicContact CB-CD 4.16Å; E323-K326 WeakPolarHBondContact O-CB 3.27Å; E323-K326 PolarHBondContact O-N 3.33Å; E323-K326 VanDerWaalsContact OE2-CE 3.29Å; E323-K326 WeakPolarHBondContact OE2-CE 3.11Å; E323-K326 IonicContact OE2-NZ 3.65Å; E323-K326 PolarHBondContact OE2-NZ 2.85Å; I324-K326 PolarHBondContact O-N 3.14Å
327	A	93.3	Very high	93	Very high	12 Å²	12	27.1 Å²	27.1	10%	0.099	14%	0.14	C	C	.	.	S	Bend	trans	-64.7	142.4	-177.2	0	0	0	0	0	111.9	M279 I324 V331 L332	M279-A327 HydrophobicContact CB-CB 3.98Å; M279-A327 HydrophobicContact CG-CB 4.22Å; M279-A327 HydrophobicContact SD-CB 4.16Å; I324-A327 HydrophobicContact CD1-CB 4.15Å; I324-A327 WeakPolarHBondContact O-CB 3.33Å; I324-A327 PolarHBondContact O-N 2.95Å; I324-A327 VanDerWaalsContact O-N 3.12Å; A327-V331 HydrophobicContact CB-CB 4.4Å; A327-L332 HydrophobicContact CB-CD2 4.22Å
328	H	92.8	Very high	92.8	Very high	42 Å²	42	27.1 Å²	27.1	19%	0.194	14%	0.14	C	C	.	.			trans	-62.5	143.7	169.7	-172.8	-92.4	0	0	0	110.9	Y282 Q283 V288 D330 V331 L332	Y282-H328 WeakPolarHBondContact O-CB 3.48Å; Y282-H328 PolarHBondContact O-N 2.88Å; Q283-H328 PolarHBondContact O-CD2 3.46Å; V288-H328 HydrophobicContact CG2-CB 3.87Å; H328-D330 VanDerWaalsContact CE1-CG 3.48Å; H328-D330 IonicContact CE1-OD1 3.56Å; H328-D330 IonicContact CE1-OD2 2.77Å; H328-D330 PolarHBondContact CE1-OD2 3.39Å; H328-D330 VanDerWaalsContact CE1-OD2 3.27Å; H328-D330 WeakPolarHBondContact ND1-CB 3.23Å; H328-D330 PolarHBondContact ND1-N 3.41Å; H328-D330 VanDerWaalsContact ND1-N 3.15Å; H328-D330 IonicContact ND1-OD2 2.75Å; H328-D330 PolarHBondContact O-N 3.38Å; H328-V331 HydrophobicContact CB-CG2 4.25Å; H328-V331 WeakPolarHBondContact O-CB 3.27Å; H328-V331 PolarHBondContact O-N 3.2Å; H328-L332 PolarHBondContact O-N 2.59Å
329	P	90.9	Very high	92.6	Very high	53 Å²	53	27.3 Å²	27.3	34%	0.344	14%	0.141	S	C	.	.	H	α-helix	trans	-55	-28.6	-179.4	-29.1	36	0	0	0	115.4	L332 T333 R422	P329-L332 PolarHBondContact O-N 3.09Å; P329-T333 PolarHBondContact O-N 2.63Å; P329-T333 PolarHBondContact O-OG1 3.37Å; P329-T333 VanDerWaalsContact O-OG1 3.11Å; P329-R422 PolarHBondContact O-NH1 2.93Å; P329-R422 PolarHBondContact O-NH2 3.45Å
330	D	90.5	Very high	92.2	Very high	60 Å²	60	30.2 Å²	30.2	32%	0.321	16%	0.156	S	C	.	.	H	α-helix	trans	-70.8	-32.2	177.2	-66.2	-14.6	0	0	0	112.3	V288 H328 L332 T333 I334	V288-D330 HydrophobicContact CG1-CB 4.01Å; V288-D330 HydrophobicContact CG2-CB 4.35Å; H328-D330 VanDerWaalsContact CE1-CG 3.48Å; H328-D330 IonicContact CE1-OD1 3.56Å; H328-D330 IonicContact CE1-OD2 2.77Å; H328-D330 PolarHBondContact CE1-OD2 3.39Å; H328-D330 VanDerWaalsContact CE1-OD2 3.27Å; H328-D330 WeakPolarHBondContact ND1-CB 3.23Å; H328-D330 PolarHBondContact ND1-N 3.41Å; H328-D330 VanDerWaalsContact ND1-N 3.15Å; H328-D330 IonicContact ND1-OD2 2.75Å; H328-D330 PolarHBondContact O-N 3.38Å; D330-L332 VanDerWaalsContact C-N 3.32Å; D330-T333 VanDerWaalsContact O-CB 3.31Å; D330-T333 WeakPolarHBondContact O-CB 3.34Å; D330-T333 PolarHBondContact O-N 2.7Å; D330-T333 VanDerWaalsContact O-N 3.17Å; D330-I334 PolarHBondContact O-N 3.46Å
331	V	92.2	Very high	91.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.3	-43.8	172.7	-178.5	0	0	0	0	109.6	M279 V288 F291 A327 H328 T333 I334 M335	M279-V331 HydrophobicContact SD-CG1 4.27Å; V288-V331 HydrophobicContact CB-CG2 4.24Å; V288-V331 HydrophobicContact CG1-CG2 3.91Å; V288-V331 HydrophobicContact CG2-CG2 3.69Å; F291-V331 HydrophobicContact CD1-CG1 4.3Å; F291-V331 HydrophobicContact CD2-CG1 4.48Å; F291-V331 HydrophobicContact CE1-CG1 4.04Å; F291-V331 HydrophobicContact CE2-CG1 4.2Å; F291-V331 HydrophobicContact CZ-CG1 3.96Å; A327-V331 HydrophobicContact CB-CB 4.4Å; H328-V331 HydrophobicContact CB-CG2 4.25Å; H328-V331 WeakPolarHBondContact O-CB 3.27Å; H328-V331 PolarHBondContact O-N 3.2Å; V331-T333 PolarHBondContact O-N 3.21Å; V331-I334 PolarHBondContact O-N 3.05Å; V331-I334 VanDerWaalsContact O-N 3.12Å; V331-M335 HydrophobicContact CG1-CG 4.43Å; V331-M335 HydrophobicContact CG1-SD 4.02Å; V331-M335 WeakPolarHBondContact O-CG 3.32Å; V331-M335 PolarHBondContact O-N 2.81Å
332	L	90.8	Very high	91.5	Very high	11 Å²	11	33.3 Å²	33.3	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-32.5	176.1	-58.3	179.1	0	0	0	111.7	I324 A327 H328 P329 D330 M335 L336 L420 F425	I324-L332 HydrophobicContact CD1-CD2 3.77Å; I324-L332 HydrophobicContact CG1-CD2 4.01Å; A327-L332 HydrophobicContact CB-CD2 4.22Å; H328-L332 PolarHBondContact O-N 2.59Å; P329-L332 PolarHBondContact O-N 3.09Å; D330-L332 VanDerWaalsContact C-N 3.32Å; L332-M335 HydrophobicContact CD2-SD 4.33Å; L332-M335 PolarHBondContact O-N 3.35Å; L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.41Å; L332-L420 HydrophobicContact CD1-CD2 4.48Å; L332-F425 HydrophobicContact CD2-CE2 4.13Å; L332-F425 HydrophobicContact CD2-CZ 4.02Å
333	T	88.5	Confident	91.3	Very high	64 Å²	64	37.8 Å²	37.8	39%	0.393	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-45.3	174.6	-45	0	0	0	0	111.5	P329 D330 V331 M335 L336 Q337 R422	P329-T333 PolarHBondContact O-N 2.63Å; P329-T333 PolarHBondContact O-OG1 3.37Å; P329-T333 VanDerWaalsContact O-OG1 3.11Å; D330-T333 VanDerWaalsContact O-CB 3.31Å; D330-T333 WeakPolarHBondContact O-CB 3.34Å; D330-T333 PolarHBondContact O-N 2.7Å; D330-T333 VanDerWaalsContact O-N 3.17Å; V331-T333 PolarHBondContact O-N 3.21Å; T333-M335 VanDerWaalsContact C-N 3.31Å; T333-M335 PolarHBondContact O-N 2.82Å; T333-L336 WeakPolarHBondContact O-CB 3.22Å; T333-L336 PolarHBondContact O-N 2.98Å; T333-Q337 PolarHBondContact O-N 2.96Å; T333-R422 VanDerWaalsContact N-NH1 3.11Å; T333-R422 PolarHBondContact OG1-NH1 3.12Å; T333-R422 PolarHBondContact OG1-NH2 3.46Å
334	I	90.2	Very high	91.1	Very high	24 Å²	24	36 Å²	36	12%	0.123	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-42.6	178.1	-64	166	0	0	0	109.9	V288 F291 I292 D330 V331 L336 Q337 L338 L344	V288-I334 HydrophobicContact CG1-CD1 3.82Å; F291-I334 HydrophobicContact CD1-CD1 4.23Å; F291-I334 HydrophobicContact CD1-CG2 4.11Å; F291-I334 HydrophobicContact CE1-CB 4.41Å; F291-I334 HydrophobicContact CE1-CG2 3.92Å; I292-I334 HydrophobicContact CD1-CD1 3.93Å; I292-I334 HydrophobicContact CG1-CD1 4.2Å; I292-I334 HydrophobicContact CG2-CD1 4.05Å; I292-I334 HydrophobicContact CG2-CG2 3.64Å; D330-I334 PolarHBondContact O-N 3.46Å; V331-I334 PolarHBondContact O-N 3.05Å; V331-I334 VanDerWaalsContact O-N 3.12Å; I334-L336 VanDerWaalsContact C-N 3.32Å; I334-L336 PolarHBondContact O-N 3.36Å; I334-Q337 PolarHBondContact O-N 2.79Å; I334-L338 PolarHBondContact O-N 2.8Å; I334-L344 HydrophobicContact CG2-CD1 3.53Å
335	M	91.6	Very high	90.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-34.2	177.9	-68	174.4	71.2	0	0	112.9	F291 F321 I324 V331 L332 T333 L338 F339 M361 F425	F291-M335 HydrophobicContact CE1-CG 4.46Å; F291-M335 HydrophobicContact CZ-CG 4.32Å; F321-M335 HydrophobicContact CB-CE 4.38Å; F321-M335 HydrophobicContact CD1-CE 4.38Å; F321-M335 HydrophobicContact CD2-CE 3.4Å; F321-M335 VanDerWaalsContact CD2-CE 3.4Å; F321-M335 HydrophobicContact CE2-CE 3.59Å; F321-M335 HydrophobicContact CG-CE 3.82Å; F321-M335 HydrophobicContact CZ-CE 4.19Å; I324-M335 HydrophobicContact CD1-CE 3.77Å; I324-M335 HydrophobicContact CD1-SD 3.77Å; V331-M335 HydrophobicContact CG1-CG 4.43Å; V331-M335 HydrophobicContact CG1-SD 4.02Å; V331-M335 WeakPolarHBondContact O-CG 3.32Å; V331-M335 PolarHBondContact O-N 2.81Å; L332-M335 HydrophobicContact CD2-SD 4.33Å; L332-M335 PolarHBondContact O-N 3.35Å; T333-M335 VanDerWaalsContact C-N 3.31Å; T333-M335 PolarHBondContact O-N 2.82Å; M335-L338 WeakPolarHBondContact O-CB 2.95Å; M335-L338 PolarHBondContact O-N 2.81Å; M335-F339 HydrophobicContact CB-CE2 4.04Å; M335-F339 HydrophobicContact CB-CZ 4.14Å; M335-F339 HydrophobicContact CE-CE2 3.86Å; M335-F339 HydrophobicContact CE-CZ 3.47Å; M335-F339 VanDerWaalsContact CE-CZ 3.47Å; M335-F339 WeakPolarHBondContact O-CB 3.13Å; M335-F339 VanDerWaalsContact O-CD2 3.3Å; M335-F339 WeakPolarHBondContact O-CD2 3.26Å; M335-F339 WeakPolarHBondContact O-CG 3.42Å; M335-F339 PolarHBondContact O-N 3.47Å; M335-M361 HydrophobicContact CE-CG 4.04Å; M335-M361 HydrophobicContact CE-SD 3.58Å; M335-M361 VanDerWaalsContact CE-SD 3.58Å; M335-F425 HydrophobicContact CB-CE2 3.98Å; M335-F425 HydrophobicContact CE-CE2 4.46Å; M335-F425 HydrophobicContact CE-CZ 4.17Å
336	L	89.1	Confident	90.5	Very high	23 Å²	23	36.8 Å²	36.8	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-49.6	173.4	-78.5	169.4	0	0	0	111.4	L332 T333 I334 L338 F339 D340 E424 F425 R428	L332-L336 WeakPolarHBondContact O-CG 3.45Å; L332-L336 PolarHBondContact O-N 3.41Å; T333-L336 WeakPolarHBondContact O-CB 3.22Å; T333-L336 PolarHBondContact O-N 2.98Å; I334-L336 VanDerWaalsContact C-N 3.32Å; I334-L336 PolarHBondContact O-N 3.36Å; L336-L338 VanDerWaalsContact C-N 3.29Å; L336-L338 PolarHBondContact O-N 2.91Å; L336-F339 PolarHBondContact O-N 3.32Å; L336-D340 VanDerWaalsContact O-CB 3.29Å; L336-D340 WeakPolarHBondContact O-CB 3.38Å; L336-D340 PolarHBondContact O-N 3.44Å; L336-E424 HydrophobicContact CD2-CB 4.39Å; L336-F425 VanDerWaalsContact CD2-CA 3.42Å; L336-F425 HydrophobicContact CD2-CB 3.8Å; L336-F425 HydrophobicContact CD2-CD2 3.73Å; L336-F425 HydrophobicContact CD2-CG 4.24Å; L336-F425 HydrophobicContact CG-CD2 3.92Å; L336-R428 HydrophobicContact CD2-CG 4.41Å
337	Q	87	Confident	89.8	Confident	84 Å²	84	33.5 Å²	33.5	39%	0.393	18%	0.178	S	C	.	.	H	α-helix	trans	-60.8	-43	178.2	-175.2	179.5	1.6	0	0	111	T333 I334 F339 D340 E341	T333-Q337 PolarHBondContact O-N 2.96Å; I334-Q337 PolarHBondContact O-N 2.79Å; Q337-F339 PolarHBondContact O-N 3.32Å; Q337-D340 PolarHBondContact O-N 3.04Å; Q337-E341 HydrophobicContact CG-CG 4.31Å; Q337-E341 WeakPolarHBondContact CG-OE2 3.29Å; Q337-E341 PolarHBondContact NE2-OE2 3Å; Q337-E341 WeakPolarHBondContact O-CB 3.44Å; Q337-E341 PolarHBondContact O-N 3.28Å
338	L	92.1	Very high	89.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.1	-45.7	177.4	176.7	57.5	0	0	0	112.6	L307 I334 M335 L336 G342 L344 C354 F359	L307-L338 HydrophobicContact CD2-CD2 4.15Å; I334-L338 PolarHBondContact O-N 2.8Å; M335-L338 WeakPolarHBondContact O-CB 2.95Å; M335-L338 PolarHBondContact O-N 2.81Å; L336-L338 VanDerWaalsContact C-N 3.29Å; L336-L338 PolarHBondContact O-N 2.91Å; L338-G342 VanDerWaalsContact O-CA 3.26Å; L338-G342 WeakPolarHBondContact O-CA 3.45Å; L338-G342 PolarHBondContact O-N 3.43Å; L338-L344 HydrophobicContact CD1-CB 4.23Å; L338-C354 WeakPolarHBondContact CD1-SG 3.14Å; L338-F359 HydrophobicContact CD1-CE1 4.48Å; L338-F359 HydrophobicContact CD1-CE2 4.31Å; L338-F359 HydrophobicContact CD1-CZ 3.79Å; L338-F359 HydrophobicContact CD2-CD1 4.26Å; L338-F359 HydrophobicContact CD2-CE1 3.61Å; L338-F359 HydrophobicContact CD2-CE2 4.49Å; L338-F359 HydrophobicContact CD2-CZ 3.75Å; L338-F359 HydrophobicContact CG-CE1 4.22Å; L338-F359 HydrophobicContact CG-CE2 4.24Å; L338-F359 HydrophobicContact CG-CZ 3.85Å
339	F	92.4	Very high	88.7	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-76.4	-24.6	-178.3	-58.8	-20	0	0	0	113.1	V244 F321 M335 L336 Q337 F359 M361 F425 R428	V244-F339 HydrophobicContact CG1-CD1 4.47Å; V244-F339 HydrophobicContact CG1-CD2 3.96Å; V244-F339 HydrophobicContact CG1-CE1 4.33Å; V244-F339 HydrophobicContact CG1-CE2 3.77Å; V244-F339 HydrophobicContact CG1-CG 4.3Å; V244-F339 HydrophobicContact CG1-CZ 3.96Å; V244-F339 HydrophobicContact CG2-CB 4.01Å; V244-F339 HydrophobicContact CG2-CD1 3.56Å; V244-F339 HydrophobicContact CG2-CD2 4.14Å; V244-F339 HydrophobicContact CG2-CE1 4.02Å; V244-F339 HydrophobicContact CG2-CG 3.64Å; V244-F339 HydrophobicContact CG2-CZ 4.45Å; F321-F339 HydrophobicContact CE2-CE1 4.32Å; F321-F339 HydrophobicContact CE2-CZ 4.15Å; M335-F339 HydrophobicContact CB-CE2 4.04Å; M335-F339 HydrophobicContact CB-CZ 4.14Å; M335-F339 HydrophobicContact CE-CE2 3.86Å; M335-F339 HydrophobicContact CE-CZ 3.47Å; M335-F339 VanDerWaalsContact CE-CZ 3.47Å; M335-F339 WeakPolarHBondContact O-CB 3.13Å; M335-F339 VanDerWaalsContact O-CD2 3.3Å; M335-F339 WeakPolarHBondContact O-CD2 3.26Å; M335-F339 WeakPolarHBondContact O-CG 3.42Å; M335-F339 PolarHBondContact O-N 3.47Å; L336-F339 PolarHBondContact O-N 3.32Å; Q337-F339 PolarHBondContact O-N 3.32Å; F339-F359 HydrophobicContact CD1-CB 4.47Å; F339-F359 HydrophobicContact CD1-CD2 4.06Å; F339-F359 HydrophobicContact CD1-CG 4.2Å; F339-F359 HydrophobicContact CE1-CB 3.64Å; F339-F359 AromaticContact CE1-CD1 3.98Å; F339-F359 HydrophobicContact CE1-CD1 3.98Å; F339-F359 AromaticContact CE1-CD2 3.87Å; F339-F359 HydrophobicContact CE1-CD2 3.87Å; F339-F359 AromaticContact CE1-CG 3.53Å; F339-F359 HydrophobicContact CE1-CG 3.53Å; F339-F359 HydrophobicContact CZ-CB 4.15Å; F339-F359 HydrophobicContact CZ-CG 4.45Å; F339-M361 HydrophobicContact CE2-CE 4.03Å; F339-M361 HydrophobicContact CE2-SD 4.01Å; F339-M361 HydrophobicContact CZ-CE 4.42Å; F339-M361 HydrophobicContact CZ-SD 4.19Å; F339-F425 HydrophobicContact CD2-CE2 4.28Å; F339-F425 AromaticContact CE2-CE2 3.88Å; F339-F425 HydrophobicContact CE2-CE2 3.88Å; F339-F425 HydrophobicContact CE2-CZ 4Å; F339-R428 HydrophobicContact CB-CB 3.98Å
340	D	89.3	Confident	88.5	Confident	60 Å²	60	39.8 Å²	39.8	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-84.6	-45.4	177.2	-167.6	11.7	0	0	0	112.3	H241 L336 Q337 R428	H241-D340 PolarHBondContact CE1-O 3.42Å; H241-D340 IonicContact CE1-OD1 3.42Å; H241-D340 PolarHBondContact ND1-O 3.46Å; L336-D340 VanDerWaalsContact O-CB 3.29Å; L336-D340 WeakPolarHBondContact O-CB 3.38Å; L336-D340 PolarHBondContact O-N 3.44Å; Q337-D340 PolarHBondContact O-N 3.04Å; D340-R428 IonicContact OD1-CZ 3.98Å; D340-R428 IonicContact OD1-NH1 2.64Å; D340-R428 PolarHBondContact OD1-NH1 3.29Å; D340-R428 IonicContact OD1-NH2 3.9Å; D340-R428 PolarHBondContact OD1-NH2 3.36Å; D340-R428 VanDerWaalsContact OD1-NH2 3.09Å; D340-R428 IonicContact OD2-CZ 3.48Å; D340-R428 IonicContact OD2-NH1 3.45Å; D340-R428 IonicContact OD2-NH2 2.78Å; D340-R428 PolarHBondContact OD2-NH2 3.31Å
341	E	89.4	Confident	88.4	Confident	66 Å²	66	40.7 Å²	40.7	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-99.9	-10.4	-172.8	-57.9	-172.9	140.2	0	0	113.2	Q337 R343	Q337-E341 HydrophobicContact CG-CG 4.31Å; Q337-E341 WeakPolarHBondContact CG-OE2 3.29Å; Q337-E341 PolarHBondContact NE2-OE2 3Å; Q337-E341 WeakPolarHBondContact O-CB 3.44Å; Q337-E341 PolarHBondContact O-N 3.28Å; E341-R343 HydrophobicContact CB-CG 3.72Å; E341-R343 PolarHBondContact O-N 3.3Å; E341-R343 IonicContact OE1-CZ 3.24Å; E341-R343 IonicContact OE1-NE 3.72Å; E341-R343 IonicContact OE1-NH2 3.92Å; E341-R343 PolarHBondContact OE1-NH2 2.87Å; E341-R343 IonicContact OE2-CZ 3.22Å; E341-R343 IonicContact OE2-NE 3.72Å; E341-R343 PolarHBondContact OE2-NE 2.76Å; E341-R343 IonicContact OE2-NH2 3.4Å; E341-R343 PolarHBondContact OE2-NH2 3.39Å; E341-R343 VanDerWaalsContact OE2-NH2 3.16Å
342	G	90.4	Very high	88.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	59.8	25.5	-172.9	0	0	0	0	0	112.7	L338 C354 K355	L338-G342 VanDerWaalsContact O-CA 3.26Å; L338-G342 WeakPolarHBondContact O-CA 3.45Å; L338-G342 PolarHBondContact O-N 3.43Å; G342-C354 CarbonylContact O-C 3.51Å; G342-C354 PolarHBondContact O-N 3.47Å; G342-C354 PolarHBondContact O-SG 2.94Å; G342-K355 PolarHBondContact O-N 2.85Å
343	R	91.6	Very high	88.4	Confident	106 Å²	106	46.8 Å²	46.8	40%	0.4	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.6	-179.6	74.2	-169.9	177.1	-177.7	-6.9	111.8	E341 T351 I352	E341-R343 HydrophobicContact CB-CG 3.72Å; E341-R343 PolarHBondContact O-N 3.3Å; E341-R343 IonicContact OE1-CZ 3.24Å; E341-R343 IonicContact OE1-NE 3.72Å; E341-R343 IonicContact OE1-NH2 3.92Å; E341-R343 PolarHBondContact OE1-NH2 2.87Å; E341-R343 IonicContact OE2-CZ 3.22Å; E341-R343 IonicContact OE2-NE 3.72Å; E341-R343 PolarHBondContact OE2-NE 2.76Å; E341-R343 IonicContact OE2-NH2 3.4Å; E341-R343 PolarHBondContact OE2-NH2 3.39Å; E341-R343 VanDerWaalsContact OE2-NH2 3.16Å; R343-T351 HydrophobicContact CB-CG2 3.9Å; R343-T351 HydrophobicContact CG-CG2 4.12Å; R343-I352 CarbonylContact C-O 3.56Å; R343-I352 WeakPolarHBondContact CA-O 3.28Å; R343-I352 WeakPolarHBondContact CB-O 3.48Å
344	L	90.5	Very high	88.5	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	131	176.5	-168.1	62.2	0	0	0	109.6	I292 L307 T308 L311 I334 L338 T351 I352	I292-L344 HydrophobicContact CG2-CD1 3.96Å; I292-L344 HydrophobicContact CG2-CD2 4.28Å; I292-L344 HydrophobicContact CG2-CG 4.3Å; L307-L344 HydrophobicContact CD2-CD2 3.67Å; L307-L344 HydrophobicContact CG-CD2 3.9Å; T308-L344 HydrophobicContact CG2-CD2 3.46Å; T308-L344 VanDerWaalsContact CG2-CD2 3.46Å; T308-L344 HydrophobicContact CG2-CG 3.82Å; L311-L344 HydrophobicContact CD1-CD2 4.45Å; I334-L344 HydrophobicContact CG2-CD1 3.53Å; L338-L344 HydrophobicContact CD1-CB 4.23Å; L344-T351 WeakPolarHBondContact O-CA 3.42Å; L344-I352 PolarHBondContact N-O 3.12Å; L344-I352 PolarHBondContact O-N 3.18Å
345	T	87.1	Confident	88.6	Confident	50 Å²	50	46.4 Å²	46.4	31%	0.307	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.8	174.1	-54.2	0	0	0	0	109.4	N350 T351	T345-N350 WeakPolarHBondContact CA-O 3.48Å; T345-T351 PolarHBondContact OG1-OG1 2.95Å
346	D	86.1	Confident	88.5	Confident	24 Å²	24	52.9 Å²	52.9	13%	0.128	28%	0.276	C	S	.	.			trans	-77.2	174	177	73.7	10.1	0	0	0	112.4	T308 Q348 G349 N350	T308-D346 HydrophobicContact CG2-CB 3.87Å; D346-Q348 PolarHBondContact O-N 3.33Å; D346-Q348 VanDerWaalsContact O-N 3.15Å; D346-Q348 VanDerWaalsContact OD1-C 3.31Å; D346-Q348 VanDerWaalsContact OD1-CA 3.3Å; D346-Q348 WeakPolarHBondContact OD1-CA 3.3Å; D346-Q348 WeakPolarHBondContact OD1-CB 3.1Å; D346-Q348 PolarHBondContact OD1-N 3.18Å; D346-G349 PolarHBondContact O-N 3.5Å; D346-G349 PolarHBondContact OD1-N 3.25Å; D346-N350 PolarHBondContact N-O 2.76Å; D346-N350 PolarHBondContact OD1-N 2.82Å; D346-N350 WeakPolarHBondContact OD2-CB 3.44Å; D346-N350 PolarHBondContact OD2-ND2 3.46Å
347	G	80.2	Confident	88.7	Confident	19 Å²	19	51.8 Å²	51.8	20%	0.196	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.4	176.2	0	0	0	0	0	114.7	P296	P296-G347 WeakPolarHBondContact CD-O 3.37Å
348	Q	79.7	Confident	89.1	Confident	99 Å²	99	47.9 Å²	47.9	46%	0.463	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-8	179.3	-58.6	-177.8	4.8	0	0	112.6	H301 D346	H301-Q348 PolarHBondContact O-NE2 3.37Å; D346-Q348 PolarHBondContact O-N 3.33Å; D346-Q348 VanDerWaalsContact O-N 3.15Å; D346-Q348 VanDerWaalsContact OD1-C 3.31Å; D346-Q348 VanDerWaalsContact OD1-CA 3.3Å; D346-Q348 WeakPolarHBondContact OD1-CA 3.3Å; D346-Q348 WeakPolarHBondContact OD1-CB 3.1Å; D346-Q348 PolarHBondContact OD1-N 3.18Å
349	G	82.4	Confident	89.4	Confident	51 Å²	51	47.9 Å²	47.9	53%	0.526	25%	0.252	S	S	.	.	S	Bend	trans	92.5	6.6	-178.2	0	0	0	0	0	114.7	D346	D346-G349 PolarHBondContact O-N 3.5Å; D346-G349 PolarHBondContact OD1-N 3.25Å
350	N	86.3	Confident	89.6	Confident	88 Å²	88	47.7 Å²	47.7	47%	0.471	25%	0.251	S	S	.	.			trans	-78.8	129	174	-51.7	-58.6	0	0	0	109.8	T345 D346	T345-N350 WeakPolarHBondContact CA-O 3.48Å; D346-N350 PolarHBondContact N-O 2.76Å; D346-N350 PolarHBondContact OD1-N 2.82Å; D346-N350 WeakPolarHBondContact OD2-CB 3.44Å; D346-N350 PolarHBondContact OD2-ND2 3.46Å
351	T	90	Very high	90	Very high	80 Å²	80	44.9 Å²	44.9	49%	0.491	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.1	176.5	-58.7	0	0	0	0	110.5	R343 L344 T345	R343-T351 HydrophobicContact CB-CG2 3.9Å; R343-T351 HydrophobicContact CG-CG2 4.12Å; L344-T351 WeakPolarHBondContact O-CA 3.42Å; T345-T351 PolarHBondContact OG1-OG1 2.95Å
352	I	90.6	Very high	90.3	Very high	14 Å²	14	41.8 Å²	41.8	7%	0.072	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	123.1	178.1	-55.7	154.5	0	0	0	107.9	T308 L311 T312 R343 L344	T308-I352 HydrophobicContact CG2-CD1 3.99Å; T308-I352 WeakPolarHBondContact O-CD1 3.41Å; L311-I352 HydrophobicContact CB-CG2 4.16Å; T312-I352 WeakPolarHBondContact OG1-CD1 3.44Å; T312-I352 WeakPolarHBondContact OG1-CG1 3.35Å; R343-I352 CarbonylContact C-O 3.56Å; R343-I352 WeakPolarHBondContact CA-O 3.28Å; R343-I352 WeakPolarHBondContact CB-O 3.48Å; L344-I352 PolarHBondContact N-O 3.12Å; L344-I352 PolarHBondContact O-N 3.18Å
353	E	91.9	Very high	90.5	Very high	124 Å²	124	41.8 Å²	41.8	58%	0.579	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85	129.7	171.9	-64.2	-164.7	-177.6	0	0	110.4	K355	E353-K355 IonicContact OE2-NZ 2.63Å
354	C	91.3	Very high	90.6	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.014	21%	0.214	C	C	.	.			trans	-139.7	35.5	-176	45.4	0	0	0	0	111.4	L311 L338 G342 E356 A357 F359	L311-C354 HydrophobicContact CD1-CB 4.4Å; L311-C354 HydrophobicContact CD2-CB 4.39Å; L338-C354 WeakPolarHBondContact CD1-SG 3.14Å; G342-C354 CarbonylContact O-C 3.51Å; G342-C354 PolarHBondContact O-N 3.47Å; G342-C354 PolarHBondContact O-SG 2.94Å; C354-E356 PolarHBondContact O-N 2.87Å; C354-A357 HydrophobicContact CB-CB 3.98Å; C354-A357 VanDerWaalsContact O-CB 3.24Å; C354-A357 WeakPolarHBondContact O-CB 3.36Å; C354-A357 PolarHBondContact O-N 3.49Å; C354-F359 HydrophobicContact CB-CZ 4.45Å
355	K	90.9	Very high	90.8	Very high	79 Å²	79	39.9 Å²	39.9	34%	0.343	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.9	177	-65.1	168.5	-179.3	165.4	0	112.9	P242 G342 E353	P242-K355 WeakPolarHBondContact CA-O 3.5Å; G342-K355 PolarHBondContact O-N 2.85Å; E353-K355 IonicContact OE2-NZ 2.63Å
356	E	89.5	Confident	91	Very high	135 Å²	135	37.9 Å²	37.9	63%	0.631	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-8.6	176.7	-64	-175.3	176.9	0	0	113.4	N316 C354	N316-E356 HydrophobicContact CB-CB 3.87Å; C354-E356 PolarHBondContact O-N 2.87Å
357	A	94.1	Very high	91.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.			trans	-68.1	152.5	178.6	0	0	0	0	0	111.4	P242 P315 A317 C354 F359	P242-A357 WeakPolarHBondContact CB-O 3.46Å; P315-A357 WeakPolarHBondContact O-CB 3.4Å; A317-A357 WeakPolarHBondContact O-CA 3.48Å; A317-A357 WeakPolarHBondContact O-CB 3.15Å; C354-A357 HydrophobicContact CB-CB 3.98Å; C354-A357 VanDerWaalsContact O-CB 3.24Å; C354-A357 WeakPolarHBondContact O-CB 3.36Å; C354-A357 PolarHBondContact O-N 3.49Å; A357-F359 HydrophobicContact CB-CE2 3.74Å; A357-F359 HydrophobicContact CB-CZ 3.75Å
358	I	95.9	Very high	91.9	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.015	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.3	172.9	-59	-175.6	0	0	0	108.7	I229 L243 F245 V262 L266 A317 V318 V319 I360	I229-I358 HydrophobicContact CG1-CD1 4.28Å; L243-I358 HydrophobicContact CB-CG1 4.3Å; L243-I358 HydrophobicContact CB-CG2 4.33Å; L243-I358 HydrophobicContact CD1-CD1 4.3Å; L243-I358 HydrophobicContact CD1-CG1 4.43Å; F245-I358 HydrophobicContact CD2-CG2 3.8Å; F245-I358 HydrophobicContact CE2-CG2 3.63Å; V262-I358 HydrophobicContact CG1-CD1 4.39Å; L266-I358 HydrophobicContact CD1-CD1 3.32Å; L266-I358 HydrophobicContact CD1-CG1 4.46Å; A317-I358 PolarHBondContact O-N 2.8Å; A317-I358 VanDerWaalsContact O-N 3.11Å; V318-I358 CarbonylContact C-O 3.59Å; V318-I358 WeakPolarHBondContact CA-O 3.39Å; V318-I358 HydrophobicContact CG2-CB 4.32Å; V319-I358 PolarHBondContact N-O 3.23Å; I358-I360 HydrophobicContact CG2-CD1 4.48Å; I358-I360 HydrophobicContact CG2-CG1 4.12Å
359	F	97	Very high	92.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.3	176.9	-61.1	-78.4	0	0	0	110	P242 L243 V244 F245 V319 F321 L338 F339 C354 A357	P242-F359 HydrophobicContact CB-CD2 3.66Å; P242-F359 HydrophobicContact CB-CE2 3.52Å; P242-F359 HydrophobicContact CG-CD2 3.74Å; P242-F359 HydrophobicContact CG-CE2 3.57Å; L243-F359 PolarHBondContact O-N 2.92Å; V244-F359 CarbonylContact C-O 3.56Å; V244-F359 WeakPolarHBondContact CA-O 3.46Å; V244-F359 HydrophobicContact CG2-CB 4.32Å; V244-F359 HydrophobicContact CG2-CD2 4.45Å; F245-F359 PolarHBondContact N-O 3.04Å; V319-F359 HydrophobicContact CB-CD1 3.65Å; V319-F359 HydrophobicContact CB-CE1 3.89Å; V319-F359 HydrophobicContact CG1-CD1 4.11Å; V319-F359 HydrophobicContact CG1-CE1 4.29Å; V319-F359 HydrophobicContact CG2-CD1 4.05Å; V319-F359 HydrophobicContact CG2-CE1 3.77Å; F321-F359 HydrophobicContact CE2-CB 4.33Å; F321-F359 AromaticContact CE2-CD1 3.56Å; F321-F359 HydrophobicContact CE2-CD1 3.56Å; F321-F359 HydrophobicContact CE2-CE1 4.36Å; F321-F359 HydrophobicContact CE2-CG 4.33Å; F321-F359 AromaticContact CZ-CD1 3.99Å; F321-F359 HydrophobicContact CZ-CD1 3.99Å; F321-F359 HydrophobicContact CZ-CE1 4.36Å; L338-F359 HydrophobicContact CD1-CE1 4.48Å; L338-F359 HydrophobicContact CD1-CE2 4.31Å; L338-F359 HydrophobicContact CD1-CZ 3.79Å; L338-F359 HydrophobicContact CD2-CD1 4.26Å; L338-F359 HydrophobicContact CD2-CE1 3.61Å; L338-F359 HydrophobicContact CD2-CE2 4.49Å; L338-F359 HydrophobicContact CD2-CZ 3.75Å; L338-F359 HydrophobicContact CG-CE1 4.22Å; L338-F359 HydrophobicContact CG-CE2 4.24Å; L338-F359 HydrophobicContact CG-CZ 3.85Å; F339-F359 HydrophobicContact CD1-CB 4.47Å; F339-F359 HydrophobicContact CD1-CD2 4.06Å; F339-F359 HydrophobicContact CD1-CG 4.2Å; F339-F359 HydrophobicContact CE1-CB 3.64Å; F339-F359 AromaticContact CE1-CD1 3.98Å; F339-F359 HydrophobicContact CE1-CD1 3.98Å; F339-F359 AromaticContact CE1-CD2 3.87Å; F339-F359 HydrophobicContact CE1-CD2 3.87Å; F339-F359 AromaticContact CE1-CG 3.53Å; F339-F359 HydrophobicContact CE1-CG 3.53Å; F339-F359 HydrophobicContact CZ-CB 4.15Å; F339-F359 HydrophobicContact CZ-CG 4.45Å; C354-F359 HydrophobicContact CB-CZ 4.45Å; A357-F359 HydrophobicContact CB-CE2 3.74Å; A357-F359 HydrophobicContact CB-CZ 3.75Å
360	I	97.9	Very high	93.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.9	176.4	-59.5	175.4	0	0	0	107.3	F245 F247 A259 V318 V319 L320 F321 I358	F245-I360 HydrophobicContact CB-CG1 4.36Å; F245-I360 HydrophobicContact CD2-CG1 4.09Å; F247-I360 HydrophobicContact CD1-CG2 4.05Å; F247-I360 HydrophobicContact CD2-CG2 3.5Å; F247-I360 HydrophobicContact CE1-CG2 3.98Å; F247-I360 HydrophobicContact CE2-CD1 4.27Å; F247-I360 HydrophobicContact CE2-CG2 3.41Å; F247-I360 VanDerWaalsContact CE2-CG2 3.41Å; F247-I360 HydrophobicContact CG-CG2 3.84Å; F247-I360 HydrophobicContact CZ-CD1 4.06Å; F247-I360 HydrophobicContact CZ-CG1 4.35Å; F247-I360 HydrophobicContact CZ-CG2 3.66Å; A259-I360 HydrophobicContact CB-CD1 3.68Å; A259-I360 HydrophobicContact CB-CG2 4.21Å; V318-I360 HydrophobicContact CG1-CD1 3.81Å; V318-I360 HydrophobicContact CG1-CG1 4.44Å; V319-I360 PolarHBondContact O-N 3.44Å; L320-I360 CarbonylContact C-O 3.55Å; L320-I360 VanDerWaalsContact CA-O 3.28Å; L320-I360 WeakPolarHBondContact CA-O 3.3Å; L320-I360 HydrophobicContact CD1-CB 3.94Å; L320-I360 HydrophobicContact CD1-CG2 3.63Å; F321-I360 PolarHBondContact N-O 3.42Å; I358-I360 HydrophobicContact CG2-CD1 4.48Å; I358-I360 HydrophobicContact CG2-CG1 4.12Å
361	M	96.7	Very high	93.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.5	171.8	-64.2	175.6	-72.7	0	0	108.9	V244 F245 L246 F247 F321 I324 M335 F339 F425 I429	V244-M361 HydrophobicContact CG1-CE 3.55Å; F245-M361 PolarHBondContact O-N 3.42Å; L246-M361 HydrophobicContact CB-CE 4.4Å; L246-M361 HydrophobicContact CD1-CB 3.77Å; F247-M361 WeakPolarHBondContact CB-O 3.09Å; F247-M361 PolarHBondContact N-O 2.93Å; F321-M361 HydrophobicContact CB-CG 4.13Å; F321-M361 HydrophobicContact CD2-CG 3.96Å; F321-M361 CarbonylContact O-C 3.57Å; F321-M361 WeakPolarHBondContact O-CA 3.42Å; I324-M361 HydrophobicContact CB-CB 4.44Å; I324-M361 HydrophobicContact CD1-SD 4.28Å; I324-M361 HydrophobicContact CG1-SD 4.07Å; M335-M361 HydrophobicContact CE-CG 4.04Å; M335-M361 HydrophobicContact CE-SD 3.58Å; M335-M361 VanDerWaalsContact CE-SD 3.58Å; F339-M361 HydrophobicContact CE2-CE 4.03Å; F339-M361 HydrophobicContact CE2-SD 4.01Å; F339-M361 HydrophobicContact CZ-CE 4.42Å; F339-M361 HydrophobicContact CZ-SD 4.19Å; M361-F425 HydrophobicContact CE-CE1 4.03Å; M361-F425 HydrophobicContact CE-CZ 4.08Å; M361-F425 HydrophobicContact SD-CE1 3.76Å; M361-F425 HydrophobicContact SD-CZ 3.41Å; M361-F425 WeakPolarHBondContact SD-CZ 3.41Å; M361-I429 HydrophobicContact CE-CD1 4.17Å; M361-I429 HydrophobicContact CE-CG1 3.94Å
362	T	96	Very high	93.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	144.8	168.7	81.9	0	0	0	0	109.9	F247 K255 L320 F321 D322 E323 I324	F247-T362 WeakPolarHBondContact O-CA 3.46Å; K255-T362 HydrophobicContact CB-CG2 4.05Å; L320-T362 HydrophobicContact CD1-CG2 3.54Å; L320-T362 HydrophobicContact CG-CG2 4.46Å; F321-T362 PolarHBondContact O-N 2.83Å; D322-T362 WeakPolarHBondContact CA-OG1 3.5Å; D322-T362 WeakPolarHBondContact OD1-CG2 3.28Å; D322-T362 PolarHBondContact OD1-OG1 2.99Å; E323-T362 WeakPolarHBondContact CA-O 3.41Å; E323-T362 PolarHBondContact N-O 3.25Å; E323-T362 PolarHBondContact N-OG1 3.06Å; I324-T362 PolarHBondContact N-O 3.12Å
363	S	95.1	Very high	93.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.8	170.8	-169.9	0	0	0	0	111.5	F247 G249 K255 E325 L365	F247-S363 PolarHBondContact O-N 2.93Å; G249-S363 PolarHBondContact N-O 3.32Å; K255-S363 PolarHBondContact NZ-O 2.88Å; E325-S363 WeakPolarHBondContact OE2-CA 3.45Å; E325-S363 VanDerWaalsContact OE2-CB 3.25Å; E325-S363 WeakPolarHBondContact OE2-CB 3.29Å; E325-S363 PolarHBondContact OE2-OG 3.16Å; S363-L365 VanDerWaalsContact OG-CB 3.31Å; S363-L365 WeakPolarHBondContact OG-CB 3.29Å; S363-L365 WeakPolarHBondContact OG-CG 3.12Å; S363-L365 PolarHBondContact OG-N 3.2Å; S363-L365 VanDerWaalsContact OG-N 3.11Å
364	N	93.9	Very high	93.6	Very high	46 Å²	46	28.5 Å²	28.5	25%	0.246	15%	0.145	C	C	.	.			trans	-94.6	4.7	168.5	-58.3	-56.4	0	0	0	112	G249 K255 E325 A367	G249-N364 PolarHBondContact O-OD1 3.14Å; K255-N364 PolarHBondContact NZ-OD1 2.97Å; E325-N364 PolarHBondContact OE1-N 2.88Å; E325-N364 VanDerWaalsContact OE1-N 3.09Å; N364-A367 WeakPolarHBondContact O-CB 3.18Å; N364-A367 PolarHBondContact O-N 2.88Å
365	L	93.2	Very high	93.5	Very high	23 Å²	23	31.8 Å²	31.8	12%	0.12	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	146.5	173.1	-68.9	176.2	0	0	0	110.8	M248 E325 S363 A367 I415 L416 N419	M248-L365 HydrophobicContact CE-CB 3.99Å; M248-L365 WeakPolarHBondContact CE-O 3.49Å; E325-L365 HydrophobicContact CB-CD1 3.86Å; E325-L365 HydrophobicContact CB-CD2 4.08Å; E325-L365 HydrophobicContact CB-CG 3.83Å; E325-L365 HydrophobicContact CG-CD2 4.48Å; E325-L365 HydrophobicContact CG-CG 4.31Å; S363-L365 VanDerWaalsContact OG-CB 3.31Å; S363-L365 WeakPolarHBondContact OG-CB 3.29Å; S363-L365 WeakPolarHBondContact OG-CG 3.12Å; S363-L365 PolarHBondContact OG-N 3.2Å; S363-L365 VanDerWaalsContact OG-N 3.11Å; L365-A367 PolarHBondContact O-N 3.01Å; L365-I415 HydrophobicContact CB-CG2 4.33Å; L365-L416 HydrophobicContact CB-CD2 4.4Å; L365-L416 HydrophobicContact CD1-CD2 3.99Å; L365-N419 HydrophobicContact CD1-CB 3.7Å; L365-N419 HydrophobicContact CD2-CB 4.16Å
366	A	92.2	Very high	93.5	Very high	7 Å²	7	34 Å²	34	6%	0.058	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	15.2	-178.6	0	0	0	0	0	115.2	M248 E368 E369 I370 I415	M248-A366 HydrophobicContact CE-CB 4.11Å; A366-E368 VanDerWaalsContact C-N 3.33Å; A366-E368 PolarHBondContact O-N 2.79Å; A366-E369 WeakPolarHBondContact CA-OE2 3.32Å; A366-E369 PolarHBondContact O-N 3.44Å; A366-I370 HydrophobicContact CB-CD1 4.15Å; A366-I370 HydrophobicContact CB-CG1 4.44Å; A366-I370 WeakPolarHBondContact O-CB 3.39Å; A366-I370 WeakPolarHBondContact O-CD1 3.23Å; A366-I370 WeakPolarHBondContact O-CG1 3.47Å; A366-I370 PolarHBondContact O-N 3.18Å; A366-I415 HydrophobicContact CB-CB 4.46Å; A366-I415 HydrophobicContact CB-CD1 3.77Å; A366-I415 HydrophobicContact CB-CG2 4.2Å
367	A	92.9	Very high	93.5	Very high	15 Å²	15	29.3 Å²	29.3	12%	0.124	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-38.7	-173.6	0	0	0	0	0	112.6	N364 L365 A371	N364-A367 WeakPolarHBondContact O-CB 3.18Å; N364-A367 PolarHBondContact O-N 2.88Å; L365-A367 PolarHBondContact O-N 3.01Å; A367-A371 WeakPolarHBondContact O-CB 3.24Å; A367-A371 PolarHBondContact O-N 3.35Å
368	E	93.3	Very high	93.2	Very high	124 Å²	124	31.8 Å²	31.8	58%	0.579	16%	0.16	S	C	*	.	H	α-helix	trans	-70.2	-40.2	179.4	-173.4	161	-136.9	0	0	111.5	A366 A371 S372 R483	A366-E368 VanDerWaalsContact C-N 3.33Å; A366-E368 PolarHBondContact O-N 2.79Å; E368-A371 PolarHBondContact O-N 3.03Å; E368-S372 VanDerWaalsContact O-CB 3.29Å; E368-S372 WeakPolarHBondContact O-CB 3.2Å; E368-S372 PolarHBondContact O-N 2.71Å; E368-S372 PolarHBondContact O-OG 3.26Å; E368-S372 VanDerWaalsContact O-OG 3.06Å; E368-R483 IonicContact OE1-CZ 3.08Å; E368-R483 IonicContact OE1-NH2 3.17Å; E368-R483 PolarHBondContact OE1-NH2 2.75Å
369	E	94.1	Very high	92.8	Very high	71 Å²	71	38.3 Å²	38.3	33%	0.332	19%	0.188	S	C	.	.	H	α-helix	trans	-64.8	-47.7	175.4	-64.2	82.1	172.1	0	0	110.9	A366 A371 S372 H373 F407 V411 I415	A366-E369 WeakPolarHBondContact CA-OE2 3.32Å; A366-E369 PolarHBondContact O-N 3.44Å; E369-A371 VanDerWaalsContact C-N 3.34Å; E369-A371 PolarHBondContact O-N 3.46Å; E369-S372 PolarHBondContact O-N 3.24Å; E369-S372 PolarHBondContact O-OG 3.06Å; E369-H373 WeakPolarHBondContact O-CB 3.45Å; E369-H373 PolarHBondContact O-N 3.32Å; E369-F407 HydrophobicContact CB-CE2 4.5Å; E369-F407 HydrophobicContact CB-CZ 3.96Å; E369-F407 WeakPolarHBondContact O-CZ 3.47Å; E369-V411 HydrophobicContact CB-CG1 3.83Å; E369-V411 HydrophobicContact CG-CG1 3.87Å; E369-I415 HydrophobicContact CG-CD1 4.17Å
370	I	93.3	Very high	92.3	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-47.4	176.7	-70.3	162.6	0	0	0	110	M248 A366 H373 A374 I403 F407 V412 Y434 L436	M248-I370 HydrophobicContact CB-CD1 3.86Å; M248-I370 HydrophobicContact CE-CD1 4.39Å; A366-I370 HydrophobicContact CB-CD1 4.15Å; A366-I370 HydrophobicContact CB-CG1 4.44Å; A366-I370 WeakPolarHBondContact O-CB 3.39Å; A366-I370 WeakPolarHBondContact O-CD1 3.23Å; A366-I370 WeakPolarHBondContact O-CG1 3.47Å; A366-I370 PolarHBondContact O-N 3.18Å; I370-H373 PolarHBondContact O-N 3.31Å; I370-A374 VanDerWaalsContact O-CB 3.27Å; I370-A374 WeakPolarHBondContact O-CB 3.19Å; I370-A374 PolarHBondContact O-N 3Å; I370-I403 HydrophobicContact CG1-CD1 4.47Å; I370-I403 HydrophobicContact CG2-CD1 3.91Å; I370-F407 HydrophobicContact CG1-CE1 4.06Å; I370-F407 HydrophobicContact CG1-CZ 4.5Å; I370-V412 HydrophobicContact CG1-CG2 4.33Å; I370-Y434 HydrophobicContact CD1-CD1 3.9Å; I370-Y434 HydrophobicContact CD1-CE1 4.26Å; I370-Y434 HydrophobicContact CG1-CD1 4.29Å; I370-L436 HydrophobicContact CG2-CD2 4.16Å
371	A	92.4	Very high	91.7	Very high	7 Å²	7	44.9 Å²	44.9	6%	0.058	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-47.6	-179.9	0	0	0	0	0	112	A367 E368 E369 H373 A374 L375 P437 V482	A367-A371 WeakPolarHBondContact O-CB 3.24Å; A367-A371 PolarHBondContact O-N 3.35Å; E368-A371 PolarHBondContact O-N 3.03Å; E369-A371 VanDerWaalsContact C-N 3.34Å; E369-A371 PolarHBondContact O-N 3.46Å; A371-H373 PolarHBondContact O-N 2.83Å; A371-A374 PolarHBondContact O-N 2.81Å; A371-L375 VanDerWaalsContact O-CG 3.29Å; A371-L375 WeakPolarHBondContact O-CG 3.46Å; A371-L375 PolarHBondContact O-N 3.1Å; A371-P437 HydrophobicContact CB-CG 3.62Å; A371-V482 HydrophobicContact CB-CG1 3.7Å
372	S	92.7	Very high	91.1	Very high	52 Å²	52	50.3 Å²	50.3	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-64.4	-39.7	-180	67	0	0	0	0	112.3	E368 E369 K376	E368-S372 VanDerWaalsContact O-CB 3.29Å; E368-S372 WeakPolarHBondContact O-CB 3.2Å; E368-S372 PolarHBondContact O-N 2.71Å; E368-S372 PolarHBondContact O-OG 3.26Å; E368-S372 VanDerWaalsContact O-OG 3.06Å; E369-S372 PolarHBondContact O-N 3.24Å; E369-S372 PolarHBondContact O-OG 3.06Å; S372-K376 WeakPolarHBondContact O-CG 3.47Å; S372-K376 PolarHBondContact O-N 3.38Å; S372-K376 VanDerWaalsContact O-N 3.14Å
373	H	92.7	Very high	90.5	Very high	33 Å²	33	56.6 Å²	56.6	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-66.9	-44.5	176.1	-174.2	55.2	0	0	0	111.7	E369 I370 A371 L375 K376 L377 F407	E369-H373 WeakPolarHBondContact O-CB 3.45Å; E369-H373 PolarHBondContact O-N 3.32Å; I370-H373 PolarHBondContact O-N 3.31Å; A371-H373 PolarHBondContact O-N 2.83Å; H373-L375 VanDerWaalsContact C-N 3.32Å; H373-L375 PolarHBondContact O-N 2.96Å; H373-K376 WeakPolarHBondContact O-CB 3.43Å; H373-K376 PolarHBondContact O-N 3.23Å; H373-K376 VanDerWaalsContact O-N 3.13Å; H373-L377 WeakPolarHBondContact O-CG 3.41Å; H373-L377 PolarHBondContact O-N 3.38Å; H373-F407 HydrophobicContact CB-CD2 3.91Å; H373-F407 HydrophobicContact CB-CE1 4.41Å; H373-F407 HydrophobicContact CB-CE2 3.5Å; H373-F407 HydrophobicContact CB-CZ 3.78Å; H373-F407 AromaticContact CD2-CD1 3.82Å; H373-F407 AromaticContact CD2-CD2 3.54Å; H373-F407 AromaticContact CD2-CG 3.43Å; H373-F407 VanDerWaalsContact CD2-CG 3.43Å; H373-F407 WeakPolarHBondContact CD2-CG 3.5Å; H373-F407 AromaticContact CG-CD2 3.53Å; H373-F407 AromaticContact CG-CE2 3.7Å; H373-F407 AromaticContact CG-CG 3.93Å; H373-F407 AromaticContact ND1-CD2 3.91Å; H373-F407 AromaticContact NE2-CD2 3.94Å; H373-F407 AromaticContact NE2-CG 3.72Å
374	A	90.9	Very high	89.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.4	-41.2	177.3	0	0	0	0	0	112.4	I370 A371 K376 L377 R378 L436	I370-A374 VanDerWaalsContact O-CB 3.27Å; I370-A374 WeakPolarHBondContact O-CB 3.19Å; I370-A374 PolarHBondContact O-N 3Å; A371-A374 PolarHBondContact O-N 2.81Å; A374-K376 VanDerWaalsContact C-N 3.33Å; A374-K376 PolarHBondContact O-N 3.28Å; A374-L377 PolarHBondContact O-N 3.25Å; A374-R378 WeakPolarHBondContact O-CG 3.35Å; A374-R378 PolarHBondContact O-N 3.46Å; A374-L436 HydrophobicContact CB-CB 4.29Å; A374-L436 HydrophobicContact CB-CD2 3.99Å
375	L	90	Very high	88.9	Confident	70 Å²	70	60 Å²	60	37%	0.366	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-36.2	175.7	-70.7	173.8	0	0	0	112.3	A371 H373 K379	A371-L375 VanDerWaalsContact O-CG 3.29Å; A371-L375 WeakPolarHBondContact O-CG 3.46Å; A371-L375 PolarHBondContact O-N 3.1Å; H373-L375 VanDerWaalsContact C-N 3.32Å; H373-L375 PolarHBondContact O-N 2.96Å; L375-K379 WeakPolarHBondContact O-CG 3.42Å; L375-K379 PolarHBondContact O-N 2.74Å
376	K	90.9	Very high	88.2	Confident	126 Å²	126	64 Å²	64	55%	0.548	31%	0.311	S	S	.	.	H	α-helix	trans	-66.2	-50	174.4	-72.1	174.4	-175.8	179.5	0	111.4	S372 H373 A374 R378 K379 E380	S372-K376 WeakPolarHBondContact O-CG 3.47Å; S372-K376 PolarHBondContact O-N 3.38Å; S372-K376 VanDerWaalsContact O-N 3.14Å; H373-K376 WeakPolarHBondContact O-CB 3.43Å; H373-K376 PolarHBondContact O-N 3.23Å; H373-K376 VanDerWaalsContact O-N 3.13Å; A374-K376 VanDerWaalsContact C-N 3.33Å; A374-K376 PolarHBondContact O-N 3.28Å; K376-R378 VanDerWaalsContact C-N 3.28Å; K376-R378 PolarHBondContact O-N 3.14Å; K376-K379 WeakPolarHBondContact O-CB 3.43Å; K376-K379 PolarHBondContact O-N 2.81Å; K376-K379 VanDerWaalsContact O-N 3.08Å; K376-E380 WeakPolarHBondContact O-CG 3.43Å; K376-E380 PolarHBondContact O-N 3.49Å
377	L	89.4	Confident	87.4	Confident	37 Å²	37	70.1 Å²	70.1	19%	0.194	34%	0.338	C	S	.	.	H	α-helix	trans	-58.1	-40.2	179.5	-71.1	175.7	0	0	0	112.3	H373 A374 E380 A381 V401	H373-L377 WeakPolarHBondContact O-CG 3.41Å; H373-L377 PolarHBondContact O-N 3.38Å; A374-L377 PolarHBondContact O-N 3.25Å; L377-E380 PolarHBondContact O-N 3.21Å; L377-A381 WeakPolarHBondContact O-CB 3.5Å; L377-A381 PolarHBondContact O-N 3.42Å; L377-V401 HydrophobicContact CB-CG1 3.39Å; L377-V401 HydrophobicContact CD1-CG1 3.59Å; L377-V401 HydrophobicContact CG-CG1 4.14Å
378	R	87.3	Confident	86.2	Confident	52 Å²	52	75.4 Å²	75.4	20%	0.196	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-40.2	175.6	-74.5	178.8	-178.7	161.1	0.8	113	A374 K376 E380 A381 Q382 V401 P437	A374-R378 WeakPolarHBondContact O-CG 3.35Å; A374-R378 PolarHBondContact O-N 3.46Å; K376-R378 VanDerWaalsContact C-N 3.28Å; K376-R378 PolarHBondContact O-N 3.14Å; R378-E380 VanDerWaalsContact C-N 3.33Å; R378-A381 PolarHBondContact O-N 3.32Å; R378-Q382 WeakPolarHBondContact O-CB 3.44Å; R378-Q382 PolarHBondContact O-N 3.22Å; R378-V401 HydrophobicContact CG-CB 4.31Å; R378-V401 HydrophobicContact CG-CG2 3.69Å; R378-P437 PolarHBondContact NH1-O 3.4Å; R378-P437 PolarHBondContact NH2-O 2.84Å
379	K	87.5	Confident	84.7	Confident	139 Å²	139	74.6 Å²	74.6	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-64.7	-38.6	175.4	-74	177.1	-178.6	-174.6	0	111.7	L375 K376 K383	L375-K379 WeakPolarHBondContact O-CG 3.42Å; L375-K379 PolarHBondContact O-N 2.74Å; K376-K379 WeakPolarHBondContact O-CB 3.43Å; K376-K379 PolarHBondContact O-N 2.81Å; K376-K379 VanDerWaalsContact O-N 3.08Å; K379-K383 WeakPolarHBondContact O-CG 3.5Å; K379-K383 PolarHBondContact O-N 2.91Å; K379-K383 VanDerWaalsContact O-N 3.1Å
380	E	86.8	Confident	83.7	Confident	118 Å²	118	77.5 Å²	77.5	55%	0.551	38%	0.38	S	S	*	.	H	α-helix	trans	-67.2	-44.6	176.3	-72	168.8	-173.5	0	0	111.6	K376 L377 R378 Q382 K383 L384	K376-E380 WeakPolarHBondContact O-CG 3.43Å; K376-E380 PolarHBondContact O-N 3.49Å; L377-E380 PolarHBondContact O-N 3.21Å; R378-E380 VanDerWaalsContact C-N 3.33Å; E380-Q382 PolarHBondContact O-N 2.99Å; E380-K383 PolarHBondContact O-N 3.39Å; E380-L384 WeakPolarHBondContact O-CB 3.33Å; E380-L384 PolarHBondContact O-N 3.28Å
381	A	84.4	Confident	82.2	Confident	20 Å²	20	80 Å²	80	17%	0.165	41%	0.407	C	S	.	.	H	α-helix	trans	-58.6	-47	174.3	0	0	0	0	0	111.9	L377 R378 K383 L384 D385 S399	L377-A381 WeakPolarHBondContact O-CB 3.5Å; L377-A381 PolarHBondContact O-N 3.42Å; R378-A381 PolarHBondContact O-N 3.32Å; A381-K383 PolarHBondContact O-N 3.45Å; A381-L384 PolarHBondContact O-N 2.99Å; A381-L384 VanDerWaalsContact O-N 3.16Å; A381-D385 PolarHBondContact O-N 3.17Å; A381-S399 WeakPolarHBondContact CB-OG 3.37Å
382	Q	83.4	Confident	80.1	Confident	114 Å²	114	89 Å²	89	53%	0.533	45%	0.445	S	S	.	.	H	α-helix	trans	-59.8	-45.3	177.6	-175.1	-177	-14.3	0	0	112.1	R378 E380 L384 D385 E386	R378-Q382 WeakPolarHBondContact O-CB 3.44Å; R378-Q382 PolarHBondContact O-N 3.22Å; E380-Q382 PolarHBondContact O-N 2.99Å; Q382-L384 VanDerWaalsContact C-N 3.28Å; Q382-L384 PolarHBondContact O-N 2.77Å; Q382-D385 PolarHBondContact O-N 3.18Å; Q382-E386 WeakPolarHBondContact CG-OE1 3.11Å; Q382-E386 PolarHBondContact NE2-OE1 3.35Å; Q382-E386 WeakPolarHBondContact O-CB 3.47Å; Q382-E386 VanDerWaalsContact O-CG 3.32Å; Q382-E386 WeakPolarHBondContact O-CG 3.43Å; Q382-E386 PolarHBondContact O-N 2.97Å
383	K	83.8	Confident	77.8	Confident	134 Å²	134	93.9 Å²	93.9	58%	0.583	47%	0.466	S	S	*	.	H	α-helix	trans	-61.2	-38.1	176.6	-75.5	177.6	179.5	-173.8	0	112.4	K379 E380 A381 Q387	K379-K383 WeakPolarHBondContact O-CG 3.5Å; K379-K383 PolarHBondContact O-N 2.91Å; K379-K383 VanDerWaalsContact O-N 3.1Å; E380-K383 PolarHBondContact O-N 3.39Å; A381-K383 PolarHBondContact O-N 3.45Å; K383-Q387 VanDerWaalsContact O-CG 3.28Å; K383-Q387 WeakPolarHBondContact O-CG 3.39Å; K383-Q387 PolarHBondContact O-N 3.48Å
384	L	79.6	Confident	75.7	Confident	80 Å²	80	96.5 Å²	96.5	42%	0.419	49%	0.493	S	S	.	.	H	α-helix	trans	-71	-38.1	-179.6	-166.5	150.4	0	0	0	111	E380 A381 Q382 Q387 K388	E380-L384 WeakPolarHBondContact O-CB 3.33Å; E380-L384 PolarHBondContact O-N 3.28Å; A381-L384 PolarHBondContact O-N 2.99Å; A381-L384 VanDerWaalsContact O-N 3.16Å; Q382-L384 VanDerWaalsContact C-N 3.28Å; Q382-L384 PolarHBondContact O-N 2.77Å; L384-Q387 PolarHBondContact O-N 3.11Å; L384-K388 HydrophobicContact CD2-CD 3.73Å; L384-K388 HydrophobicContact CD2-CG 4.27Å; L384-K388 WeakPolarHBondContact O-CG 3.24Å; L384-K388 PolarHBondContact O-N 3.44Å
385	D	77.2	Confident	73.4	Confident	38 Å²	38	103.9 Å²	103.9	20%	0.203	53%	0.533	C	S	.	.	H	α-helix	trans	-68.5	-40.6	173.7	-70.8	-18.6	0	0	0	111.8	A381 Q382 Q387 K388 L389	A381-D385 PolarHBondContact O-N 3.17Å; Q382-D385 PolarHBondContact O-N 3.18Å; D385-Q387 VanDerWaalsContact C-N 3.3Å; D385-Q387 PolarHBondContact O-N 3.28Å; D385-K388 PolarHBondContact O-N 2.96Å; D385-L389 WeakPolarHBondContact O-CB 3.23Å; D385-L389 WeakPolarHBondContact O-CD1 3.34Å; D385-L389 WeakPolarHBondContact O-CG 3.31Å; D385-L389 PolarHBondContact O-N 2.89Å
386	E	77.5	Confident	71.3	Confident	105 Å²	105	103.7 Å²	103.7	49%	0.491	54%	0.541	S	S	.	.	H	α-helix	trans	-58.9	-41.7	172.4	-75	169.4	-170.2	0	0	111.3	Q382 L389 T390	Q382-E386 WeakPolarHBondContact CG-OE1 3.11Å; Q382-E386 PolarHBondContact NE2-OE1 3.35Å; Q382-E386 WeakPolarHBondContact O-CB 3.47Å; Q382-E386 VanDerWaalsContact O-CG 3.32Å; Q382-E386 WeakPolarHBondContact O-CG 3.43Å; Q382-E386 PolarHBondContact O-N 2.97Å; E386-L389 PolarHBondContact O-N 3Å; E386-T390 PolarHBondContact O-N 3.47Å
387	Q	75.1	Confident	69	Low	136 Å²	136	106.2 Å²	106.2	64%	0.636	56%	0.555	S	S	*	*	H	α-helix	trans	-65.7	-42.9	174.3	-73.7	173.4	6.1	0	0	112.2	K383 L384 D385 T390	K383-Q387 VanDerWaalsContact O-CG 3.28Å; K383-Q387 WeakPolarHBondContact O-CG 3.39Å; K383-Q387 PolarHBondContact O-N 3.48Å; L384-Q387 PolarHBondContact O-N 3.11Å; D385-Q387 VanDerWaalsContact C-N 3.3Å; D385-Q387 PolarHBondContact O-N 3.28Å; Q387-T390 PolarHBondContact O-N 3.1Å; Q387-T390 PolarHBondContact O-OG1 3.35Å
388	K	68.7	Low	67.1	Low	126 Å²	126	109.9 Å²	109.9	55%	0.548	58%	0.583	S	S	.	*	H	α-helix	trans	-66.5	-35.4	176.9	-76.9	175.6	176	165.2	0	112.6	L384 D385 T390 G391	L384-K388 HydrophobicContact CD2-CD 3.73Å; L384-K388 HydrophobicContact CD2-CG 4.27Å; L384-K388 WeakPolarHBondContact O-CG 3.24Å; L384-K388 PolarHBondContact O-N 3.44Å; D385-K388 PolarHBondContact O-N 2.96Å; K388-T390 PolarHBondContact O-N 2.73Å; K388-G391 CarbonylContact O-C 3.07Å; K388-G391 WeakPolarHBondContact O-CA 3.47Å; K388-G391 PolarHBondContact O-N 2.55Å
389	L	61.8	Low	65.6	Low	108 Å²	108	110.1 Å²	110.1	57%	0.565	59%	0.593	S	S	*	*	H	α-helix	trans	-63.9	-28.2	177.5	-84.2	155.3	0	0	0	112.2	D385 E386 G391	D385-L389 WeakPolarHBondContact O-CB 3.23Å; D385-L389 WeakPolarHBondContact O-CD1 3.34Å; D385-L389 WeakPolarHBondContact O-CG 3.31Å; D385-L389 PolarHBondContact O-N 2.89Å; E386-L389 PolarHBondContact O-N 3Å; L389-G391 PolarHBondContact O-N 2.98Å
390	T	72.8	Confident	64.6	Low	131 Å²	131	108.7 Å²	108.7	80%	0.804	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-16.8	169.2	69.5	0	0	0	0	113.3	E386 Q387 K388	E386-T390 PolarHBondContact O-N 3.47Å; Q387-T390 PolarHBondContact O-N 3.1Å; Q387-T390 PolarHBondContact O-OG1 3.35Å; K388-T390 PolarHBondContact O-N 2.73Å
391	G	60.5	Low	64.2	Low	55 Å²	55	104.4 Å²	104.4	57%	0.567	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	71.8	176.3	0	0	0	0	0	112.6	K388 L389	K388-G391 CarbonylContact O-C 3.07Å; K388-G391 WeakPolarHBondContact O-CA 3.47Å; K388-G391 PolarHBondContact O-N 2.55Å; L389-G391 PolarHBondContact O-N 2.98Å
392	K	48.3	Very low	64.1	Low	196 Å²	196	108 Å²	108	85%	0.852	59%	0.59	S	S	*	*	S	Bend	trans	29.8	95.6	163.9	-69.2	-176.9	177.6	179.3	0	116.3
393	L	45.9	Very low	64.2	Low	154 Å²	154	103 Å²	103	81%	0.806	57%	0.568	S	S	*	*			trans	-175.8	126.4	139.5	-96.9	151.7	0	0	0	108.3
394	A	47.5	Very low	64.3	Low	88 Å²	88	98.8 Å²	98.8	73%	0.727	55%	0.554	S	S	*	*			trans	-107.7	28.9	-166.2	0	0	0	0	0	114.3
395	D	43.4	Very low	64.6	Low	155 Å²	155	103.9 Å²	103.9	83%	0.829	57%	0.568	S	S	*	*			trans	-111.3	62.2	172.1	-75.5	-27.4	0	0	0	110.1	Q397	D395-Q397 VanDerWaalsContact C-N 3.27Å; D395-Q397 PolarHBondContact O-N 2.91Å; D395-Q397 VanDerWaalsContact O-N 3.09Å
396	A	44.8	Very low	65.1	Low	65 Å²	65	108.5 Å²	108.5	54%	0.537	59%	0.588	S	S	.	*			trans	-80.5	78	168.6	0	0	0	0	0	108.8	S398	A396-S398 PolarHBondContact O-N 2.95Å
397	Q	43.1	Very low	65.8	Low	180 Å²	180	104.6 Å²	104.6	84%	0.841	57%	0.57	S	S	*	*			trans	-58	126.4	154.5	-72.4	-174.7	-6.7	0	0	106.4	D395 S399	D395-Q397 VanDerWaalsContact C-N 3.27Å; D395-Q397 PolarHBondContact O-N 2.91Å; D395-Q397 VanDerWaalsContact O-N 3.09Å; Q397-S399 PolarHBondContact O-N 3.05Å
398	S	50	Low	66.5	Low	113 Å²	113	100.9 Å²	100.9	79%	0.79	55%	0.552	S	S	*	*			trans	-43.6	110.6	179.1	52.2	0	0	0	0	109.2	A396 E400	A396-S398 PolarHBondContact O-N 2.95Å; S398-E400 PolarHBondContact O-N 3.15Å
399	S	55.2	Low	67.5	Low	58 Å²	58	99.2 Å²	99.2	41%	0.406	55%	0.546	S	S	.	.			trans	-57	111.3	179.8	57	0	0	0	0	107.5	A381 Q397 V401	A381-S399 WeakPolarHBondContact CB-OG 3.37Å; Q397-S399 PolarHBondContact O-N 3.05Å; S399-V401 PolarHBondContact O-N 2.9Å
400	E	66.6	Low	68.9	Low	108 Å²	108	100.9 Å²	100.9	51%	0.505	55%	0.551	S	S	.	*			trans	-61.9	108.7	-177.6	-171.8	175.8	-176.9	0	0	108.5	E219 G220 S398 T402	E219-E400 VanDerWaalsContact C-OE1 3.24Å; E219-E400 VanDerWaalsContact CB-OE1 3.24Å; E219-E400 WeakPolarHBondContact CB-OE1 3.42Å; G220-E400 WeakPolarHBondContact CA-OE1 3.45Å; G220-E400 PolarHBondContact N-OE1 3.07Å; S398-E400 PolarHBondContact O-N 3.15Å; E400-T402 PolarHBondContact O-N 3.27Å
401	V	78.8	Confident	69.8	Low	28 Å²	28	96.8 Å²	96.8	17%	0.17	53%	0.526	C	S	.	.			trans	-73.7	113.4	-177	172.9	0	0	0	0	108.4	L377 R378 S399 L436	L377-V401 HydrophobicContact CB-CG1 3.39Å; L377-V401 HydrophobicContact CD1-CG1 3.59Å; L377-V401 HydrophobicContact CG-CG1 4.14Å; R378-V401 HydrophobicContact CG-CB 4.31Å; R378-V401 HydrophobicContact CG-CG2 3.69Å; S399-V401 PolarHBondContact O-N 2.9Å; V401-L436 WeakPolarHBondContact O-CD1 3.19Å
402	T	81.3	Confident	71.3	Confident	96 Å²	96	94.2 Å²	94.2	59%	0.589	50%	0.499	S	S	*	.			trans	-108.3	141.6	175	-57.7	0	0	0	0	110	E400 S404	E400-T402 PolarHBondContact O-N 3.27Å; T402-S404 PolarHBondContact O-N 3.19Å
403	I	85.6	Confident	73.2	Confident	10 Å²	10	87.2 Å²	87.2	5%	0.051	47%	0.47	C	S	.	.			trans	-66.3	127.5	176.7	-63	-173.1	0	0	0	110.1	I370 F407 K408 Y434 L436	I370-I403 HydrophobicContact CG1-CD1 4.47Å; I370-I403 HydrophobicContact CG2-CD1 3.91Å; I403-F407 HydrophobicContact CG2-CB 4.05Å; I403-F407 HydrophobicContact CG2-CD1 3.37Å; I403-F407 HydrophobicContact CG2-CE1 4.2Å; I403-F407 HydrophobicContact CG2-CG 4.07Å; I403-K408 HydrophobicContact CG2-CG 3.86Å; I403-Y434 HydrophobicContact CD1-CD1 3.54Å; I403-Y434 HydrophobicContact CD1-CD2 4.34Å; I403-Y434 HydrophobicContact CD1-CE1 4.32Å; I403-Y434 HydrophobicContact CD1-CG 3.54Å; I403-L436 HydrophobicContact CD1-CD2 3.76Å; I403-L436 HydrophobicContact CG1-CD2 3.84Å
404	S	86.2	Confident	75.4	Confident	44 Å²	44	83 Å²	83	31%	0.308	45%	0.453	S	S	.	.			trans	-63.3	147.4	179.5	70.5	0	0	0	0	112.5	T402 Q406 F407 K408	T402-S404 PolarHBondContact O-N 3.19Å; S404-Q406 VanDerWaalsContact C-N 3.25Å; S404-Q406 PolarHBondContact O-N 2.93Å; S404-F407 PolarHBondContact O-N 2.86Å; S404-F407 VanDerWaalsContact O-N 3.17Å; S404-F407 WeakPolarHBondContact OG-CB 3.13Å; S404-F407 PolarHBondContact OG-N 2.88Å; S404-K408 PolarHBondContact O-N 3.13Å
405	R	87.4	Confident	77.4	Confident	188 Å²	188	80.7 Å²	80.7	71%	0.709	43%	0.427	S	S	*	.	H	α-helix	trans	-56	-41.1	175.3	-177.8	177.9	172.9	176.6	-0.1	112.2	F407 K408 E409	R405-F407 VanDerWaalsContact C-N 3.34Å; R405-F407 PolarHBondContact O-N 3.3Å; R405-K408 WeakPolarHBondContact O-CB 3.45Å; R405-K408 PolarHBondContact O-N 3.02Å; R405-E409 IonicContact CZ-OE1 2.73Å; R405-E409 IonicContact NE-OE1 2.67Å; R405-E409 PolarHBondContact NE-OE1 2.8Å; R405-E409 IonicContact NH2-OE1 3.11Å; R405-E409 PolarHBondContact NH2-OE1 2.88Å; R405-E409 VanDerWaalsContact NH2-OE1 3.16Å; R405-E409 PolarHBondContact O-N 3.08Å
406	Q	87.5	Confident	79.7	Confident	134 Å²	134	73.3 Å²	73.3	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-59.6	-43	178.2	-69.9	177.3	-15.5	0	0	112	S404 E409 Q410	S404-Q406 VanDerWaalsContact C-N 3.25Å; S404-Q406 PolarHBondContact O-N 2.93Å; Q406-E409 PolarHBondContact O-N 2.96Å; Q406-Q410 VanDerWaalsContact O-CB 3.3Å; Q406-Q410 WeakPolarHBondContact O-CB 3.32Å; Q406-Q410 WeakPolarHBondContact O-CG 3.41Å; Q406-Q410 PolarHBondContact O-N 2.82Å
407	F	91.1	Very high	81.7	Confident	23 Å²	23	74.5 Å²	74.5	10%	0.101	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-41.5	177.2	-179	-90.7	0	0	0	112.2	E369 I370 H373 I403 S404 R405 E409 V411 V412	E369-F407 HydrophobicContact CB-CE2 4.5Å; E369-F407 HydrophobicContact CB-CZ 3.96Å; E369-F407 WeakPolarHBondContact O-CZ 3.47Å; I370-F407 HydrophobicContact CG1-CE1 4.06Å; I370-F407 HydrophobicContact CG1-CZ 4.5Å; H373-F407 HydrophobicContact CB-CD2 3.91Å; H373-F407 HydrophobicContact CB-CE1 4.41Å; H373-F407 HydrophobicContact CB-CE2 3.5Å; H373-F407 HydrophobicContact CB-CZ 3.78Å; H373-F407 AromaticContact CD2-CD1 3.82Å; H373-F407 AromaticContact CD2-CD2 3.54Å; H373-F407 AromaticContact CD2-CG 3.43Å; H373-F407 VanDerWaalsContact CD2-CG 3.43Å; H373-F407 WeakPolarHBondContact CD2-CG 3.5Å; H373-F407 AromaticContact CG-CD2 3.53Å; H373-F407 AromaticContact CG-CE2 3.7Å; H373-F407 AromaticContact CG-CG 3.93Å; H373-F407 AromaticContact ND1-CD2 3.91Å; H373-F407 AromaticContact NE2-CD2 3.94Å; H373-F407 AromaticContact NE2-CG 3.72Å; I403-F407 HydrophobicContact CG2-CB 4.05Å; I403-F407 HydrophobicContact CG2-CD1 3.37Å; I403-F407 HydrophobicContact CG2-CE1 4.2Å; I403-F407 HydrophobicContact CG2-CG 4.07Å; S404-F407 PolarHBondContact O-N 2.86Å; S404-F407 VanDerWaalsContact O-N 3.17Å; S404-F407 WeakPolarHBondContact OG-CB 3.13Å; S404-F407 PolarHBondContact OG-N 2.88Å; R405-F407 VanDerWaalsContact C-N 3.34Å; R405-F407 PolarHBondContact O-N 3.3Å; F407-E409 VanDerWaalsContact C-N 3.33Å; F407-E409 PolarHBondContact O-N 3.12Å; F407-V411 HydrophobicContact CD2-CB 4.12Å; F407-V411 HydrophobicContact CD2-CG2 3.84Å; F407-V411 HydrophobicContact CE2-CB 3.91Å; F407-V411 HydrophobicContact CE2-CG1 3.93Å; F407-V411 HydrophobicContact CE2-CG2 3.9Å; F407-V411 HydrophobicContact CZ-CB 4.17Å; F407-V411 HydrophobicContact CZ-CG1 4Å; F407-V411 WeakPolarHBondContact O-CB 3.49Å; F407-V411 PolarHBondContact O-N 2.81Å; F407-V412 HydrophobicContact CD1-CG2 3.88Å; F407-V412 HydrophobicContact CE1-CG2 3.48Å; F407-V412 VanDerWaalsContact CE1-CG2 3.48Å; F407-V412 HydrophobicContact CZ-CG2 4.34Å; F407-V412 PolarHBondContact O-N 3.25Å
408	K	90.8	Very high	83.8	Confident	58 Å²	58	75.9 Å²	75.9	25%	0.252	38%	0.379	S	S	.	.	I	π-helix	trans	-57.8	-47.9	175.8	-60.9	-174.2	-176.6	-172.3	0	110.7	I403 S404 R405 V412 L413 Y434	I403-K408 HydrophobicContact CG2-CG 3.86Å; S404-K408 PolarHBondContact O-N 3.13Å; R405-K408 WeakPolarHBondContact O-CB 3.45Å; R405-K408 PolarHBondContact O-N 3.02Å; K408-V412 PolarHBondContact O-N 3.34Å; K408-L413 WeakPolarHBondContact O-CG 3.41Å; K408-L413 PolarHBondContact O-N 2.85Å; K408-Y434 HydrophobicContact CD-CE2 3.66Å; K408-Y434 HydrophobicContact CG-CE2 3.99Å; K408-Y434 WeakPolarHBondContact CG-OH 3.18Å
409	E	89.2	Confident	85.5	Confident	91 Å²	91	74.4 Å²	74.4	43%	0.425	36%	0.362	S	S	.	.	I	π-helix	trans	-73.7	-40.2	-175.8	-70.7	175.2	-179.2	0	0	113.8	R405 Q406 F407 L413 P414	R405-E409 IonicContact CZ-OE1 2.73Å; R405-E409 IonicContact NE-OE1 2.67Å; R405-E409 PolarHBondContact NE-OE1 2.8Å; R405-E409 IonicContact NH2-OE1 3.11Å; R405-E409 PolarHBondContact NH2-OE1 2.88Å; R405-E409 VanDerWaalsContact NH2-OE1 3.16Å; R405-E409 PolarHBondContact O-N 3.08Å; Q406-E409 PolarHBondContact O-N 2.96Å; F407-E409 VanDerWaalsContact C-N 3.33Å; F407-E409 PolarHBondContact O-N 3.12Å; E409-L413 HydrophobicContact CG-CD1 4.38Å; E409-P414 WeakPolarHBondContact O-CD 3.3Å
410	Q	90.6	Very high	86.8	Confident	144 Å²	144	71.8 Å²	71.8	67%	0.673	34%	0.343	S	S	*	.	I	π-helix	trans	-91.8	-22.7	-171.7	-65.5	-178.8	-8.2	0	0	114.2	Q406	Q406-Q410 VanDerWaalsContact O-CB 3.3Å; Q406-Q410 WeakPolarHBondContact O-CB 3.32Å; Q406-Q410 WeakPolarHBondContact O-CG 3.41Å; Q406-Q410 PolarHBondContact O-N 2.82Å
411	V	91.8	Very high	87.2	Confident	45 Å²	45	76.3 Å²	76.3	27%	0.273	36%	0.356	S	S	.	.	I	π-helix	trans	-117.2	-56.7	-174.5	-175	0	0	0	0	110.8	E369 F407 P414 I415	E369-V411 HydrophobicContact CB-CG1 3.83Å; E369-V411 HydrophobicContact CG-CG1 3.87Å; F407-V411 HydrophobicContact CD2-CB 4.12Å; F407-V411 HydrophobicContact CD2-CG2 3.84Å; F407-V411 HydrophobicContact CE2-CB 3.91Å; F407-V411 HydrophobicContact CE2-CG1 3.93Å; F407-V411 HydrophobicContact CE2-CG2 3.9Å; F407-V411 HydrophobicContact CZ-CB 4.17Å; F407-V411 HydrophobicContact CZ-CG1 4Å; F407-V411 WeakPolarHBondContact O-CB 3.49Å; F407-V411 PolarHBondContact O-N 2.81Å; V411-P414 WeakPolarHBondContact O-CD 3.38Å; V411-I415 HydrophobicContact CG1-CD1 4.16Å; V411-I415 WeakPolarHBondContact O-CD1 3.5Å; V411-I415 VanDerWaalsContact O-CG1 3.28Å; V411-I415 WeakPolarHBondContact O-CG1 3.37Å; V411-I415 PolarHBondContact O-N 3.25Å
412	V	91.4	Very high	86.9	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	36%	0.361	C	S	.	.	I	π-helix	trans	-72.4	-50.1	-171.9	-178.5	0	0	0	0	111.8	M248 I370 F407 K408 I415 L416 Y434	M248-V412 HydrophobicContact CE-CG1 4.1Å; I370-V412 HydrophobicContact CG1-CG2 4.33Å; F407-V412 HydrophobicContact CD1-CG2 3.88Å; F407-V412 HydrophobicContact CE1-CG2 3.48Å; F407-V412 VanDerWaalsContact CE1-CG2 3.48Å; F407-V412 HydrophobicContact CZ-CG2 4.34Å; F407-V412 PolarHBondContact O-N 3.25Å; K408-V412 PolarHBondContact O-N 3.34Å; V412-I415 PolarHBondContact O-N 2.89Å; V412-I415 VanDerWaalsContact O-N 3.17Å; V412-L416 HydrophobicContact CG1-CD1 3.88Å; V412-L416 HydrophobicContact CG1-CG 4.18Å; V412-L416 WeakPolarHBondContact O-CG 3.44Å; V412-L416 PolarHBondContact O-N 3.4Å; V412-Y434 HydrophobicContact CB-CE1 4.42Å; V412-Y434 HydrophobicContact CG1-CE1 3.97Å; V412-Y434 HydrophobicContact CG2-CE1 3.99Å
413	L	89.2	Confident	86.5	Confident	49 Å²	49	78.3 Å²	78.3	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-57.8	-45.8	-178.3	-75.4	-176.6	0	0	0	112.6	K408 E409 I415 L416 K417 I426 I432	K408-L413 WeakPolarHBondContact O-CG 3.41Å; K408-L413 PolarHBondContact O-N 2.85Å; E409-L413 HydrophobicContact CG-CD1 4.38Å; L413-I415 VanDerWaalsContact C-N 3.33Å; L413-I415 PolarHBondContact O-N 3.47Å; L413-L416 PolarHBondContact O-N 2.8Å; L413-K417 WeakPolarHBondContact O-CB 3.36Å; L413-K417 VanDerWaalsContact O-CG 3.31Å; L413-K417 WeakPolarHBondContact O-CG 3.38Å; L413-K417 PolarHBondContact O-N 3.33Å; L413-I426 HydrophobicContact CD2-CG2 4.04Å; L413-I432 HydrophobicContact CD2-CD1 4.42Å
414	P	91	Very high	86.4	Confident	67 Å²	67	84.9 Å²	84.9	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-58.8	-39.9	175.4	-29	37.5	0	0	0	114	E409 V411 R418	E409-P414 WeakPolarHBondContact O-CD 3.3Å; V411-P414 WeakPolarHBondContact O-CD 3.38Å; P414-R418 WeakPolarHBondContact O-CB 3.43Å; P414-R418 PolarHBondContact O-N 3.23Å
415	I	91.5	Very high	86.2	Confident	38 Å²	38	82.8 Å²	82.8	20%	0.195	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-43.5	177.6	-66.4	168.3	0	0	0	110.6	L365 A366 E369 V411 V412 L413 R418 N419	L365-I415 HydrophobicContact CB-CG2 4.33Å; A366-I415 HydrophobicContact CB-CB 4.46Å; A366-I415 HydrophobicContact CB-CD1 3.77Å; A366-I415 HydrophobicContact CB-CG2 4.2Å; E369-I415 HydrophobicContact CG-CD1 4.17Å; V411-I415 HydrophobicContact CG1-CD1 4.16Å; V411-I415 WeakPolarHBondContact O-CD1 3.5Å; V411-I415 VanDerWaalsContact O-CG1 3.28Å; V411-I415 WeakPolarHBondContact O-CG1 3.37Å; V411-I415 PolarHBondContact O-N 3.25Å; V412-I415 PolarHBondContact O-N 2.89Å; V412-I415 VanDerWaalsContact O-N 3.17Å; L413-I415 VanDerWaalsContact C-N 3.33Å; L413-I415 PolarHBondContact O-N 3.47Å; I415-R418 PolarHBondContact O-N 2.94Å; I415-N419 PolarHBondContact O-N 3.41Å; I415-N419 PolarHBondContact O-ND2 3.25Å
416	L	90.5	Very high	86.1	Confident	1 Å²	1	75 Å²	75	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-48	177.1	-71.6	177.9	0	0	0	111.6	L246 M248 L365 V412 L413 R418 N419 L420 I426 I432	L246-L416 HydrophobicContact CD2-CD1 3.9Å; L246-L416 HydrophobicContact CD2-CD2 4.02Å; M248-L416 HydrophobicContact CE-CD1 4.49Å; M248-L416 HydrophobicContact CE-CD2 3.72Å; M248-L416 HydrophobicContact CE-CG 4.26Å; M248-L416 HydrophobicContact SD-CD2 3.92Å; L365-L416 HydrophobicContact CB-CD2 4.4Å; L365-L416 HydrophobicContact CD1-CD2 3.99Å; V412-L416 HydrophobicContact CG1-CD1 3.88Å; V412-L416 HydrophobicContact CG1-CG 4.18Å; V412-L416 WeakPolarHBondContact O-CG 3.44Å; V412-L416 PolarHBondContact O-N 3.4Å; L413-L416 PolarHBondContact O-N 2.8Å; L416-R418 VanDerWaalsContact C-N 3.3Å; L416-R418 PolarHBondContact O-N 3.43Å; L416-N419 PolarHBondContact O-N 2.94Å; L416-L420 HydrophobicContact CD2-CD1 4.29Å; L416-L420 WeakPolarHBondContact O-CB 2.9Å; L416-L420 PolarHBondContact O-N 3.46Å; L416-I426 HydrophobicContact CB-CD1 4.09Å; L416-I432 HydrophobicContact CD1-CD1 4.02Å
417	K	87.8	Confident	86.1	Confident	89 Å²	89	71.8 Å²	71.8	39%	0.387	35%	0.346	S	S	.	.	H	α-helix	trans	-57.3	-43.5	178.3	-73.6	-173.3	173.9	-148.1	0	112.2	L413 N419 R421 D423 I426	L413-K417 WeakPolarHBondContact O-CB 3.36Å; L413-K417 VanDerWaalsContact O-CG 3.31Å; L413-K417 WeakPolarHBondContact O-CG 3.38Å; L413-K417 PolarHBondContact O-N 3.33Å; K417-N419 PolarHBondContact O-N 2.97Å; K417-R421 WeakPolarHBondContact O-CA 3.42Å; K417-R421 PolarHBondContact O-N 3.43Å; K417-D423 VanDerWaalsContact CD-OD1 3.26Å; K417-D423 WeakPolarHBondContact CD-OD1 3.19Å; K417-D423 WeakPolarHBondContact CE-OD1 3.28Å; K417-D423 VanDerWaalsContact CG-OD1 3.28Å; K417-D423 WeakPolarHBondContact CG-OD1 3.37Å; K417-D423 IonicContact NZ-OD1 3.98Å; K417-D423 IonicContact NZ-OD2 2.75Å; K417-D423 PolarHBondContact NZ-OD2 3.1Å; K417-I426 HydrophobicContact CB-CD1 4.44Å; K417-I426 HydrophobicContact CG-CD1 3.52Å
418	R	87.3	Confident	86	Confident	210 Å²	210	74.9 Å²	74.9	79%	0.792	36%	0.358	S	S	*	.	H	α-helix	trans	-63.5	-39.5	180	-173.2	176.2	-177.6	164.2	1.3	112.8	P414 I415 L416	P414-R418 WeakPolarHBondContact O-CB 3.43Å; P414-R418 PolarHBondContact O-N 3.23Å; I415-R418 PolarHBondContact O-N 2.94Å; L416-R418 VanDerWaalsContact C-N 3.3Å; L416-R418 PolarHBondContact O-N 3.43Å
419	N	85.1	Confident	86	Confident	81 Å²	81	73 Å²	73	43%	0.433	35%	0.35	S	S	.	.	H	α-helix	trans	-88.1	-42.6	-174.8	-72.6	-67.7	0	0	0	113.1	L365 I415 L416 K417 R421	L365-N419 HydrophobicContact CD1-CB 3.7Å; L365-N419 HydrophobicContact CD2-CB 4.16Å; I415-N419 PolarHBondContact O-N 3.41Å; I415-N419 PolarHBondContact O-ND2 3.25Å; L416-N419 PolarHBondContact O-N 2.94Å; K417-N419 PolarHBondContact O-N 2.97Å; N419-R421 VanDerWaalsContact C-N 3.28Å; N419-R421 PolarHBondContact O-N 3.11Å
420	L	82.8	Confident	86.1	Confident	4 Å²	4	71.2 Å²	71.2	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-79.4	-12.8	179.8	-60.1	176.2	0	0	0	112.7	I324 L332 L416 R422 F425	I324-L420 HydrophobicContact CG2-CD2 4.44Å; L332-L420 HydrophobicContact CD1-CD2 4.48Å; L416-L420 HydrophobicContact CD2-CD1 4.29Å; L416-L420 WeakPolarHBondContact O-CB 2.9Å; L416-L420 PolarHBondContact O-N 3.46Å; L420-R422 PolarHBondContact O-N 2.94Å; L420-F425 HydrophobicContact CD1-CD1 3.91Å; L420-F425 HydrophobicContact CD1-CE1 4.1Å
421	R	75.5	Confident	86.2	Confident	203 Å²	203	67.5 Å²	67.5	77%	0.766	33%	0.328	S	S	*	.			trans	56.7	9.5	173	-59.3	-176.8	-177.1	-176.5	3	116.1	K417 N419	K417-R421 WeakPolarHBondContact O-CA 3.42Å; K417-R421 PolarHBondContact O-N 3.43Å; N419-R421 VanDerWaalsContact C-N 3.28Å; N419-R421 PolarHBondContact O-N 3.11Å
422	R	71.9	Confident	86.3	Confident	74 Å²	74	66.6 Å²	66.6	28%	0.279	32%	0.322	S	S	.	.			trans	-144.8	112.4	-176.7	-63.1	-174	-176.7	162.6	1.2	111.2	P329 T333 L420 E424 F425	P329-R422 PolarHBondContact O-NH1 2.93Å; P329-R422 PolarHBondContact O-NH2 3.45Å; T333-R422 VanDerWaalsContact N-NH1 3.11Å; T333-R422 PolarHBondContact OG1-NH1 3.12Å; T333-R422 PolarHBondContact OG1-NH2 3.46Å; L420-R422 PolarHBondContact O-N 2.94Å; R422-E424 VanDerWaalsContact C-N 3.29Å; R422-E424 PolarHBondContact O-N 3.07Å; R422-F425 HydrophobicContact CB-CB 4.29Å; R422-F425 WeakPolarHBondContact O-CB 3.35Å; R422-F425 PolarHBondContact O-N 3.09Å
423	D	73.1	Confident	86.5	Confident	92 Å²	92	66.7 Å²	66.7	49%	0.492	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-33	179.7	-83.7	11.2	0	0	0	112.3	K417 F425 I426 G427	K417-D423 VanDerWaalsContact CD-OD1 3.26Å; K417-D423 WeakPolarHBondContact CD-OD1 3.19Å; K417-D423 WeakPolarHBondContact CE-OD1 3.28Å; K417-D423 VanDerWaalsContact CG-OD1 3.28Å; K417-D423 WeakPolarHBondContact CG-OD1 3.37Å; K417-D423 IonicContact NZ-OD1 3.98Å; K417-D423 IonicContact NZ-OD2 2.75Å; K417-D423 PolarHBondContact NZ-OD2 3.1Å; D423-F425 PolarHBondContact O-N 3.28Å; D423-I426 PolarHBondContact O-N 2.91Å; D423-G427 PolarHBondContact O-N 2.95Å
424	E	82.6	Confident	86.8	Confident	148 Å²	148	65.6 Å²	65.6	69%	0.692	32%	0.315	S	S	*	.	H	α-helix	trans	-58.7	-36.2	177.1	-66.7	176.4	-178.5	0	0	112.2	L336 R422 I426 G427 R428	L336-E424 HydrophobicContact CD2-CB 4.39Å; R422-E424 VanDerWaalsContact C-N 3.29Å; R422-E424 PolarHBondContact O-N 3.07Å; E424-I426 VanDerWaalsContact C-N 3.31Å; E424-I426 PolarHBondContact O-N 3.3Å; E424-G427 PolarHBondContact O-N 2.76Å; E424-G427 VanDerWaalsContact O-N 3.14Å; E424-R428 WeakPolarHBondContact O-CG 3.48Å; E424-R428 PolarHBondContact O-N 3.17Å
425	F	83	Confident	87.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-40.5	-179.6	-171.4	-95.8	0	0	0	112	L332 M335 L336 F339 M361 L420 R422 D423 G427 R428	L332-F425 HydrophobicContact CD2-CE2 4.13Å; L332-F425 HydrophobicContact CD2-CZ 4.02Å; M335-F425 HydrophobicContact CB-CE2 3.98Å; M335-F425 HydrophobicContact CE-CE2 4.46Å; M335-F425 HydrophobicContact CE-CZ 4.17Å; L336-F425 VanDerWaalsContact CD2-CA 3.42Å; L336-F425 HydrophobicContact CD2-CB 3.8Å; L336-F425 HydrophobicContact CD2-CD2 3.73Å; L336-F425 HydrophobicContact CD2-CG 4.24Å; L336-F425 HydrophobicContact CG-CD2 3.92Å; F339-F425 HydrophobicContact CD2-CE2 4.28Å; F339-F425 AromaticContact CE2-CE2 3.88Å; F339-F425 HydrophobicContact CE2-CE2 3.88Å; F339-F425 HydrophobicContact CE2-CZ 4Å; M361-F425 HydrophobicContact CE-CE1 4.03Å; M361-F425 HydrophobicContact CE-CZ 4.08Å; M361-F425 HydrophobicContact SD-CE1 3.76Å; M361-F425 HydrophobicContact SD-CZ 3.41Å; M361-F425 WeakPolarHBondContact SD-CZ 3.41Å; L420-F425 HydrophobicContact CD1-CD1 3.91Å; L420-F425 HydrophobicContact CD1-CE1 4.1Å; R422-F425 HydrophobicContact CB-CB 4.29Å; R422-F425 WeakPolarHBondContact O-CB 3.35Å; R422-F425 PolarHBondContact O-N 3.09Å; D423-F425 PolarHBondContact O-N 3.28Å; F425-G427 VanDerWaalsContact C-N 3.29Å; F425-G427 PolarHBondContact O-N 2.89Å; F425-R428 PolarHBondContact O-N 3.34Å
426	I	85.3	Confident	87.2	Confident	25 Å²	25	61.6 Å²	61.6	13%	0.128	29%	0.29	C	S	.	.	H	α-helix	trans	-66.3	-36.9	178	-60.6	171.7	0	0	0	110.3	L413 L416 K417 D423 E424 R428 I429	L413-I426 HydrophobicContact CD2-CG2 4.04Å; L416-I426 HydrophobicContact CB-CD1 4.09Å; K417-I426 HydrophobicContact CB-CD1 4.44Å; K417-I426 HydrophobicContact CG-CD1 3.52Å; D423-I426 PolarHBondContact O-N 2.91Å; E424-I426 VanDerWaalsContact C-N 3.31Å; E424-I426 PolarHBondContact O-N 3.3Å; I426-R428 PolarHBondContact O-N 3.22Å; I426-I429 PolarHBondContact O-N 3.43Å
427	G	86.8	Confident	87.3	Confident	65 Å²	65	61.6 Å²	61.6	67%	0.67	29%	0.29	S	S	*	.	H	α-helix	trans	-65.6	-17.6	178.3	0	0	0	0	0	114.8	D423 E424 F425	D423-G427 PolarHBondContact O-N 2.95Å; E424-G427 PolarHBondContact O-N 2.76Å; E424-G427 VanDerWaalsContact O-N 3.14Å; F425-G427 VanDerWaalsContact C-N 3.29Å; F425-G427 PolarHBondContact O-N 2.89Å
428	R	88.4	Confident	87.6	Confident	88 Å²	88	58 Å²	58	33%	0.332	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-9.1	177.1	-56.5	-50.3	-179.5	142.9	7	114.1	L336 F339 D340 E424 F425 I426 T430	L336-R428 HydrophobicContact CD2-CG 4.41Å; F339-R428 HydrophobicContact CB-CB 3.98Å; D340-R428 IonicContact OD1-CZ 3.98Å; D340-R428 IonicContact OD1-NH1 2.64Å; D340-R428 PolarHBondContact OD1-NH1 3.29Å; D340-R428 IonicContact OD1-NH2 3.9Å; D340-R428 PolarHBondContact OD1-NH2 3.36Å; D340-R428 VanDerWaalsContact OD1-NH2 3.09Å; D340-R428 IonicContact OD2-CZ 3.48Å; D340-R428 IonicContact OD2-NH1 3.45Å; D340-R428 IonicContact OD2-NH2 2.78Å; D340-R428 PolarHBondContact OD2-NH2 3.31Å; E424-R428 WeakPolarHBondContact O-CG 3.48Å; E424-R428 PolarHBondContact O-N 3.17Å; F425-R428 PolarHBondContact O-N 3.34Å; I426-R428 PolarHBondContact O-N 3.22Å; R428-T430 PolarHBondContact O-N 2.95Å
429	I	91.8	Very high	87.8	Confident	20 Å²	20	50 Å²	50	10%	0.103	25%	0.249	C	C	.	.			trans	-77	119.6	178.8	-59.2	169.8	0	0	0	108.2	V244 L246 M361 I426 E431 I432	V244-I429 HydrophobicContact CG1-CG1 4.36Å; L246-I429 HydrophobicContact CB-CD1 4Å; L246-I429 HydrophobicContact CB-CG2 3.95Å; L246-I429 HydrophobicContact CD2-CD1 3.85Å; M361-I429 HydrophobicContact CE-CD1 4.17Å; M361-I429 HydrophobicContact CE-CG1 3.94Å; I426-I429 PolarHBondContact O-N 3.43Å; I429-E431 WeakPolarHBondContact CG2-O 3.36Å; I429-I432 HydrophobicContact CG2-CG1 4.02Å
430	T	90.5	Very high	88.1	Confident	52 Å²	52	50.9 Å²	50.9	32%	0.319	25%	0.246	S	C	.	.	S	Bend	trans	-61.6	-44.6	176.8	-47.5	0	0	0	0	111.4	L243 V244 R428	L243-T430 HydrophobicContact CD2-CG2 4.01Å; V244-T430 PolarHBondContact N-OG1 3.26Å; V244-T430 WeakPolarHBondContact O-CA 3.31Å; V244-T430 VanDerWaalsContact O-CB 3.26Å; V244-T430 WeakPolarHBondContact O-CB 3.32Å; V244-T430 PolarHBondContact O-N 2.71Å; V244-T430 PolarHBondContact O-OG1 3.28Å; R428-T430 PolarHBondContact O-N 2.95Å
431	E	92.8	Very high	88.6	Confident	67 Å²	67	54.1 Å²	54.1	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	134.7	-178.6	-172.6	67.3	-137.6	0	0	111.7	S224 V244 F245 L246 I429 V433	S224-E431 WeakPolarHBondContact OG-CG 3.46Å; V244-E431 PolarHBondContact O-N 3.29Å; F245-E431 WeakPolarHBondContact CA-O 3.27Å; F245-E431 HydrophobicContact CD1-CB 4.06Å; F245-E431 HydrophobicContact CE1-CB 4.22Å; L246-E431 PolarHBondContact N-O 3.42Å; L246-E431 VanDerWaalsContact N-O 3.1Å; I429-E431 WeakPolarHBondContact CG2-O 3.36Å; E431-V433 HydrophobicContact CG-CG2 4.2Å
432	I	94.7	Very high	89.4	Confident	26 Å²	26	45.8 Å²	45.8	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	114.1	170.7	-56.4	177.5	0	0	0	108.1	L246 M248 L413 L416 I429 Y434	L246-I432 HydrophobicContact CB-CG1 4.37Å; L246-I432 HydrophobicContact CD2-CG1 4.46Å; L246-I432 HydrophobicContact CD2-CG2 4.49Å; L246-I432 CarbonylContact O-C 2.98Å; L246-I432 WeakPolarHBondContact O-CA 3.4Å; M248-I432 HydrophobicContact CG-CG2 3.65Å; L413-I432 HydrophobicContact CD2-CD1 4.42Å; L416-I432 HydrophobicContact CD1-CD1 4.02Å; I429-I432 HydrophobicContact CG2-CG1 4.02Å; I432-Y434 HydrophobicContact CB-CE2 4.14Å; I432-Y434 HydrophobicContact CG2-CD2 4.47Å; I432-Y434 HydrophobicContact CG2-CE1 4.03Å; I432-Y434 HydrophobicContact CG2-CE2 3.8Å; I432-Y434 WeakPolarHBondContact O-CD2 3.41Å; I432-Y434 VanDerWaalsContact O-CE2 3.28Å; I432-Y434 WeakPolarHBondContact O-CE2 3.32Å
433	V	95.9	Very high	90.5	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126	-175.6	-173.2	0	0	0	0	109.5	A221 V225 F245 L246 F247 M248 E431 F435	A221-V433 VanDerWaalsContact CA-CG1 3.49Å; A221-V433 HydrophobicContact CB-CG1 3.47Å; A221-V433 VanDerWaalsContact CB-CG1 3.47Å; V225-V433 HydrophobicContact CG2-CG1 4.35Å; V225-V433 HydrophobicContact CG2-CG2 3.98Å; F245-V433 HydrophobicContact CD1-CG2 3.99Å; L246-V433 PolarHBondContact O-N 2.75Å; F247-V433 WeakPolarHBondContact CA-O 3.33Å; F247-V433 HydrophobicContact CD1-CB 3.62Å; F247-V433 HydrophobicContact CD1-CG1 4.29Å; F247-V433 HydrophobicContact CD1-CG2 3.87Å; F247-V433 HydrophobicContact CE1-CB 3.88Å; F247-V433 HydrophobicContact CE1-CG1 4.31Å; F247-V433 HydrophobicContact CE1-CG2 3.71Å; M248-V433 PolarHBondContact N-O 3.24Å; E431-V433 HydrophobicContact CG-CG2 4.2Å; V433-F435 HydrophobicContact CB-CE2 4.45Å; V433-F435 HydrophobicContact CG1-CD2 4.49Å; V433-F435 HydrophobicContact CG1-CE2 3.95Å
434	Y	95.5	Very high	91.6	Very high	25 Å²	25	40 Å²	40	10%	0.098	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	125	-174.8	-62.6	-87.7	0	0	0	111.5	M248 I370 I403 K408 V412 I432	M248-Y434 HydrophobicContact CB-CD1 4.03Å; M248-Y434 HydrophobicContact CB-CE1 4.33Å; I370-Y434 HydrophobicContact CD1-CD1 3.9Å; I370-Y434 HydrophobicContact CD1-CE1 4.26Å; I370-Y434 HydrophobicContact CG1-CD1 4.29Å; I403-Y434 HydrophobicContact CD1-CD1 3.54Å; I403-Y434 HydrophobicContact CD1-CD2 4.34Å; I403-Y434 HydrophobicContact CD1-CE1 4.32Å; I403-Y434 HydrophobicContact CD1-CG 3.54Å; K408-Y434 HydrophobicContact CD-CE2 3.66Å; K408-Y434 HydrophobicContact CG-CE2 3.99Å; K408-Y434 WeakPolarHBondContact CG-OH 3.18Å; V412-Y434 HydrophobicContact CB-CE1 4.42Å; V412-Y434 HydrophobicContact CG1-CE1 3.97Å; V412-Y434 HydrophobicContact CG2-CE1 3.99Å; I432-Y434 HydrophobicContact CB-CE2 4.14Å; I432-Y434 HydrophobicContact CG2-CD2 4.47Å; I432-Y434 HydrophobicContact CG2-CE1 4.03Å; I432-Y434 HydrophobicContact CG2-CE2 3.8Å; I432-Y434 WeakPolarHBondContact O-CD2 3.41Å; I432-Y434 VanDerWaalsContact O-CE2 3.28Å; I432-Y434 WeakPolarHBondContact O-CE2 3.32Å
435	F	95.8	Very high	92.2	Very high	1 Å²	1	38.1 Å²	38.1	0%	0.004	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-100.3	122.8	175.9	-70.1	-107.3	0	0	0	109.4	Q218 A221 F247 M248 I253 K255 L258 V433	Q218-F435 HydrophobicContact CB-CD1 4.48Å; Q218-F435 HydrophobicContact CG-CD1 4.04Å; A221-F435 HydrophobicContact CB-CD1 4.39Å; A221-F435 HydrophobicContact CB-CD2 4.45Å; A221-F435 HydrophobicContact CB-CE1 4.2Å; A221-F435 HydrophobicContact CB-CE2 4.23Å; A221-F435 HydrophobicContact CB-CZ 4.13Å; F247-F435 HydrophobicContact CB-CD2 4.28Å; F247-F435 HydrophobicContact CB-CE2 3.65Å; F247-F435 HydrophobicContact CB-CZ 4.47Å; F247-F435 HydrophobicContact CD1-CE2 4.09Å; F247-F435 AromaticContact CD2-CE2 3.74Å; F247-F435 HydrophobicContact CD2-CE2 3.74Å; F247-F435 AromaticContact CD2-CZ 3.76Å; F247-F435 HydrophobicContact CD2-CZ 3.76Å; F247-F435 HydrophobicContact CE2-CE2 4.39Å; F247-F435 HydrophobicContact CE2-CZ 4.1Å; F247-F435 AromaticContact CG-CE2 3.56Å; F247-F435 HydrophobicContact CG-CE2 3.56Å; F247-F435 HydrophobicContact CG-CZ 4.08Å; M248-F435 PolarHBondContact O-N 2.77Å; I253-F435 HydrophobicContact CB-CB 4.35Å; I253-F435 HydrophobicContact CG1-CB 4.04Å; I253-F435 HydrophobicContact CG2-CB 3.39Å; I253-F435 HydrophobicContact CG2-CD1 3.94Å; I253-F435 HydrophobicContact CG2-CG 3.87Å; K255-F435 HydrophobicContact CB-CE2 4.47Å; K255-F435 HydrophobicContact CB-CZ 4.38Å; K255-F435 HydrophobicContact CD-CD2 4.4Å; K255-F435 HydrophobicContact CG-CD1 4.13Å; K255-F435 HydrophobicContact CG-CD2 3.71Å; K255-F435 HydrophobicContact CG-CE1 4.25Å; K255-F435 HydrophobicContact CG-CE2 3.86Å; K255-F435 HydrophobicContact CG-CG 3.86Å; K255-F435 HydrophobicContact CG-CZ 4.1Å; L258-F435 HydrophobicContact CB-CE1 4.34Å; L258-F435 HydrophobicContact CB-CZ 4.13Å; L258-F435 HydrophobicContact CD2-CE1 4.16Å; L258-F435 HydrophobicContact CD2-CZ 3.58Å; L258-F435 HydrophobicContact CG-CZ 4.49Å; V433-F435 HydrophobicContact CB-CE2 4.45Å; V433-F435 HydrophobicContact CG1-CD2 4.49Å; V433-F435 HydrophobicContact CG1-CE2 3.95Å
436	L	94.2	Very high	92.7	Very high	20 Å²	20	39 Å²	39	11%	0.105	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-97.5	151.8	-174.7	-51.7	-176.4	0	0	0	109.9	Q218 I253 I370 A374 V401 I403	Q218-L436 PolarHBondContact NE2-O 2.8Å; I253-L436 VanDerWaalsContact CD1-O 3.27Å; I253-L436 WeakPolarHBondContact CD1-O 3.16Å; I253-L436 WeakPolarHBondContact CG1-O 3.41Å; I370-L436 HydrophobicContact CG2-CD2 4.16Å; A374-L436 HydrophobicContact CB-CB 4.29Å; A374-L436 HydrophobicContact CB-CD2 3.99Å; V401-L436 WeakPolarHBondContact O-CD1 3.19Å; I403-L436 HydrophobicContact CD1-CD2 3.76Å; I403-L436 HydrophobicContact CG1-CD2 3.84Å
437	P	93.4	Very high	93.2	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.013	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-51.1	154.8	171.6	-26.1	35	0	0	0	111.9	A371 R378 V482	A371-P437 HydrophobicContact CB-CG 3.62Å; R378-P437 PolarHBondContact NH1-O 3.4Å; R378-P437 PolarHBondContact NH2-O 2.84Å; P437-V482 HydrophobicContact CB-CG1 4.11Å; P437-V482 HydrophobicContact CG-CG1 3.91Å
438	F	93.7	Very high	93.6	Very high	13 Å²	13	36.2 Å²	36.2	6%	0.057	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-72.7	145.5	179.2	-64.4	-65.7	0	0	0	111.8	I253 E442 L443 L446 Y480 A486	I253-F438 HydrophobicContact CD1-CD1 4.34Å; I253-F438 HydrophobicContact CD1-CD2 3.69Å; I253-F438 HydrophobicContact CD1-CE1 4.15Å; I253-F438 HydrophobicContact CD1-CE2 3.48Å; I253-F438 VanDerWaalsContact CD1-CE2 3.48Å; I253-F438 HydrophobicContact CD1-CG 4.13Å; I253-F438 HydrophobicContact CD1-CZ 3.72Å; I253-F438 HydrophobicContact CG1-CZ 4.47Å; I253-F438 WeakPolarHBondContact O-CZ 3.39Å; F438-E442 VanDerWaalsContact CA-OE2 3.31Å; F438-E442 WeakPolarHBondContact CA-OE2 3.2Å; F438-E442 HydrophobicContact CB-CB 4.12Å; F438-E442 HydrophobicContact CD1-CB 4.08Å; F438-L443 HydrophobicContact CB-CD2 3.56Å; F438-L443 HydrophobicContact CB-CG 3.73Å; F438-L443 HydrophobicContact CD2-CD2 4.02Å; F438-L443 HydrophobicContact CG-CD2 4.15Å; F438-L446 HydrophobicContact CD2-CD1 4.21Å; F438-L446 HydrophobicContact CE1-CD1 4.34Å; F438-L446 HydrophobicContact CE2-CD1 3.7Å; F438-L446 HydrophobicContact CZ-CD1 3.79Å; F438-Y480 AromaticContact CD2-CE2 3.88Å; F438-Y480 HydrophobicContact CD2-CE2 3.88Å; F438-Y480 PolarHBondContact N-OH 3.45Å; F438-A486 HydrophobicContact CE2-CB 4.05Å; F438-A486 HydrophobicContact CZ-CB 4.46Å
439	T	91.6	Very high	93.9	Very high	41 Å²	41	36.4 Å²	36.4	25%	0.252	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-75.9	163.8	166.7	70	0	0	0	0	110.4	S441 E442 L443	T439-S441 PolarHBondContact O-N 3.38Å; T439-S441 PolarHBondContact OG1-OG 2.89Å; T439-E442 PolarHBondContact N-OE2 3.48Å; T439-E442 PolarHBondContact O-N 3.14Å; T439-E442 VanDerWaalsContact O-N 3.14Å; T439-E442 WeakPolarHBondContact OG1-CG 3.25Å; T439-E442 PolarHBondContact OG1-N 2.93Å; T439-E442 PolarHBondContact OG1-OE2 2.83Å; T439-L443 VanDerWaalsContact O-CG 3.32Å; T439-L443 WeakPolarHBondContact O-CG 3.36Å; T439-L443 PolarHBondContact O-N 3.48Å
440	R	90.6	Very high	94	Very high	101 Å²	101	36.7 Å²	36.7	38%	0.381	19%	0.187	S	C	.	.	H	α-helix	trans	-56.4	-40.3	176.2	-173.1	60.1	172.3	-165.1	-5.4	112.4	L443 L444 E474 A477 D478	R440-L443 PolarHBondContact O-N 2.73Å; R440-L444 WeakPolarHBondContact O-CG 3.32Å; R440-L444 PolarHBondContact O-N 2.69Å; R440-L444 VanDerWaalsContact O-N 3.09Å; R440-E474 PolarHBondContact NH2-O 2.83Å; R440-E474 VanDerWaalsContact NH2-O 3.12Å; R440-A477 VanDerWaalsContact NH1-C 3.35Å; R440-A477 PolarHBondContact NH1-O 3.18Å; R440-D478 IonicContact CZ-OD1 3.82Å; R440-D478 IonicContact NH1-OD1 2.75Å; R440-D478 PolarHBondContact NH1-OD1 3.44Å; R440-D478 IonicContact NH2-OD1 3.16Å; R440-D478 PolarHBondContact NH2-OD1 3.09Å; R440-D478 IonicContact NH2-OD2 2.85Å
441	S	92.6	Very high	94.3	Very high	71 Å²	71	34.2 Å²	34.2	50%	0.497	17%	0.172	S	C	.	.	H	α-helix	trans	-64.5	-41.6	177.4	69.5	0	0	0	0	112.8	T439 L444 Q445	T439-S441 PolarHBondContact O-N 3.38Å; T439-S441 PolarHBondContact OG1-OG 2.89Å; S441-L444 PolarHBondContact O-N 3.47Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 2.9Å
442	E	93.8	Very high	94.4	Very high	28 Å²	28	34.6 Å²	34.6	13%	0.131	17%	0.174	C	C	.	.	H	α-helix	trans	-67.4	-38.4	176.5	-70	167	163	0	0	111.3	I216 G217 F438 T439 Q445 L446	I216-E442 HydrophobicContact CG2-CB 4.02Å; I216-E442 HydrophobicContact CG2-CG 4.31Å; G217-E442 WeakPolarHBondContact CA-OE1 3.49Å; F438-E442 VanDerWaalsContact CA-OE2 3.31Å; F438-E442 WeakPolarHBondContact CA-OE2 3.2Å; F438-E442 HydrophobicContact CB-CB 4.12Å; F438-E442 HydrophobicContact CD1-CB 4.08Å; T439-E442 PolarHBondContact N-OE2 3.48Å; T439-E442 PolarHBondContact O-N 3.14Å; T439-E442 VanDerWaalsContact O-N 3.14Å; T439-E442 WeakPolarHBondContact OG1-CG 3.25Å; T439-E442 PolarHBondContact OG1-N 2.93Å; T439-E442 PolarHBondContact OG1-OE2 2.83Å; E442-Q445 PolarHBondContact O-N 3.09Å; E442-L446 WeakPolarHBondContact O-CB 3.31Å; E442-L446 PolarHBondContact O-N 2.93Å
443	L	94.7	Very high	94.4	Very high	9 Å²	9	39 Å²	39	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-61.2	-45.5	175.5	-70.5	173.1	0	0	0	111.8	F438 T439 R440 Q445 L446 V447 A477 Y480 I489	F438-L443 HydrophobicContact CB-CD2 3.56Å; F438-L443 HydrophobicContact CB-CG 3.73Å; F438-L443 HydrophobicContact CD2-CD2 4.02Å; F438-L443 HydrophobicContact CG-CD2 4.15Å; T439-L443 VanDerWaalsContact O-CG 3.32Å; T439-L443 WeakPolarHBondContact O-CG 3.36Å; T439-L443 PolarHBondContact O-N 3.48Å; R440-L443 PolarHBondContact O-N 2.73Å; L443-Q445 VanDerWaalsContact C-N 3.31Å; L443-Q445 PolarHBondContact O-N 2.6Å; L443-L446 WeakPolarHBondContact O-CB 3.21Å; L443-L446 PolarHBondContact O-N 3.11Å; L443-L446 VanDerWaalsContact O-N 3.1Å; L443-V447 WeakPolarHBondContact O-CG2 3.33Å; L443-V447 PolarHBondContact O-N 3.25Å; L443-A477 HydrophobicContact CB-CB 4.19Å; L443-Y480 HydrophobicContact CD1-CD1 3.55Å; L443-Y480 HydrophobicContact CD1-CD2 4.45Å; L443-Y480 HydrophobicContact CD1-CE1 4.17Å; L443-Y480 HydrophobicContact CD1-CG 3.69Å; L443-Y480 HydrophobicContact CD2-CD1 3.93Å; L443-Y480 HydrophobicContact CD2-CD2 3.36Å; L443-Y480 HydrophobicContact CD2-CE1 4.22Å; L443-Y480 HydrophobicContact CD2-CE2 3.7Å; L443-Y480 HydrophobicContact CD2-CG 3.47Å; L443-Y480 VanDerWaalsContact CD2-CG 3.47Å; L443-Y480 HydrophobicContact CG-CD1 4.35Å; L443-Y480 HydrophobicContact CG-CG 4.24Å; L443-I489 HydrophobicContact CD2-CD1 4.5Å; L443-I489 HydrophobicContact CD2-CG1 4.35Å
444	L	95.9	Very high	94.4	Very high	36 Å²	36	40.6 Å²	40.6	19%	0.188	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-41.1	177.1	-69.5	171.7	0	0	0	111.8	R440 S441 L446 A448 L473 E474 A477	R440-L444 WeakPolarHBondContact O-CG 3.32Å; R440-L444 PolarHBondContact O-N 2.69Å; R440-L444 VanDerWaalsContact O-N 3.09Å; S441-L444 PolarHBondContact O-N 3.47Å; L444-L446 VanDerWaalsContact C-N 3.3Å; L444-L446 PolarHBondContact O-N 3.12Å; L444-A448 WeakPolarHBondContact O-CB 3.38Å; L444-A448 PolarHBondContact O-N 3.3Å; L444-L473 HydrophobicContact CD2-CB 3.8Å; L444-E474 HydrophobicContact CD2-CG 4.11Å; L444-A477 HydrophobicContact CD2-CB 4.02Å
445	Q	94.5	Very high	94.3	Very high	108 Å²	108	42.3 Å²	42.3	51%	0.505	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-38.6	174.2	-68.8	176.3	20.9	0	0	111.8	I216 S441 E442 L443 A448 K449	I216-Q445 HydrophobicContact CD1-CB 4.18Å; I216-Q445 HydrophobicContact CG2-CB 3.99Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 2.9Å; E442-Q445 PolarHBondContact O-N 3.09Å; L443-Q445 VanDerWaalsContact C-N 3.31Å; L443-Q445 PolarHBondContact O-N 2.6Å; Q445-A448 PolarHBondContact O-N 3.32Å; Q445-K449 WeakPolarHBondContact O-CB 3.39Å; Q445-K449 PolarHBondContact O-N 3.39Å
446	L	94.1	Very high	94.3	Very high	18 Å²	18	44.9 Å²	44.9	9%	0.094	22%	0.222	C	C	.	.	H	α-helix	trans	-67.1	-46.6	179.8	-162.8	152.5	0	0	0	111.5	I216 F438 E442 L443 L444 A448 K449 E450 A486 I489	I216-L446 HydrophobicContact CD1-CB 4.02Å; I216-L446 HydrophobicContact CD1-CG 4.36Å; F438-L446 HydrophobicContact CD2-CD1 4.21Å; F438-L446 HydrophobicContact CE1-CD1 4.34Å; F438-L446 HydrophobicContact CE2-CD1 3.7Å; F438-L446 HydrophobicContact CZ-CD1 3.79Å; E442-L446 WeakPolarHBondContact O-CB 3.31Å; E442-L446 PolarHBondContact O-N 2.93Å; L443-L446 WeakPolarHBondContact O-CB 3.21Å; L443-L446 PolarHBondContact O-N 3.11Å; L443-L446 VanDerWaalsContact O-N 3.1Å; L444-L446 VanDerWaalsContact C-N 3.3Å; L444-L446 PolarHBondContact O-N 3.12Å; L446-A448 VanDerWaalsContact C-N 3.34Å; L446-A448 PolarHBondContact O-N 3.17Å; L446-K449 PolarHBondContact O-N 2.95Å; L446-E450 PolarHBondContact O-N 3.18Å; L446-A486 HydrophobicContact CD1-CB 3.53Å; L446-A486 HydrophobicContact CD2-CB 4.1Å; L446-A486 HydrophobicContact CG-CB 4.39Å; L446-I489 HydrophobicContact CD2-CB 3.61Å; L446-I489 HydrophobicContact CD2-CG1 4.02Å; L446-I489 HydrophobicContact CD2-CG2 3.47Å; L446-I489 VanDerWaalsContact CD2-CG2 3.47Å
447	V	96	Very high	94.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.7	-47.3	173.8	176.7	0	0	0	0	110.4	L443 K449 E450 L451 L473 L476 A477 I489	L443-V447 WeakPolarHBondContact O-CG2 3.33Å; L443-V447 PolarHBondContact O-N 3.25Å; V447-K449 VanDerWaalsContact C-N 3.29Å; V447-K449 PolarHBondContact O-N 2.86Å; V447-E450 PolarHBondContact O-N 3.49Å; V447-L451 HydrophobicContact CG1-CD1 4.08Å; V447-L451 HydrophobicContact CG1-CG 4.35Å; V447-L451 WeakPolarHBondContact O-CG 3.18Å; V447-L451 PolarHBondContact O-N 3.19Å; V447-L473 HydrophobicContact CB-CD2 4.22Å; V447-L473 HydrophobicContact CG1-CD2 3.62Å; V447-L476 HydrophobicContact CG1-CB 3.64Å; V447-L476 HydrophobicContact CG1-CD1 3.72Å; V447-L476 HydrophobicContact CG1-CG 4.34Å; V447-L476 HydrophobicContact CG2-CB 4.13Å; V447-A477 HydrophobicContact CG2-CB 4.16Å; V447-I489 HydrophobicContact CB-CG2 4.32Å; V447-I489 HydrophobicContact CG2-CD1 4.09Å; V447-I489 HydrophobicContact CG2-CG2 3.56Å
448	A	95.7	Very high	94.2	Very high	32 Å²	32	48.8 Å²	48.8	26%	0.264	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-40.8	179.4	0	0	0	0	0	112	L444 Q445 L446 L451 E452 L473	L444-A448 WeakPolarHBondContact O-CB 3.38Å; L444-A448 PolarHBondContact O-N 3.3Å; Q445-A448 PolarHBondContact O-N 3.32Å; L446-A448 VanDerWaalsContact C-N 3.34Å; L446-A448 PolarHBondContact O-N 3.17Å; A448-L451 PolarHBondContact O-N 2.94Å; A448-E452 WeakPolarHBondContact O-CB 3.4Å; A448-E452 PolarHBondContact O-N 3.09Å; A448-L473 HydrophobicContact CB-CD1 4.39Å; A448-L473 HydrophobicContact CB-CD2 4.12Å
449	K	93.8	Very high	94.1	Very high	93 Å²	93	53.9 Å²	53.9	40%	0.404	26%	0.264	S	S	.	.	H	α-helix	trans	-65.2	-41	176.6	-174.5	173.3	-179.6	168.8	0	112.5	K213 Y214 I216 Q445 L446 V447 E452 F453	K213-K449 PolarHBondContact O-NZ 2.64Å; Y214-K449 PolarHBondContact O-NZ 3.37Å; I216-K449 HydrophobicContact CD1-CB 4.27Å; I216-K449 HydrophobicContact CD1-CD 3.91Å; Q445-K449 WeakPolarHBondContact O-CB 3.39Å; Q445-K449 PolarHBondContact O-N 3.39Å; L446-K449 PolarHBondContact O-N 2.95Å; V447-K449 VanDerWaalsContact C-N 3.29Å; V447-K449 PolarHBondContact O-N 2.86Å; K449-E452 PolarHBondContact O-N 3.14Å; K449-F453 PolarHBondContact O-N 2.91Å
450	E	94.7	Very high	94.1	Very high	25 Å²	25	60.2 Å²	60.2	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-44	176.8	-170.4	59.9	-145.9	0	0	111.1	L446 V447 E452 F453 W454 V493	L446-E450 PolarHBondContact O-N 3.18Å; V447-E450 PolarHBondContact O-N 3.49Å; E450-E452 VanDerWaalsContact C-N 3.34Å; E450-E452 PolarHBondContact O-N 3.2Å; E450-F453 WeakPolarHBondContact O-CB 3.48Å; E450-F453 PolarHBondContact O-N 3.16Å; E450-W454 PolarHBondContact O-N 2.63Å; E450-W454 VanDerWaalsContact O-N 3.12Å; E450-W454 PolarHBondContact OE1-NE1 3.15Å; E450-V493 HydrophobicContact CB-CG2 4.29Å; E450-V493 HydrophobicContact CG-CB 3.99Å; E450-V493 HydrophobicContact CG-CG1 3.97Å; E450-V493 HydrophobicContact CG-CG2 3.94Å
451	L	96.1	Very high	94.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.4	-39.1	174.5	-70.8	177.3	0	0	0	112.4	V447 A448 F453 W454 K455 W468 L473 L476 V493 V497 L518	V447-L451 HydrophobicContact CG1-CD1 4.08Å; V447-L451 HydrophobicContact CG1-CG 4.35Å; V447-L451 WeakPolarHBondContact O-CG 3.18Å; V447-L451 PolarHBondContact O-N 3.19Å; A448-L451 PolarHBondContact O-N 2.94Å; L451-F453 VanDerWaalsContact C-N 3.34Å; L451-F453 PolarHBondContact O-N 3.06Å; L451-W454 PolarHBondContact O-N 3.23Å; L451-K455 WeakPolarHBondContact O-CB 3.18Å; L451-K455 PolarHBondContact O-N 3.13Å; L451-W468 HydrophobicContact CB-CD2 4.18Å; L451-W468 HydrophobicContact CB-CE3 4.18Å; L451-W468 HydrophobicContact CB-CH2 3.71Å; L451-W468 HydrophobicContact CB-CZ2 3.69Å; L451-W468 HydrophobicContact CB-CZ3 3.96Å; L451-W468 HydrophobicContact CD1-CD2 3.81Å; L451-W468 HydrophobicContact CD1-CE3 4.39Å; L451-W468 HydrophobicContact CD1-CG 3.88Å; L451-W468 HydrophobicContact CD1-CZ2 4.44Å; L451-L473 HydrophobicContact CD1-CD2 3.58Å; L451-L476 HydrophobicContact CD1-CD1 4.11Å; L451-L476 HydrophobicContact CD2-CD1 4.16Å; L451-L476 HydrophobicContact CG-CD1 4.39Å; L451-V493 HydrophobicContact CD2-CG1 3.83Å; L451-V497 HydrophobicContact CD2-CG1 4.39Å; L451-V497 HydrophobicContact CD2-CG2 4.15Å; L451-L518 HydrophobicContact CD2-CD1 4.14Å
452	E	95.5	Very high	93.9	Very high	76 Å²	76	62.5 Å²	62.5	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-37.9	175.9	-166	63.7	-147	0	0	111.7	A448 K449 E450 W454 K455 V456 W468	A448-E452 WeakPolarHBondContact O-CB 3.4Å; A448-E452 PolarHBondContact O-N 3.09Å; K449-E452 PolarHBondContact O-N 3.14Å; E450-E452 VanDerWaalsContact C-N 3.34Å; E450-E452 PolarHBondContact O-N 3.2Å; E452-W454 VanDerWaalsContact C-N 3.34Å; E452-W454 PolarHBondContact O-N 3.38Å; E452-K455 PolarHBondContact O-N 2.94Å; E452-K455 IonicContact OE1-NZ 3.18Å; E452-K455 PolarHBondContact OE1-NZ 3.24Å; E452-K455 VanDerWaalsContact OE1-NZ 3.08Å; E452-K455 IonicContact OE2-NZ 3.71Å; E452-K455 PolarHBondContact OE2-NZ 3.5Å; E452-K455 VanDerWaalsContact OE2-NZ 3.17Å; E452-V456 WeakPolarHBondContact O-CG2 3.25Å; E452-V456 PolarHBondContact O-N 3Å; E452-W468 WeakPolarHBondContact OE2-CH2 3.4Å
453	F	94.6	Very high	93.6	Very high	118 Å²	118	70.1 Å²	70.1	52%	0.518	32%	0.321	S	S	.	.	H	α-helix	trans	-57.8	-47.1	172.2	170.8	-99.8	0	0	0	111.5	K449 E450 L451 K457	K449-F453 PolarHBondContact O-N 2.91Å; E450-F453 WeakPolarHBondContact O-CB 3.48Å; E450-F453 PolarHBondContact O-N 3.16Å; L451-F453 VanDerWaalsContact C-N 3.34Å; L451-F453 PolarHBondContact O-N 3.06Å; F453-K457 HydrophobicContact CE1-CD 4.41Å; F453-K457 WeakPolarHBondContact O-CB 3.44Å; F453-K457 PolarHBondContact O-N 3.08Å; F453-K457 VanDerWaalsContact O-N 3.12Å
454	W	95	Very high	93.4	Very high	36 Å²	36	70.2 Å²	70.2	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-35	178	-75	105.8	0	0	0	113.3	E450 L451 E452 K457 A458 E494 V498	E450-W454 PolarHBondContact O-N 2.63Å; E450-W454 VanDerWaalsContact O-N 3.12Å; E450-W454 PolarHBondContact OE1-NE1 3.15Å; L451-W454 PolarHBondContact O-N 3.23Å; E452-W454 VanDerWaalsContact C-N 3.34Å; E452-W454 PolarHBondContact O-N 3.38Å; W454-K457 HydrophobicContact CE3-CD 3.82Å; W454-K457 HydrophobicContact CH2-CD 4.46Å; W454-K457 VanDerWaalsContact CH2-NZ 3.31Å; W454-K457 HydrophobicContact CZ3-CD 3.7Å; W454-K457 PolarHBondContact O-N 2.87Å; W454-A458 VanDerWaalsContact O-CB 3.28Å; W454-A458 WeakPolarHBondContact O-CB 3.36Å; W454-A458 PolarHBondContact O-N 3.42Å; W454-E494 HydrophobicContact CZ2-CG 4.02Å; W454-V498 HydrophobicContact CD2-CG2 3.49Å; W454-V498 VanDerWaalsContact CD2-CG2 3.49Å; W454-V498 VanDerWaalsContact CE2-CG2 3.5Å; W454-V498 HydrophobicContact CE3-CG1 4.2Å; W454-V498 HydrophobicContact CE3-CG2 3.8Å; W454-V498 HydrophobicContact CG-CG2 3.93Å; W454-V498 HydrophobicContact CH2-CG1 3.83Å; W454-V498 HydrophobicContact CH2-CG2 4.07Å; W454-V498 HydrophobicContact CZ2-CG1 4.36Å; W454-V498 HydrophobicContact CZ2-CG2 3.82Å; W454-V498 HydrophobicContact CZ3-CG1 3.74Å; W454-V498 HydrophobicContact CZ3-CG2 4.06Å
455	K	94.9	Very high	93.2	Very high	60 Å²	60	72.5 Å²	72.5	26%	0.261	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-50.6	174	177.6	-178.8	164.5	-152.3	0	112	L451 E452 K457 A458 E459 L466 W468	L451-K455 WeakPolarHBondContact O-CB 3.18Å; L451-K455 PolarHBondContact O-N 3.13Å; E452-K455 PolarHBondContact O-N 2.94Å; E452-K455 IonicContact OE1-NZ 3.18Å; E452-K455 PolarHBondContact OE1-NZ 3.24Å; E452-K455 VanDerWaalsContact OE1-NZ 3.08Å; E452-K455 IonicContact OE2-NZ 3.71Å; E452-K455 PolarHBondContact OE2-NZ 3.5Å; E452-K455 VanDerWaalsContact OE2-NZ 3.17Å; K455-K457 VanDerWaalsContact C-N 3.28Å; K455-K457 PolarHBondContact O-N 3.33Å; K455-A458 PolarHBondContact O-N 3.02Å; K455-E459 PolarHBondContact O-N 2.89Å; K455-L466 HydrophobicContact CB-CB 4.17Å; K455-L466 HydrophobicContact CB-CD2 4.36Å; K455-L466 WeakPolarHBondContact CD-O 3.43Å; K455-L466 HydrophobicContact CG-CB 4.11Å; K455-W468 HydrophobicContact CB-CH2 4.24Å; K455-W468 HydrophobicContact CB-CZ3 4Å; K455-W468 HydrophobicContact CD-CH2 3.76Å; K455-W468 HydrophobicContact CD-CZ3 3.74Å; K455-W468 HydrophobicContact CG-CZ3 4.36Å
456	V	95	Very high	93.1	Very high	55 Å²	55	67.4 Å²	67.4	33%	0.333	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-38.9	177.6	173.1	0	0	0	0	111.1	E452 K460	E452-V456 WeakPolarHBondContact O-CG2 3.25Å; E452-V456 PolarHBondContact O-N 3Å; V456-K460 HydrophobicContact CG1-CD 4.04Å; V456-K460 WeakPolarHBondContact O-CB 3.46Å; V456-K460 WeakPolarHBondContact O-CG 3.29Å; V456-K460 PolarHBondContact O-N 3.48Å
457	K	93.7	Very high	93.1	Very high	90 Å²	90	68.4 Å²	68.4	39%	0.391	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-41.9	176.4	-170.8	177	176.4	-176.8	0	111.9	F453 W454 K455 K461	F453-K457 HydrophobicContact CE1-CD 4.41Å; F453-K457 WeakPolarHBondContact O-CB 3.44Å; F453-K457 PolarHBondContact O-N 3.08Å; F453-K457 VanDerWaalsContact O-N 3.12Å; W454-K457 HydrophobicContact CE3-CD 3.82Å; W454-K457 HydrophobicContact CH2-CD 4.46Å; W454-K457 VanDerWaalsContact CH2-NZ 3.31Å; W454-K457 HydrophobicContact CZ3-CD 3.7Å; W454-K457 PolarHBondContact O-N 2.87Å; K455-K457 VanDerWaalsContact C-N 3.28Å; K455-K457 PolarHBondContact O-N 3.33Å; K457-K461 VanDerWaalsContact O-CB 3.27Å; K457-K461 WeakPolarHBondContact O-CB 3.15Å; K457-K461 PolarHBondContact O-N 3.02Å
458	A	91.3	Very high	93.1	Very high	14 Å²	14	71 Å²	71	12%	0.116	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-42.6	176.9	0	0	0	0	0	112	W454 K455 H462 R463 I464	W454-A458 VanDerWaalsContact O-CB 3.28Å; W454-A458 WeakPolarHBondContact O-CB 3.36Å; W454-A458 PolarHBondContact O-N 3.42Å; K455-A458 PolarHBondContact O-N 3.02Å; A458-H462 CarbonylContact O-C 3.35Å; A458-H462 WeakPolarHBondContact O-CA 3.2Å; A458-H462 WeakPolarHBondContact O-CB 3.36Å; A458-H462 PolarHBondContact O-N 2.98Å; A458-R463 PolarHBondContact O-N 2.63Å; A458-R463 VanDerWaalsContact O-N 3.1Å; A458-I464 HydrophobicContact CB-CB 4.45Å; A458-I464 PolarHBondContact O-N 3.31Å
459	E	91.4	Very high	93	Very high	120 Å²	120	72.5 Å²	72.5	56%	0.561	33%	0.327	S	S	*	.	H	α-helix	trans	-64.5	-50.8	177.3	-174.3	179.9	-164.4	0	0	111.5	K455 R463 I464	K455-E459 PolarHBondContact O-N 2.89Å; E459-R463 WeakPolarHBondContact O-CA 3.49Å; E459-R463 PolarHBondContact O-N 3.31Å; E459-I464 WeakPolarHBondContact CA-O 3.48Å; E459-I464 PolarHBondContact N-O 3.33Å
460	K	92.5	Very high	92.9	Very high	174 Å²	174	72.8 Å²	72.8	76%	0.757	33%	0.33	S	S	*	.	H	α-helix	trans	-65.8	-42.9	-177.8	-73.6	-178.9	178.9	179.7	0	113.4	V456	V456-K460 HydrophobicContact CG1-CD 4.04Å; V456-K460 WeakPolarHBondContact O-CB 3.46Å; V456-K460 WeakPolarHBondContact O-CG 3.29Å; V456-K460 PolarHBondContact O-N 3.48Å
461	K	90.5	Very high	92.9	Very high	156 Å²	156	76.1 Å²	76.1	68%	0.678	35%	0.349	S	S	*	.	H	α-helix	trans	-91	-34.5	-172.3	-170.4	175.4	177	-177	0	113.1	K457	K457-K461 VanDerWaalsContact O-CB 3.27Å; K457-K461 WeakPolarHBondContact O-CB 3.15Å; K457-K461 PolarHBondContact O-N 3.02Å
462	H	88.2	Confident	92.8	Very high	64 Å²	64	76.1 Å²	76.1	30%	0.296	35%	0.349	S	S	.	.	H	α-helix	trans	-120.7	-6.3	-171.7	-57.4	-83.9	0	0	0	113.6	A458 I464 H505	A458-H462 CarbonylContact O-C 3.35Å; A458-H462 WeakPolarHBondContact O-CA 3.2Å; A458-H462 WeakPolarHBondContact O-CB 3.36Å; A458-H462 PolarHBondContact O-N 2.98Å; H462-I464 HydrophobicContact CB-CB 4.47Å; H462-I464 HydrophobicContact CB-CD1 3.66Å; H462-I464 HydrophobicContact CB-CG1 3.85Å; H462-I464 PolarHBondContact O-N 3.01Å; H462-H505 AromaticContact ND1-NE2 3.53Å
463	R	88.4	Confident	92.7	Very high	188 Å²	188	73.2 Å²	73.2	71%	0.709	34%	0.336	S	S	*	.			trans	54.9	36.9	-173.1	-54.3	-178.7	-176.7	-178.7	0.1	112.2	A458 E459 P512 G513	A458-R463 PolarHBondContact O-N 2.63Å; A458-R463 VanDerWaalsContact O-N 3.1Å; E459-R463 WeakPolarHBondContact O-CA 3.49Å; E459-R463 PolarHBondContact O-N 3.31Å; R463-P512 HydrophobicContact CB-CB 4.24Å; R463-G513 WeakPolarHBondContact O-CA 3.48Å; R463-G513 PolarHBondContact O-N 3.34Å
464	I	89.4	Confident	92.7	Very high	11 Å²	11	71.7 Å²	71.7	6%	0.056	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-103	130.7	178	-64	171.1	0	0	0	108.3	A458 E459 H462 M510 C514 V516	A458-I464 HydrophobicContact CB-CB 4.45Å; A458-I464 PolarHBondContact O-N 3.31Å; E459-I464 WeakPolarHBondContact CA-O 3.48Å; E459-I464 PolarHBondContact N-O 3.33Å; H462-I464 HydrophobicContact CB-CB 4.47Å; H462-I464 HydrophobicContact CB-CD1 3.66Å; H462-I464 HydrophobicContact CB-CG1 3.85Å; H462-I464 PolarHBondContact O-N 3.01Å; I464-M510 HydrophobicContact CD1-CB 4.07Å; I464-C514 WeakPolarHBondContact CA-O 3.39Å; I464-V516 HydrophobicContact CG2-CB 4.44Å; I464-V516 HydrophobicContact CG2-CG2 3.68Å
465	E	91.8	Very high	92.6	Very high	84 Å²	84	71 Å²	71	39%	0.393	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.1	172.4	-171.9	-175	179.9	0	0	109.4	T467 C514 R515 V516	E465-T467 HydrophobicContact CG-CG2 4.44Å; E465-C514 PolarHBondContact N-O 3.16Å; E465-R515 HydrophobicContact CB-CB 4.36Å; E465-R515 HydrophobicContact CB-CG 4.39Å; E465-R515 VanDerWaalsContact CD-NH2 3.3Å; E465-R515 HydrophobicContact CG-CG 4.49Å; E465-R515 CarbonylContact O-C 3.55Å; E465-R515 WeakPolarHBondContact O-CA 3.48Å; E465-R515 IonicContact OE1-CZ 3.27Å; E465-R515 IonicContact OE1-NE 3.64Å; E465-R515 PolarHBondContact OE1-NE 2.73Å; E465-R515 IonicContact OE1-NH2 3.47Å; E465-R515 PolarHBondContact OE1-NH2 3.1Å; E465-R515 IonicContact OE2-CZ 2.73Å; E465-R515 IonicContact OE2-NE 3.35Å; E465-R515 PolarHBondContact OE2-NE 2.94Å; E465-R515 IonicContact OE2-NH2 3.64Å; E465-R515 PolarHBondContact OE2-NH2 3.33Å; E465-R515 VanDerWaalsContact OE2-NH2 3.11Å; E465-V516 PolarHBondContact O-N 2.66Å
466	L	93.4	Very high	92.6	Very high	1 Å²	1	68.1 Å²	68.1	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.1	178.6	-170.3	68.5	0	0	0	110.4	K455 W468 L501 V516 L518	K455-L466 HydrophobicContact CB-CB 4.17Å; K455-L466 HydrophobicContact CB-CD2 4.36Å; K455-L466 WeakPolarHBondContact CD-O 3.43Å; K455-L466 HydrophobicContact CG-CB 4.11Å; L466-W468 HydrophobicContact CD2-CZ3 4.31Å; L466-W468 HydrophobicContact CG-CE3 4.27Å; L466-W468 HydrophobicContact CG-CZ3 4.29Å; L466-L501 HydrophobicContact CD1-CD1 4.23Å; L466-L501 HydrophobicContact CD1-CD2 4.31Å; L466-L501 HydrophobicContact CD2-CD1 4.41Å; L466-V516 HydrophobicContact CD1-CB 4.11Å; L466-V516 HydrophobicContact CD1-CG1 4.16Å; L466-L518 HydrophobicContact CD1-CD1 4.19Å; L466-L518 HydrophobicContact CD1-CD2 3.92Å; L466-L518 HydrophobicContact CD1-CG 3.93Å; L466-L518 HydrophobicContact CD2-CD1 4.46Å; L466-L518 HydrophobicContact CG-CD1 4.42Å
467	T	94.4	Very high	92.6	Very high	40 Å²	40	65.5 Å²	65.5	25%	0.245	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.7	177.9	59.4	0	0	0	0	110.2	E465 V516 Q517 L518	E465-T467 HydrophobicContact CG-CG2 4.44Å; T467-V516 PolarHBondContact N-O 2.95Å; T467-V516 PolarHBondContact OG1-O 3.49Å; T467-Q517 CarbonylContact O-C 3.58Å; T467-Q517 WeakPolarHBondContact O-CA 3.37Å; T467-Q517 WeakPolarHBondContact OG1-CA 3.37Å; T467-L518 PolarHBondContact O-N 2.89Å
468	W	95.4	Very high	92.5	Very high	53 Å²	53	66.2 Å²	66.2	20%	0.201	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	157.9	-179.7	56.3	88.5	0	0	0	111.7	L451 E452 K455 L466 V472 L518	L451-W468 HydrophobicContact CB-CD2 4.18Å; L451-W468 HydrophobicContact CB-CE3 4.18Å; L451-W468 HydrophobicContact CB-CH2 3.71Å; L451-W468 HydrophobicContact CB-CZ2 3.69Å; L451-W468 HydrophobicContact CB-CZ3 3.96Å; L451-W468 HydrophobicContact CD1-CD2 3.81Å; L451-W468 HydrophobicContact CD1-CE3 4.39Å; L451-W468 HydrophobicContact CD1-CG 3.88Å; L451-W468 HydrophobicContact CD1-CZ2 4.44Å; E452-W468 WeakPolarHBondContact OE2-CH2 3.4Å; K455-W468 HydrophobicContact CB-CH2 4.24Å; K455-W468 HydrophobicContact CB-CZ3 4Å; K455-W468 HydrophobicContact CD-CH2 3.76Å; K455-W468 HydrophobicContact CD-CZ3 3.74Å; K455-W468 HydrophobicContact CG-CZ3 4.36Å; L466-W468 HydrophobicContact CD2-CZ3 4.31Å; L466-W468 HydrophobicContact CG-CE3 4.27Å; L466-W468 HydrophobicContact CG-CZ3 4.29Å; W468-V472 HydrophobicContact CB-CB 4.31Å; W468-V472 HydrophobicContact CB-CG1 4.4Å; W468-V472 HydrophobicContact CB-CG2 4.46Å; W468-L518 HydrophobicContact CB-CB 3.84Å; W468-L518 HydrophobicContact CB-CD1 4.1Å; W468-L518 HydrophobicContact CB-CG 4.27Å
469	N	92.5	Very high	92.5	Very high	64 Å²	64	66.7 Å²	66.7	34%	0.342	32%	0.316	S	S	.	.			trans	-97.3	167.3	174.9	-64.8	-2.9	0	0	0	111.2	D471 V472 Q517	N469-D471 VanDerWaalsContact C-N 3.28Å; N469-D471 PolarHBondContact O-N 3.43Å; N469-V472 WeakPolarHBondContact O-CB 3.14Å; N469-V472 PolarHBondContact O-N 3.43Å; N469-V472 VanDerWaalsContact O-N 3.16Å; N469-Q517 PolarHBondContact OD1-NE2 3.25Å; N469-Q517 VanDerWaalsContact OD1-NE2 3.07Å
470	Q	92.9	Very high	92.6	Very high	99 Å²	99	62.7 Å²	62.7	46%	0.463	30%	0.296	S	S	.	.	H	α-helix	trans	-57.7	-37.7	177.7	-176.7	62.6	25.2	0	0	112.8	V472 L473 E474	Q470-V472 PolarHBondContact O-N 2.88Å; Q470-L473 WeakPolarHBondContact O-CA 3.19Å; Q470-L473 WeakPolarHBondContact O-CB 3.19Å; Q470-L473 PolarHBondContact O-N 2.87Å; Q470-E474 PolarHBondContact O-N 3.15Å; Q470-E474 VanDerWaalsContact O-N 3.09Å
471	D	93.2	Very high	92.6	Very high	95 Å²	95	57.6 Å²	57.6	51%	0.508	28%	0.276	S	S	.	.	H	α-helix	trans	-58.2	-32.8	179.3	-52	-32.5	0	0	0	112.6	N469 L473 E474 L475 V520	N469-D471 VanDerWaalsContact C-N 3.28Å; N469-D471 PolarHBondContact O-N 3.43Å; D471-L473 VanDerWaalsContact C-N 3.34Å; D471-E474 PolarHBondContact O-N 3.43Å; D471-L475 WeakPolarHBondContact O-CB 3.46Å; D471-L475 PolarHBondContact O-N 3.38Å; D471-V520 HydrophobicContact CB-CB 4.3Å; D471-V520 HydrophobicContact CB-CG2 3.76Å; D471-V520 WeakPolarHBondContact O-CG2 3.42Å
472	V	94.1	Very high	92.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-38.8	176.7	178.8	0	0	0	0	110.3	W468 N469 Q470 E474 L476 L518 V520 V531	W468-V472 HydrophobicContact CB-CB 4.31Å; W468-V472 HydrophobicContact CB-CG1 4.4Å; W468-V472 HydrophobicContact CB-CG2 4.46Å; N469-V472 WeakPolarHBondContact O-CB 3.14Å; N469-V472 PolarHBondContact O-N 3.43Å; N469-V472 VanDerWaalsContact O-N 3.16Å; Q470-V472 PolarHBondContact O-N 2.88Å; V472-E474 VanDerWaalsContact C-N 3.34Å; V472-L476 HydrophobicContact CG1-CD1 3.82Å; V472-L476 HydrophobicContact CG1-CG 4.39Å; V472-L476 WeakPolarHBondContact O-CB 3.27Å; V472-L476 VanDerWaalsContact O-CG 3.25Å; V472-L476 WeakPolarHBondContact O-CG 3.32Å; V472-L476 PolarHBondContact O-N 2.89Å; V472-L518 HydrophobicContact CG1-CB 4.2Å; V472-L518 HydrophobicContact CG1-CD1 4.39Å; V472-L518 HydrophobicContact CG2-CB 4Å; V472-L518 WeakPolarHBondContact CG2-O 3.43Å; V472-V520 HydrophobicContact CB-CG2 4.49Å; V472-V520 HydrophobicContact CG2-CG2 3.95Å; V472-V531 HydrophobicContact CG1-CG1 4.48Å; V472-V531 HydrophobicContact CG1-CG2 4.14Å
473	L	94.8	Very high	92.8	Very high	16 Å²	16	56.8 Å²	56.8	8%	0.084	27%	0.271	C	S	.	.	H	α-helix	trans	-64.2	-42.7	175.9	-61.1	-179.7	0	0	0	111.1	L444 V447 A448 L451 Q470 D471 A477	L444-L473 HydrophobicContact CD2-CB 3.8Å; V447-L473 HydrophobicContact CB-CD2 4.22Å; V447-L473 HydrophobicContact CG1-CD2 3.62Å; A448-L473 HydrophobicContact CB-CD1 4.39Å; A448-L473 HydrophobicContact CB-CD2 4.12Å; L451-L473 HydrophobicContact CD1-CD2 3.58Å; Q470-L473 WeakPolarHBondContact O-CA 3.19Å; Q470-L473 WeakPolarHBondContact O-CB 3.19Å; Q470-L473 PolarHBondContact O-N 2.87Å; D471-L473 VanDerWaalsContact C-N 3.34Å; L473-A477 WeakPolarHBondContact O-CB 3.43Å; L473-A477 PolarHBondContact O-N 3.38Å
474	E	94.2	Very high	92.9	Very high	86 Å²	86	54.2 Å²	54.2	40%	0.402	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-46	178.5	-68.4	-176.2	-170.8	0	0	112	R440 L444 Q470 D471 V472 L476 A477 D478	R440-E474 PolarHBondContact NH2-O 2.83Å; R440-E474 VanDerWaalsContact NH2-O 3.12Å; L444-E474 HydrophobicContact CD2-CG 4.11Å; Q470-E474 PolarHBondContact O-N 3.15Å; Q470-E474 VanDerWaalsContact O-N 3.09Å; D471-E474 PolarHBondContact O-N 3.43Å; V472-E474 VanDerWaalsContact C-N 3.34Å; E474-L476 PolarHBondContact O-N 2.85Å; E474-A477 PolarHBondContact O-N 3.16Å; E474-D478 VanDerWaalsContact O-CG 3.31Å; E474-D478 PolarHBondContact O-N 2.77Å
475	L	93.4	Very high	93	Very high	20 Å²	20	53.7 Å²	53.7	11%	0.105	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-47.9	177.8	178.9	63.3	0	0	0	112	D471 A477 D478 V520 K529 V531	D471-L475 WeakPolarHBondContact O-CB 3.46Å; D471-L475 PolarHBondContact O-N 3.38Å; L475-A477 VanDerWaalsContact C-N 3.31Å; L475-A477 PolarHBondContact O-N 3.22Å; L475-D478 WeakPolarHBondContact O-CB 3.41Å; L475-D478 PolarHBondContact O-N 3.03Å; L475-V520 HydrophobicContact CB-CG2 4.15Å; L475-V520 HydrophobicContact CD2-CG1 4.03Å; L475-V520 HydrophobicContact CD2-CG2 3.95Å; L475-K529 HydrophobicContact CD1-CB 3.55Å; L475-K529 HydrophobicContact CD2-CB 4.23Å; L475-V531 HydrophobicContact CD2-CG2 4.01Å
476	L	94.2	Very high	93	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.4	-32.6	179.8	-67.2	171.8	0	0	0	111.7	V447 L451 V472 E474 D478 G479 I489 E492 V493 Q496 V497 V531	V447-L476 HydrophobicContact CG1-CB 3.64Å; V447-L476 HydrophobicContact CG1-CD1 3.72Å; V447-L476 HydrophobicContact CG1-CG 4.34Å; V447-L476 HydrophobicContact CG2-CB 4.13Å; L451-L476 HydrophobicContact CD1-CD1 4.11Å; L451-L476 HydrophobicContact CD2-CD1 4.16Å; L451-L476 HydrophobicContact CG-CD1 4.39Å; V472-L476 HydrophobicContact CG1-CD1 3.82Å; V472-L476 HydrophobicContact CG1-CG 4.39Å; V472-L476 WeakPolarHBondContact O-CB 3.27Å; V472-L476 VanDerWaalsContact O-CG 3.25Å; V472-L476 WeakPolarHBondContact O-CG 3.32Å; V472-L476 PolarHBondContact O-N 2.89Å; E474-L476 PolarHBondContact O-N 2.85Å; L476-D478 VanDerWaalsContact C-N 3.27Å; L476-D478 PolarHBondContact O-N 3.17Å; L476-G479 PolarHBondContact O-N 3.31Å; L476-I489 WeakPolarHBondContact O-CD1 3.41Å; L476-E492 HydrophobicContact CD2-CG 3.97Å; L476-V493 HydrophobicContact CD1-CG2 4.04Å; L476-Q496 HydrophobicContact CD2-CB 4.01Å; L476-Q496 HydrophobicContact CD2-CG 4.43Å; L476-V497 HydrophobicContact CD1-CG2 4.1Å; L476-V497 HydrophobicContact CD2-CG2 4.34Å; L476-V531 HydrophobicContact CD2-CG2 4.25Å
477	A	94.2	Very high	93	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-25	173.9	0	0	0	0	0	112.9	R440 L443 L444 V447 L473 E474 L475 G479 Y480	R440-A477 VanDerWaalsContact NH1-C 3.35Å; R440-A477 PolarHBondContact NH1-O 3.18Å; L443-A477 HydrophobicContact CB-CB 4.19Å; L444-A477 HydrophobicContact CD2-CB 4.02Å; V447-A477 HydrophobicContact CG2-CB 4.16Å; L473-A477 WeakPolarHBondContact O-CB 3.43Å; L473-A477 PolarHBondContact O-N 3.38Å; E474-A477 PolarHBondContact O-N 3.16Å; L475-A477 VanDerWaalsContact C-N 3.31Å; L475-A477 PolarHBondContact O-N 3.22Å; A477-G479 VanDerWaalsContact C-N 3.27Å; A477-Y480 VanDerWaalsContact O-CB 3.26Å; A477-Y480 WeakPolarHBondContact O-CB 3.5Å; A477-Y480 PolarHBondContact O-N 3.42Å
478	D	93	Very high	93	Very high	104 Å²	104	54.3 Å²	54.3	56%	0.556	26%	0.259	S	S	*	.	H	α-helix	trans	-69.5	-24.1	173.6	-67.8	-21.9	0	0	0	112.7	R440 E474 L475 L476 Y480	R440-D478 IonicContact CZ-OD1 3.82Å; R440-D478 IonicContact NH1-OD1 2.75Å; R440-D478 PolarHBondContact NH1-OD1 3.44Å; R440-D478 IonicContact NH2-OD1 3.16Å; R440-D478 PolarHBondContact NH2-OD1 3.09Å; R440-D478 IonicContact NH2-OD2 2.85Å; E474-D478 VanDerWaalsContact O-CG 3.31Å; E474-D478 PolarHBondContact O-N 2.77Å; L475-D478 WeakPolarHBondContact O-CB 3.41Å; L475-D478 PolarHBondContact O-N 3.03Å; L476-D478 VanDerWaalsContact C-N 3.27Å; L476-D478 PolarHBondContact O-N 3.17Å; D478-Y480 PolarHBondContact O-N 3.37Å
479	G	89.9	Confident	93	Very high	25 Å²	25	51.8 Å²	51.8	26%	0.258	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	1.2	171.8	0	0	0	0	0	114.5	L476 A477 N481	L476-G479 PolarHBondContact O-N 3.31Å; A477-G479 VanDerWaalsContact C-N 3.27Å; G479-N481 PolarHBondContact O-N 2.93Å
480	Y	94	Very high	93.1	Very high	36 Å²	36	52.4 Å²	52.4	14%	0.141	25%	0.25	C	S	.	.			trans	-63.1	124.7	-179.2	176.9	-121	0	0	0	112.8	F438 L443 A477 D478 V482 S488 I489	F438-Y480 AromaticContact CD2-CE2 3.88Å; F438-Y480 HydrophobicContact CD2-CE2 3.88Å; F438-Y480 PolarHBondContact N-OH 3.45Å; L443-Y480 HydrophobicContact CD1-CD1 3.55Å; L443-Y480 HydrophobicContact CD1-CD2 4.45Å; L443-Y480 HydrophobicContact CD1-CE1 4.17Å; L443-Y480 HydrophobicContact CD1-CG 3.69Å; L443-Y480 HydrophobicContact CD2-CD1 3.93Å; L443-Y480 HydrophobicContact CD2-CD2 3.36Å; L443-Y480 HydrophobicContact CD2-CE1 4.22Å; L443-Y480 HydrophobicContact CD2-CE2 3.7Å; L443-Y480 HydrophobicContact CD2-CG 3.47Å; L443-Y480 VanDerWaalsContact CD2-CG 3.47Å; L443-Y480 HydrophobicContact CG-CD1 4.35Å; L443-Y480 HydrophobicContact CG-CG 4.24Å; A477-Y480 VanDerWaalsContact O-CB 3.26Å; A477-Y480 WeakPolarHBondContact O-CB 3.5Å; A477-Y480 PolarHBondContact O-N 3.42Å; D478-Y480 PolarHBondContact O-N 3.37Å; Y480-V482 HydrophobicContact CD1-CG2 4.27Å; Y480-V482 HydrophobicContact CE1-CB 4.42Å; Y480-V482 HydrophobicContact CE1-CG2 3.7Å; Y480-S488 WeakPolarHBondContact CD2-OG 3.43Å; Y480-I489 HydrophobicContact CD2-CD1 4.47Å; Y480-I489 HydrophobicContact CD2-CG1 4.32Å
481	N	93.1	Very high	93.1	Very high	66 Å²	66	53.2 Å²	53.2	35%	0.353	25%	0.254	S	S	.	.			trans	-110.2	116.3	170.7	-170.3	-32	0	0	0	111.1	G479 R483 Y484 G485 S488	G479-N481 PolarHBondContact O-N 2.93Å; N481-R483 PolarHBondContact O-N 3.38Å; N481-R483 VanDerWaalsContact O-N 3.07Å; N481-R483 WeakPolarHBondContact OD1-CB 3.31Å; N481-R483 PolarHBondContact OD1-N 3.25Å; N481-Y484 HydrophobicContact CB-CD2 4.09Å; N481-Y484 PolarHBondContact O-N 2.89Å; N481-G485 PolarHBondContact O-N 2.76Å; N481-S488 PolarHBondContact N-OG 3.41Å
482	V	91.5	Very high	93.2	Very high	43 Å²	43	51 Å²	51	26%	0.261	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.5	-179	179.8	0	0	0	0	113.1	S250 A371 P437 Y480	S250-V482 WeakPolarHBondContact CB-O 3.36Å; S250-V482 PolarHBondContact OG-O 2.83Å; A371-V482 HydrophobicContact CB-CG1 3.7Å; P437-V482 HydrophobicContact CB-CG1 4.11Å; P437-V482 HydrophobicContact CG-CG1 3.91Å; Y480-V482 HydrophobicContact CD1-CG2 4.27Å; Y480-V482 HydrophobicContact CE1-CB 4.42Å; Y480-V482 HydrophobicContact CE1-CG2 3.7Å
483	R	91.1	Very high	93.2	Very high	160 Å²	160	51 Å²	51	60%	0.604	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-33.6	179.9	-66.2	-176.3	170.9	179.5	-4.7	113	S251 E368 N481	S251-R483 PolarHBondContact N-O 3.18Å; E368-R483 IonicContact OE1-CZ 3.08Å; E368-R483 IonicContact OE1-NH2 3.17Å; E368-R483 PolarHBondContact OE1-NH2 2.75Å; N481-R483 PolarHBondContact O-N 3.38Å; N481-R483 VanDerWaalsContact O-N 3.07Å; N481-R483 WeakPolarHBondContact OD1-CB 3.31Å; N481-R483 PolarHBondContact OD1-N 3.25Å
484	Y	91.3	Very high	93.2	Very high	134 Å²	134	53.8 Å²	53.8	53%	0.525	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-5.7	-174.8	-57.3	-66.8	0	0	0	113.8	S251 N481 A486 R487	S251-Y484 CarbonylContact O-C 3.55Å; N481-Y484 HydrophobicContact CB-CD2 4.09Å; N481-Y484 PolarHBondContact O-N 2.89Å; Y484-A486 PolarHBondContact O-N 2.98Å; Y484-R487 WeakPolarHBondContact O-CB 3.48Å; Y484-R487 PolarHBondContact O-N 2.68Å
485	G	91.6	Very high	93.1	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	-138.8	172.9	0	0	0	0	0	111.8	S251 N481 R487 S488	S251-G485 WeakPolarHBondContact O-CA 3.42Å; S251-G485 PolarHBondContact O-N 2.86Å; N481-G485 PolarHBondContact O-N 2.76Å; G485-R487 PolarHBondContact O-N 2.87Å; G485-S488 PolarHBondContact O-N 3.34Å; G485-S488 VanDerWaalsContact O-N 3.15Å; G485-S488 PolarHBondContact O-OG 3.38Å
486	A	91.9	Very high	93	Very high	17 Å²	17	53.7 Å²	53.7	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-59.8	-27	179.7	0	0	0	0	0	113.3	G252 F438 L446 Y484 S488 I489 Q490	G252-A486 WeakPolarHBondContact O-CB 3.26Å; G252-A486 PolarHBondContact O-N 3.17Å; F438-A486 HydrophobicContact CE2-CB 4.05Å; F438-A486 HydrophobicContact CZ-CB 4.46Å; L446-A486 HydrophobicContact CD1-CB 3.53Å; L446-A486 HydrophobicContact CD2-CB 4.1Å; L446-A486 HydrophobicContact CG-CB 4.39Å; Y484-A486 PolarHBondContact O-N 2.98Å; A486-S488 PolarHBondContact O-N 3.23Å; A486-I489 WeakPolarHBondContact O-CB 3.28Å; A486-I489 PolarHBondContact O-N 3.24Å; A486-I489 VanDerWaalsContact O-N 3.08Å; A486-Q490 PolarHBondContact O-N 2.87Å
487	R	92.6	Very high	93	Very high	110 Å²	110	53.7 Å²	53.7	42%	0.415	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-33.4	178.7	-63.3	179.5	-176.5	173.5	2.6	111.5	S251 Y484 G485 I489 Q490 H491	S251-R487 PolarHBondContact OG-NH1 3.15Å; S251-R487 VanDerWaalsContact OG-NH1 3.14Å; Y484-R487 WeakPolarHBondContact O-CB 3.48Å; Y484-R487 PolarHBondContact O-N 2.68Å; G485-R487 PolarHBondContact O-N 2.87Å; R487-I489 VanDerWaalsContact C-N 3.32Å; R487-I489 PolarHBondContact O-N 3.07Å; R487-Q490 PolarHBondContact O-N 3.32Å; R487-H491 PolarHBondContact O-CD2 2.86Å; R487-H491 PolarHBondContact O-N 3.35Å
488	S	94.8	Very high	92.9	Very high	11 Å²	11	55 Å²	55	8%	0.077	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-40.9	174.6	62.8	0	0	0	0	112	Y480 N481 G485 A486 H491 E492	Y480-S488 WeakPolarHBondContact CD2-OG 3.43Å; N481-S488 PolarHBondContact N-OG 3.41Å; G485-S488 PolarHBondContact O-N 3.34Å; G485-S488 VanDerWaalsContact O-N 3.15Å; G485-S488 PolarHBondContact O-OG 3.38Å; A486-S488 PolarHBondContact O-N 3.23Å; S488-H491 PolarHBondContact O-N 2.87Å; S488-E492 WeakPolarHBondContact O-CB 3.37Å; S488-E492 PolarHBondContact O-N 3.49Å
489	I	94.8	Very high	93	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.2	-41	176.3	-62.2	-59.2	0	0	0	111.6	L443 L446 V447 L476 Y480 A486 R487 H491 E492 V493	L443-I489 HydrophobicContact CD2-CD1 4.5Å; L443-I489 HydrophobicContact CD2-CG1 4.35Å; L446-I489 HydrophobicContact CD2-CB 3.61Å; L446-I489 HydrophobicContact CD2-CG1 4.02Å; L446-I489 HydrophobicContact CD2-CG2 3.47Å; L446-I489 VanDerWaalsContact CD2-CG2 3.47Å; V447-I489 HydrophobicContact CB-CG2 4.32Å; V447-I489 HydrophobicContact CG2-CD1 4.09Å; V447-I489 HydrophobicContact CG2-CG2 3.56Å; L476-I489 WeakPolarHBondContact O-CD1 3.41Å; Y480-I489 HydrophobicContact CD2-CD1 4.47Å; Y480-I489 HydrophobicContact CD2-CG1 4.32Å; A486-I489 WeakPolarHBondContact O-CB 3.28Å; A486-I489 PolarHBondContact O-N 3.24Å; A486-I489 VanDerWaalsContact O-N 3.08Å; R487-I489 VanDerWaalsContact C-N 3.32Å; R487-I489 PolarHBondContact O-N 3.07Å; I489-H491 PolarHBondContact O-N 3.47Å; I489-E492 PolarHBondContact O-N 3.46Å; I489-V493 HydrophobicContact CG2-CG2 4.17Å; I489-V493 WeakPolarHBondContact O-CB 3.27Å; I489-V493 WeakPolarHBondContact O-CG2 3.48Å; I489-V493 PolarHBondContact O-N 3.22Å
490	Q	93.6	Very high	93	Very high	77 Å²	77	54.7 Å²	54.7	36%	0.36	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-49.9	175	-69.1	179.2	-31.1	0	0	110.9	A486 R487 E492 V493 E494	A486-Q490 PolarHBondContact O-N 2.87Å; R487-Q490 PolarHBondContact O-N 3.32Å; Q490-E492 VanDerWaalsContact C-N 3.33Å; Q490-E492 PolarHBondContact O-N 3.12Å; Q490-V493 PolarHBondContact O-N 3.04Å; Q490-E494 WeakPolarHBondContact O-CB 2.99Å; Q490-E494 VanDerWaalsContact O-CG 3.3Å; Q490-E494 WeakPolarHBondContact O-CG 3.43Å; Q490-E494 PolarHBondContact O-N 2.73Å
491	H	94.2	Very high	92.9	Very high	117 Å²	117	54.2 Å²	54.2	54%	0.542	26%	0.264	S	S	.	.	H	α-helix	trans	-62.2	-38.9	176	-70.8	-51.8	0	0	0	112.8	R487 S488 I489 E494 S495	R487-H491 PolarHBondContact O-CD2 2.86Å; R487-H491 PolarHBondContact O-N 3.35Å; S488-H491 PolarHBondContact O-N 2.87Å; I489-H491 PolarHBondContact O-N 3.47Å; H491-E494 IonicContact ND1-OE2 3.93Å; H491-E494 PolarHBondContact O-N 3.45Å; H491-S495 WeakPolarHBondContact O-CB 3.2Å; H491-S495 PolarHBondContact O-N 2.98Å
492	E	94.1	Very high	92.8	Very high	47 Å²	47	53.8 Å²	53.8	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-45.2	178.3	-165.6	63	-150.7	0	0	111.6	L476 S488 I489 Q490 S495 Q496	L476-E492 HydrophobicContact CD2-CG 3.97Å; S488-E492 WeakPolarHBondContact O-CB 3.37Å; S488-E492 PolarHBondContact O-N 3.49Å; I489-E492 PolarHBondContact O-N 3.46Å; Q490-E492 VanDerWaalsContact C-N 3.33Å; Q490-E492 PolarHBondContact O-N 3.12Å; E492-S495 PolarHBondContact O-N 3.49Å; E492-Q496 WeakPolarHBondContact O-CB 3.17Å; E492-Q496 PolarHBondContact O-N 3.18Å; E492-Q496 WeakPolarHBondContact OE1-CG 3.21Å; E492-Q496 PolarHBondContact OE1-NE2 3.4Å
493	V	95	Very high	92.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-44.2	176	175	0	0	0	0	110.5	E450 L451 L476 I489 Q490 V497 V498	E450-V493 HydrophobicContact CB-CG2 4.29Å; E450-V493 HydrophobicContact CG-CB 3.99Å; E450-V493 HydrophobicContact CG-CG1 3.97Å; E450-V493 HydrophobicContact CG-CG2 3.94Å; L451-V493 HydrophobicContact CD2-CG1 3.83Å; L476-V493 HydrophobicContact CD1-CG2 4.04Å; I489-V493 HydrophobicContact CG2-CG2 4.17Å; I489-V493 WeakPolarHBondContact O-CB 3.27Å; I489-V493 WeakPolarHBondContact O-CG2 3.48Å; I489-V493 PolarHBondContact O-N 3.22Å; Q490-V493 PolarHBondContact O-N 3.04Å; V493-V497 HydrophobicContact CG1-CB 4.37Å; V493-V497 HydrophobicContact CG1-CG2 4.38Å; V493-V497 WeakPolarHBondContact O-CA 3.17Å; V493-V497 WeakPolarHBondContact O-CB 3.16Å; V493-V497 PolarHBondContact O-N 3.29Å; V493-V498 PolarHBondContact O-N 3.26Å; V493-V498 VanDerWaalsContact O-N 3.15Å
494	E	94.5	Very high	92.6	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	25%	0.248	S	C	.	.	I	π-helix	trans	-62.1	-44.3	177	-75.9	179.8	165.2	0	0	112.1	W454 Q490 H491 V498 S499	W454-E494 HydrophobicContact CZ2-CG 4.02Å; Q490-E494 WeakPolarHBondContact O-CB 2.99Å; Q490-E494 VanDerWaalsContact O-CG 3.3Å; Q490-E494 WeakPolarHBondContact O-CG 3.43Å; Q490-E494 PolarHBondContact O-N 2.73Å; H491-E494 IonicContact ND1-OE2 3.93Å; H491-E494 PolarHBondContact O-N 3.45Å; E494-V498 HydrophobicContact CG-CG2 4.34Å; E494-V498 WeakPolarHBondContact O-CB 3.26Å; E494-V498 PolarHBondContact O-N 2.67Å; E494-S499 PolarHBondContact O-N 3.04Å; E494-S499 PolarHBondContact O-OG 2.94Å
495	S	92.8	Very high	92.3	Very high	78 Å²	78	44.3 Å²	44.3	55%	0.545	24%	0.242	S	C	.	.	I	π-helix	trans	-68.4	-50.4	-179.3	-175.1	0	0	0	0	112.1	H491 E492 S499	H491-S495 WeakPolarHBondContact O-CB 3.2Å; H491-S495 PolarHBondContact O-N 2.98Å; E492-S495 PolarHBondContact O-N 3.49Å; S495-S499 WeakPolarHBondContact O-CB 3.44Å
496	Q	91.6	Very high	92.1	Very high	25 Å²	25	51.6 Å²	51.6	12%	0.117	28%	0.276	C	S	.	.	I	π-helix	trans	-84.4	-31.8	-174.2	-68.6	-143	37.5	0	0	114.2	L476 E492 K500 V531	L476-Q496 HydrophobicContact CD2-CB 4.01Å; L476-Q496 HydrophobicContact CD2-CG 4.43Å; E492-Q496 WeakPolarHBondContact O-CB 3.17Å; E492-Q496 PolarHBondContact O-N 3.18Å; E492-Q496 WeakPolarHBondContact OE1-CG 3.21Å; E492-Q496 PolarHBondContact OE1-NE2 3.4Å; Q496-K500 WeakPolarHBondContact O-CD 3.46Å; Q496-K500 VanDerWaalsContact O-CG 3.27Å; Q496-K500 WeakPolarHBondContact O-CG 3.41Å; Q496-V531 HydrophobicContact CB-CB 4.41Å; Q496-V531 HydrophobicContact CB-CG2 4.07Å; Q496-V531 VanDerWaalsContact OE1-N 3.12Å
497	V	93.3	Very high	91.8	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.298	C	S	.	.	I	π-helix	trans	-105.8	-61.1	-173.7	-173.2	0	0	0	0	110.6	L451 L476 V493 S499 K500 L501 L518 V531	L451-V497 HydrophobicContact CD2-CG1 4.39Å; L451-V497 HydrophobicContact CD2-CG2 4.15Å; L476-V497 HydrophobicContact CD1-CG2 4.1Å; L476-V497 HydrophobicContact CD2-CG2 4.34Å; V493-V497 HydrophobicContact CG1-CB 4.37Å; V493-V497 HydrophobicContact CG1-CG2 4.38Å; V493-V497 WeakPolarHBondContact O-CA 3.17Å; V493-V497 WeakPolarHBondContact O-CB 3.16Å; V493-V497 PolarHBondContact O-N 3.29Å; V497-S499 PolarHBondContact O-N 3.07Å; V497-K500 PolarHBondContact O-N 3.46Å; V497-L501 HydrophobicContact CG1-CD1 3.9Å; V497-L501 HydrophobicContact CG1-CG 4.43Å; V497-L501 WeakPolarHBondContact O-CG 3.33Å; V497-L501 PolarHBondContact O-N 2.99Å; V497-L518 HydrophobicContact CG1-CD1 3.58Å; V497-L518 HydrophobicContact CG1-CD2 3.96Å; V497-L518 HydrophobicContact CG1-CG 4.45Å; V497-L518 HydrophobicContact CG2-CD1 4.21Å; V497-V531 HydrophobicContact CG2-CG1 4.36Å; V497-V531 HydrophobicContact CG2-CG2 4.32Å
498	V	93.1	Very high	91.2	Very high	28 Å²	28	56.9 Å²	56.9	17%	0.17	31%	0.314	C	S	.	.	I	π-helix	trans	-64.8	-41.1	-171.8	-177.5	0	0	0	0	111.3	W454 V493 E494 K500 L501 A502	W454-V498 HydrophobicContact CD2-CG2 3.49Å; W454-V498 VanDerWaalsContact CD2-CG2 3.49Å; W454-V498 VanDerWaalsContact CE2-CG2 3.5Å; W454-V498 HydrophobicContact CE3-CG1 4.2Å; W454-V498 HydrophobicContact CE3-CG2 3.8Å; W454-V498 HydrophobicContact CG-CG2 3.93Å; W454-V498 HydrophobicContact CH2-CG1 3.83Å; W454-V498 HydrophobicContact CH2-CG2 4.07Å; W454-V498 HydrophobicContact CZ2-CG1 4.36Å; W454-V498 HydrophobicContact CZ2-CG2 3.82Å; W454-V498 HydrophobicContact CZ3-CG1 3.74Å; W454-V498 HydrophobicContact CZ3-CG2 4.06Å; V493-V498 PolarHBondContact O-N 3.26Å; V493-V498 VanDerWaalsContact O-N 3.15Å; E494-V498 HydrophobicContact CG-CG2 4.34Å; E494-V498 WeakPolarHBondContact O-CB 3.26Å; E494-V498 PolarHBondContact O-N 2.67Å; V498-K500 VanDerWaalsContact C-N 3.35Å; V498-K500 PolarHBondContact O-N 3.18Å; V498-L501 PolarHBondContact O-N 2.95Å; V498-A502 WeakPolarHBondContact O-CB 3.49Å; V498-A502 PolarHBondContact O-N 2.96Å
499	S	93.3	Very high	90.3	Very high	67 Å²	67	61.5 Å²	61.5	47%	0.469	34%	0.338	S	S	.	.	H	α-helix	trans	-65.4	-38.3	178.7	-56.4	0	0	0	0	111.7	E494 S495 V497 A502 A503	E494-S499 PolarHBondContact O-N 3.04Å; E494-S499 PolarHBondContact O-OG 2.94Å; S495-S499 WeakPolarHBondContact O-CB 3.44Å; V497-S499 PolarHBondContact O-N 3.07Å; S499-A502 PolarHBondContact O-N 3.26Å; S499-A503 WeakPolarHBondContact O-CB 3.36Å; S499-A503 PolarHBondContact O-N 2.69Å
500	K	91.6	Very high	89.3	Confident	57 Å²	57	62 Å²	62	25%	0.248	34%	0.34	C	S	.	.	H	α-helix	trans	-68.1	-39.5	174	-64	-169.1	-173.2	-165.9	0	111.6	Q496 V497 V498 A503 A504 E530 V531 L533	Q496-K500 WeakPolarHBondContact O-CD 3.46Å; Q496-K500 VanDerWaalsContact O-CG 3.27Å; Q496-K500 WeakPolarHBondContact O-CG 3.41Å; V497-K500 PolarHBondContact O-N 3.46Å; V498-K500 VanDerWaalsContact C-N 3.35Å; V498-K500 PolarHBondContact O-N 3.18Å; K500-A503 PolarHBondContact O-N 3.31Å; K500-A504 WeakPolarHBondContact O-CB 3.43Å; K500-A504 PolarHBondContact O-N 2.75Å; K500-E530 IonicContact NZ-OE2 3.02Å; K500-E530 PolarHBondContact NZ-OE2 3.14Å; K500-V531 WeakPolarHBondContact CD-O 3.35Å; K500-V531 WeakPolarHBondContact CE-O 3.43Å; K500-V531 PolarHBondContact NZ-O 3.39Å; K500-L533 HydrophobicContact CB-CD1 3.88Å; K500-L533 HydrophobicContact CB-CG 4.14Å; K500-L533 WeakPolarHBondContact O-CD1 3.33Å
501	L	91	Very high	88.4	Confident	26 Å²	26	59.4 Å²	59.4	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-63.8	-43.2	174.6	-72	171.9	0	0	0	111.2	L466 V497 V498 A504 H505 M510 V516 L533	L466-L501 HydrophobicContact CD1-CD1 4.23Å; L466-L501 HydrophobicContact CD1-CD2 4.31Å; L466-L501 HydrophobicContact CD2-CD1 4.41Å; V497-L501 HydrophobicContact CG1-CD1 3.9Å; V497-L501 HydrophobicContact CG1-CG 4.43Å; V497-L501 WeakPolarHBondContact O-CG 3.33Å; V497-L501 PolarHBondContact O-N 2.99Å; V498-L501 PolarHBondContact O-N 2.95Å; L501-A504 PolarHBondContact O-N 3.28Å; L501-H505 VanDerWaalsContact O-CB 3.32Å; L501-H505 WeakPolarHBondContact O-CB 3.38Å; L501-H505 PolarHBondContact O-N 2.85Å; L501-M510 HydrophobicContact CB-CE 4.25Å; L501-M510 HydrophobicContact CD2-CE 3.94Å; L501-M510 HydrophobicContact CD2-SD 3.87Å; L501-M510 WeakPolarHBondContact O-CE 3.4Å; L501-V516 HydrophobicContact CD2-CG1 4.03Å; L501-L533 HydrophobicContact CD2-CD1 3.89Å; L501-L533 HydrophobicContact CD2-CD2 4Å; L501-L533 HydrophobicContact CG-CD1 4.31Å; L501-L533 HydrophobicContact CG-CD2 4.31Å
502	A	90.8	Very high	87.6	Confident	57 Å²	57	58.1 Å²	58.1	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-47.3	176.6	0	0	0	0	0	111.3	V498 S499 H505 E506	V498-A502 WeakPolarHBondContact O-CB 3.49Å; V498-A502 PolarHBondContact O-N 2.96Å; S499-A502 PolarHBondContact O-N 3.26Å; A502-H505 PolarHBondContact O-N 3.33Å; A502-E506 PolarHBondContact O-N 2.89Å
503	A	90.3	Very high	87	Confident	41 Å²	41	58.3 Å²	58.3	34%	0.339	35%	0.351	S	S	.	.	H	α-helix	trans	-61.2	-45.7	177.1	0	0	0	0	0	112.2	S499 K500 H505 E506 H507	S499-A503 WeakPolarHBondContact O-CB 3.36Å; S499-A503 PolarHBondContact O-N 2.69Å; K500-A503 PolarHBondContact O-N 3.31Å; A503-H505 VanDerWaalsContact C-N 3.3Å; A503-H505 PolarHBondContact O-N 3.32Å; A503-E506 PolarHBondContact O-N 2.8Å; A503-H507 PolarHBondContact O-N 3.2Å; A503-H507 VanDerWaalsContact O-N 3.07Å; A503-H507 PolarHBondContact O-ND1 2.69Å
504	A	87.7	Confident	86.5	Confident	9 Å²	9	59 Å²	59	7%	0.074	36%	0.355	C	S	.	.	H	α-helix	trans	-67.4	-30.2	178.2	0	0	0	0	0	112.8	K500 L501 S508 L509 M510 L533 I535	K500-A504 WeakPolarHBondContact O-CB 3.43Å; K500-A504 PolarHBondContact O-N 2.75Å; L501-A504 PolarHBondContact O-N 3.28Å; A504-S508 PolarHBondContact O-N 2.92Å; A504-L509 HydrophobicContact CB-CB 4.31Å; A504-L509 HydrophobicContact CB-CD1 4.25Å; A504-L509 WeakPolarHBondContact O-CB 3.38Å; A504-L509 PolarHBondContact O-N 3.39Å; A504-M510 HydrophobicContact CB-CE 3.54Å; A504-M510 HydrophobicContact CB-CG 4.37Å; A504-M510 HydrophobicContact CB-SD 4.23Å; A504-L533 HydrophobicContact CB-CD1 4.05Å; A504-I535 HydrophobicContact CB-CD1 4.39Å
505	H	85.4	Confident	86.3	Confident	87 Å²	87	60.8 Å²	60.8	40%	0.403	36%	0.359	S	S	.	.	H	α-helix	trans	-70.2	-41.6	173.5	-177.9	-91	0	0	0	111.5	H462 L501 A502 A503 H507 S508 M510	H462-H505 AromaticContact ND1-NE2 3.53Å; L501-H505 VanDerWaalsContact O-CB 3.32Å; L501-H505 WeakPolarHBondContact O-CB 3.38Å; L501-H505 PolarHBondContact O-N 2.85Å; A502-H505 PolarHBondContact O-N 3.33Å; A503-H505 VanDerWaalsContact C-N 3.3Å; A503-H505 PolarHBondContact O-N 3.32Å; H505-H507 VanDerWaalsContact C-N 3.34Å; H505-H507 PolarHBondContact O-N 3.42Å; H505-S508 PolarHBondContact O-N 3.48Å; H505-M510 HydrophobicContact CB-CE 4.01Å
506	E	87	Confident	86.2	Confident	153 Å²	153	57 Å²	57	72%	0.715	33%	0.333	S	S	*	.	H	α-helix	trans	-59.3	-43.1	174.6	-175.5	177.4	-172.6	0	0	112	A502 A503 S508	A502-E506 PolarHBondContact O-N 2.89Å; A503-E506 PolarHBondContact O-N 2.8Å; E506-S508 PolarHBondContact O-N 3.41Å; E506-S508 VanDerWaalsContact O-N 3.1Å
507	H	86.3	Confident	86.2	Confident	132 Å²	132	58.2 Å²	58.2	61%	0.611	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	8.5	175.6	-66.5	82.5	0	0	0	113.7	A503 H505 L509	A503-H507 PolarHBondContact O-N 3.2Å; A503-H507 VanDerWaalsContact O-N 3.07Å; A503-H507 PolarHBondContact O-ND1 2.69Å; H505-H507 VanDerWaalsContact C-N 3.34Å; H505-H507 PolarHBondContact O-N 3.42Å; H507-L509 HydrophobicContact CB-CD1 4.15Å; H507-L509 HydrophobicContact CB-CG 4Å; H507-L509 PolarHBondContact O-N 2.89Å; H507-L509 VanDerWaalsContact O-N 3.11Å
508	S	79	Confident	86.2	Confident	107 Å²	107	58.2 Å²	58.2	75%	0.748	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	25.5	-178.8	-57.7	0	0	0	0	114.3	A504 H505 E506 M510	A504-S508 PolarHBondContact O-N 2.92Å; H505-S508 PolarHBondContact O-N 3.48Å; E506-S508 PolarHBondContact O-N 3.41Å; E506-S508 VanDerWaalsContact O-N 3.1Å; S508-M510 VanDerWaalsContact C-N 3.26Å
509	L	77.3	Confident	86.2	Confident	108 Å²	108	60.2 Å²	60.2	57%	0.565	35%	0.345	S	S	*	.			trans	-76.3	-17.9	176.4	-61.8	172.6	0	0	0	112	A504 H507 I535	A504-L509 HydrophobicContact CB-CB 4.31Å; A504-L509 HydrophobicContact CB-CD1 4.25Å; A504-L509 WeakPolarHBondContact O-CB 3.38Å; A504-L509 PolarHBondContact O-N 3.39Å; H507-L509 HydrophobicContact CB-CD1 4.15Å; H507-L509 HydrophobicContact CB-CG 4Å; H507-L509 PolarHBondContact O-N 2.89Å; H507-L509 VanDerWaalsContact O-N 3.11Å; L509-I535 HydrophobicContact CB-CD1 4Å
510	M	74.4	Confident	86	Confident	9 Å²	9	59.1 Å²	59.1	4%	0.044	34%	0.335	C	S	.	.			trans	-125.2	128.7	180	-60	-175	-65.2	0	0	110.3	I464 L501 A504 H505 S508 V516 I535	I464-M510 HydrophobicContact CD1-CB 4.07Å; L501-M510 HydrophobicContact CB-CE 4.25Å; L501-M510 HydrophobicContact CD2-CE 3.94Å; L501-M510 HydrophobicContact CD2-SD 3.87Å; L501-M510 WeakPolarHBondContact O-CE 3.4Å; A504-M510 HydrophobicContact CB-CE 3.54Å; A504-M510 HydrophobicContact CB-CG 4.37Å; A504-M510 HydrophobicContact CB-SD 4.23Å; H505-M510 HydrophobicContact CB-CE 4.01Å; S508-M510 VanDerWaalsContact C-N 3.26Å; M510-V516 HydrophobicContact CG-CG2 4.31Å; M510-V516 HydrophobicContact SD-CG2 3.5Å; M510-V516 WeakPolarHBondContact SD-CG2 3.33Å; M510-I535 HydrophobicContact CG-CD1 3.66Å; M510-I535 HydrophobicContact CG-CG1 4.24Å; M510-I535 HydrophobicContact CG-CG2 4.29Å; M510-I535 HydrophobicContact SD-CD1 4.19Å; M510-I535 HydrophobicContact SD-CG1 4.49Å
511	G	73.3	Confident	85.8	Confident	23 Å²	23	62.3 Å²	62.3	24%	0.237	35%	0.349	C	S	.	.			trans	-126.6	178.3	175.5	0	0	0	0	0	112.4	G513 C514	G511-G513 PolarHBondContact O-N 2.91Å; G511-C514 PolarHBondContact N-SG 3.02Å; G511-C514 WeakPolarHBondContact O-CB 3.32Å; G511-C514 PolarHBondContact O-N 3.38Å; G511-C514 PolarHBondContact O-SG 3.31Å; G511-C514 VanDerWaalsContact O-SG 3.35Å
512	P	78.2	Confident	85.4	Confident	90 Å²	90	67.5 Å²	67.5	58%	0.584	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	127.8	177.3	-22.6	33.2	0	0	0	111.7	R463	R463-P512 HydrophobicContact CB-CB 4.24Å
513	G	80.6	Confident	84.8	Confident	52 Å²	52	66.9 Å²	66.9	54%	0.536	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	6	-178.9	0	0	0	0	0	115.2	R463 G511	R463-G513 WeakPolarHBondContact O-CA 3.48Å; R463-G513 PolarHBondContact O-N 3.34Å; G511-G513 PolarHBondContact O-N 2.91Å
514	C	85.8	Confident	83.7	Confident	13 Å²	13	69.9 Å²	69.9	9%	0.088	38%	0.379	C	S	.	.			trans	-72.1	144	172	-73.4	0	0	0	0	111.6	I464 E465 G511	I464-C514 WeakPolarHBondContact CA-O 3.39Å; E465-C514 PolarHBondContact N-O 3.16Å; G511-C514 PolarHBondContact N-SG 3.02Å; G511-C514 WeakPolarHBondContact O-CB 3.32Å; G511-C514 PolarHBondContact O-N 3.38Å; G511-C514 PolarHBondContact O-SG 3.31Å; G511-C514 VanDerWaalsContact O-SG 3.35Å
515	R	88.5	Confident	82.9	Confident	114 Å²	114	78 Å²	78	43%	0.43	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.3	167	179	-177.6	-85.2	-163.6	-11.9	108.9	E465 D536	E465-R515 HydrophobicContact CB-CB 4.36Å; E465-R515 HydrophobicContact CB-CG 4.39Å; E465-R515 VanDerWaalsContact CD-NH2 3.3Å; E465-R515 HydrophobicContact CG-CG 4.49Å; E465-R515 CarbonylContact O-C 3.55Å; E465-R515 WeakPolarHBondContact O-CA 3.48Å; E465-R515 IonicContact OE1-CZ 3.27Å; E465-R515 IonicContact OE1-NE 3.64Å; E465-R515 PolarHBondContact OE1-NE 2.73Å; E465-R515 IonicContact OE1-NH2 3.47Å; E465-R515 PolarHBondContact OE1-NH2 3.1Å; E465-R515 IonicContact OE2-CZ 2.73Å; E465-R515 IonicContact OE2-NE 3.35Å; E465-R515 PolarHBondContact OE2-NE 2.94Å; E465-R515 IonicContact OE2-NH2 3.64Å; E465-R515 PolarHBondContact OE2-NH2 3.33Å; E465-R515 VanDerWaalsContact OE2-NH2 3.11Å; R515-D536 HydrophobicContact CB-CB 4.19Å; R515-D536 PolarHBondContact N-O 2.93Å; R515-D536 PolarHBondContact O-N 3.43Å
516	V	91.1	Very high	82.2	Confident	0 Å²	0	76 Å²	76	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	122.1	178.5	-175.9	0	0	0	0	108.3	I464 E465 L466 T467 L501 M510 L533 D534 I535	I464-V516 HydrophobicContact CG2-CB 4.44Å; I464-V516 HydrophobicContact CG2-CG2 3.68Å; E465-V516 PolarHBondContact O-N 2.66Å; L466-V516 HydrophobicContact CD1-CB 4.11Å; L466-V516 HydrophobicContact CD1-CG1 4.16Å; T467-V516 PolarHBondContact N-O 2.95Å; T467-V516 PolarHBondContact OG1-O 3.49Å; L501-V516 HydrophobicContact CD2-CG1 4.03Å; M510-V516 HydrophobicContact CG-CG2 4.31Å; M510-V516 HydrophobicContact SD-CG2 3.5Å; M510-V516 WeakPolarHBondContact SD-CG2 3.33Å; V516-L533 HydrophobicContact CG1-CB 4.16Å; V516-L533 HydrophobicContact CG1-CD2 4.11Å; V516-D534 WeakPolarHBondContact CA-O 3.34Å; V516-I535 HydrophobicContact CG2-CG1 4.43Å
517	Q	92.7	Very high	81.5	Confident	49 Å²	49	77.2 Å²	77.2	23%	0.229	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.5	173.3	-169.6	178	16.6	0	0	109.7	T467 N469 K519 D534	T467-Q517 CarbonylContact O-C 3.58Å; T467-Q517 WeakPolarHBondContact O-CA 3.37Å; T467-Q517 WeakPolarHBondContact OG1-CA 3.37Å; N469-Q517 PolarHBondContact OD1-NE2 3.25Å; N469-Q517 VanDerWaalsContact OD1-NE2 3.07Å; Q517-K519 HydrophobicContact CG-CG 4.29Å; Q517-D534 HydrophobicContact CB-CB 4.35Å; Q517-D534 PolarHBondContact N-O 3.45Å; Q517-D534 PolarHBondContact O-N 2.91Å
518	L	92.9	Very high	81.2	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	123.9	171.6	-53.8	-177.9	0	0	0	108.9	L451 L466 T467 W468 V472 V497 V531 L533	L451-L518 HydrophobicContact CD2-CD1 4.14Å; L466-L518 HydrophobicContact CD1-CD1 4.19Å; L466-L518 HydrophobicContact CD1-CD2 3.92Å; L466-L518 HydrophobicContact CD1-CG 3.93Å; L466-L518 HydrophobicContact CD2-CD1 4.46Å; L466-L518 HydrophobicContact CG-CD1 4.42Å; T467-L518 PolarHBondContact O-N 2.89Å; W468-L518 HydrophobicContact CB-CB 3.84Å; W468-L518 HydrophobicContact CB-CD1 4.1Å; W468-L518 HydrophobicContact CB-CG 4.27Å; V472-L518 HydrophobicContact CG1-CB 4.2Å; V472-L518 HydrophobicContact CG1-CD1 4.39Å; V472-L518 HydrophobicContact CG2-CB 4Å; V472-L518 WeakPolarHBondContact CG2-O 3.43Å; V497-L518 HydrophobicContact CG1-CD1 3.58Å; V497-L518 HydrophobicContact CG1-CD2 3.96Å; V497-L518 HydrophobicContact CG1-CG 4.45Å; V497-L518 HydrophobicContact CG2-CD1 4.21Å; L518-V531 HydrophobicContact CB-CG1 4.01Å; L518-V531 HydrophobicContact CD2-CG1 4.05Å; L518-V531 HydrophobicContact CG-CG1 4.46Å; L518-L533 HydrophobicContact CD2-CD2 3.18Å
519	K	92	Very high	81.5	Confident	71 Å²	71	77.9 Å²	77.9	31%	0.309	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	154.5	175.9	-67.3	-179.2	-179.6	169.3	0	109.8	Q517 V531 H532 D534	Q517-K519 HydrophobicContact CG-CG 4.29Å; K519-V531 CarbonylContact O-C 3.55Å; K519-V531 WeakPolarHBondContact O-CA 3.3Å; K519-H532 PolarHBondContact N-O 2.93Å; K519-H532 PolarHBondContact O-N 3.38Å; K519-D534 HydrophobicContact CD-CB 4.19Å; K519-D534 WeakPolarHBondContact CE-OD2 3.45Å; K519-D534 IonicContact NZ-OD2 3.86Å; K519-D534 PolarHBondContact NZ-OD2 2.94Å
520	V	90.8	Very high	82	Confident	43 Å²	43	76.5 Å²	76.5	26%	0.261	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133	170.9	177.9	0	0	0	0	108.8	D471 V472 L475 K529	D471-V520 HydrophobicContact CB-CB 4.3Å; D471-V520 HydrophobicContact CB-CG2 3.76Å; D471-V520 WeakPolarHBondContact O-CG2 3.42Å; V472-V520 HydrophobicContact CB-CG2 4.49Å; V472-V520 HydrophobicContact CG2-CG2 3.95Å; L475-V520 HydrophobicContact CB-CG2 4.15Å; L475-V520 HydrophobicContact CD2-CG1 4.03Å; L475-V520 HydrophobicContact CD2-CG2 3.95Å; V520-K529 HydrophobicContact CG1-CB 3.92Å; V520-K529 HydrophobicContact CG1-CD 4.21Å; V520-K529 HydrophobicContact CG1-CG 4.26Å
521	K	87.5	Confident	82.7	Confident	124 Å²	124	76 Å²	76	54%	0.539	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.2	173.1	-166.5	177.6	180	179.9	0	109.2	E530 H532	K521-E530 PolarHBondContact N-O 3.21Å; K521-E530 PolarHBondContact O-N 3.08Å; K521-H532 HydrophobicContact CB-CB 3.96Å
522	E	82.4	Confident	83.5	Confident	136 Å²	136	79.4 Å²	79.4	64%	0.636	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.8	170.7	-71.4	174.9	177.5	0	0	109.2	K529	E522-K529 HydrophobicContact CG-CG 4.01Å
523	V	77.7	Confident	84	Confident	43 Å²	43	76.2 Å²	76.2	26%	0.261	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-74.9	126.1	178.4	177.5	0	0	0	0	108.2	D525 S526 K528 E530	V523-D525 PolarHBondContact O-N 3.45Å; V523-S526 WeakPolarHBondContact CB-OG 3.46Å; V523-S526 PolarHBondContact O-N 3.3Å; V523-K528 WeakPolarHBondContact CG2-O 3.47Å; V523-K528 PolarHBondContact N-O 3.13Å; V523-E530 HydrophobicContact CG2-CB 3.98Å; V523-E530 VanDerWaalsContact CG2-CD 3.49Å; V523-E530 HydrophobicContact CG2-CG 3.53Å
524	P	68.1	Low	84.4	Confident	105 Å²	105	76.5 Å²	76.5	68%	0.682	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	136.3	175.4	-21.5	31.4	0	0	0	110.9	S526	P524-S526 VanDerWaalsContact C-N 3.3Å; P524-S526 PolarHBondContact O-N 3.05Å
525	D	69.9	Low	84.3	Confident	178 Å²	178	77.9 Å²	77.9	95%	0.952	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	17.4	179.9	-53.8	-35.5	0	0	0	116.5	V523	V523-D525 PolarHBondContact O-N 3.45Å
526	S	70.5	Confident	84	Confident	46 Å²	46	76.1 Å²	76.1	32%	0.322	39%	0.386	S	S	.	.	S	Bend	trans	-144.9	150.1	168.4	75.6	0	0	0	0	112.8	V523 P524 K528	V523-S526 WeakPolarHBondContact CB-OG 3.46Å; V523-S526 PolarHBondContact O-N 3.3Å; P524-S526 VanDerWaalsContact C-N 3.3Å; P524-S526 PolarHBondContact O-N 3.05Å; S526-K528 PolarHBondContact O-N 2.95Å; S526-K528 WeakPolarHBondContact OG-CB 3.49Å; S526-K528 PolarHBondContact OG-N 3.49Å
527	D	72.8	Confident	82.6	Confident	178 Å²	178	77.8 Å²	77.8	95%	0.952	40%	0.397	S	S	*	.	S	Bend	trans	-70.5	14.6	171.4	-68.2	-28.8	0	0	0	113.1
528	K	80.1	Confident	80.7	Confident	144 Å²	144	84.8 Å²	84.8	63%	0.626	43%	0.427	S	S	*	.			trans	-92.9	131.4	-176.4	-63.7	-175.7	178.7	180	0	110.9	V523 S526	V523-K528 WeakPolarHBondContact CG2-O 3.47Å; V523-K528 PolarHBondContact N-O 3.13Å; S526-K528 PolarHBondContact O-N 2.95Å; S526-K528 WeakPolarHBondContact OG-CB 3.49Å; S526-K528 PolarHBondContact OG-N 3.49Å
529	K	84.4	Confident	78.5	Confident	109 Å²	109	87.9 Å²	87.9	47%	0.474	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.9	169.4	-69.6	179	-177.4	-177	0	108.9	L475 V520 E522	L475-K529 HydrophobicContact CD1-CB 3.55Å; L475-K529 HydrophobicContact CD2-CB 4.23Å; V520-K529 HydrophobicContact CG1-CB 3.92Å; V520-K529 HydrophobicContact CG1-CD 4.21Å; V520-K529 HydrophobicContact CG1-CG 4.26Å; E522-K529 HydrophobicContact CG-CG 4.01Å
530	E	88.8	Confident	76.4	Confident	79 Å²	79	91.2 Å²	91.2	37%	0.369	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154	177.2	-74.9	-170.7	-166.4	0	0	111.8	K500 K521 V523	K500-E530 IonicContact NZ-OE2 3.02Å; K500-E530 PolarHBondContact NZ-OE2 3.14Å; K521-E530 PolarHBondContact N-O 3.21Å; K521-E530 PolarHBondContact O-N 3.08Å; V523-E530 HydrophobicContact CG2-CB 3.98Å; V523-E530 VanDerWaalsContact CG2-CD 3.49Å; V523-E530 HydrophobicContact CG2-CG 3.53Å
531	V	89.1	Confident	74.2	Confident	0 Å²	0	96 Å²	96	0%	0	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	128.9	170	-174.9	0	0	0	0	110.2	V472 L475 L476 Q496 V497 K500 L518 K519	V472-V531 HydrophobicContact CG1-CG1 4.48Å; V472-V531 HydrophobicContact CG1-CG2 4.14Å; L475-V531 HydrophobicContact CD2-CG2 4.01Å; L476-V531 HydrophobicContact CD2-CG2 4.25Å; Q496-V531 HydrophobicContact CB-CB 4.41Å; Q496-V531 HydrophobicContact CB-CG2 4.07Å; Q496-V531 VanDerWaalsContact OE1-N 3.12Å; V497-V531 HydrophobicContact CG2-CG1 4.36Å; V497-V531 HydrophobicContact CG2-CG2 4.32Å; K500-V531 WeakPolarHBondContact CD-O 3.35Å; K500-V531 WeakPolarHBondContact CE-O 3.43Å; K500-V531 PolarHBondContact NZ-O 3.39Å; L518-V531 HydrophobicContact CB-CG1 4.01Å; L518-V531 HydrophobicContact CD2-CG1 4.05Å; L518-V531 HydrophobicContact CG-CG1 4.46Å; K519-V531 CarbonylContact O-C 3.55Å; K519-V531 WeakPolarHBondContact O-CA 3.3Å
532	H	90	Very high	72.2	Confident	94 Å²	94	92 Å²	92	44%	0.435	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	143.4	172.5	-173.9	66.6	0	0	0	110.3	K519 K521	K519-H532 PolarHBondContact N-O 2.93Å; K519-H532 PolarHBondContact O-N 3.38Å; K521-H532 HydrophobicContact CB-CB 3.96Å
533	L	88.5	Confident	70.2	Confident	22 Å²	22	89.9 Å²	89.9	12%	0.115	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	113.2	178	-54	-177.3	0	0	0	109.4	K500 L501 A504 V516 L518 I535	K500-L533 HydrophobicContact CB-CD1 3.88Å; K500-L533 HydrophobicContact CB-CG 4.14Å; K500-L533 WeakPolarHBondContact O-CD1 3.33Å; L501-L533 HydrophobicContact CD2-CD1 3.89Å; L501-L533 HydrophobicContact CD2-CD2 4Å; L501-L533 HydrophobicContact CG-CD1 4.31Å; L501-L533 HydrophobicContact CG-CD2 4.31Å; A504-L533 HydrophobicContact CB-CD1 4.05Å; V516-L533 HydrophobicContact CG1-CB 4.16Å; V516-L533 HydrophobicContact CG1-CD2 4.11Å; L518-L533 HydrophobicContact CD2-CD2 3.18Å; L533-I535 HydrophobicContact CB-CG1 4.43Å
534	D	88.1	Confident	68.8	Low	59 Å²	59	93.1 Å²	93.1	32%	0.316	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.7	168.3	-165.1	5.9	0	0	0	109	V516 Q517 K519	V516-D534 WeakPolarHBondContact CA-O 3.34Å; Q517-D534 HydrophobicContact CB-CB 4.35Å; Q517-D534 PolarHBondContact N-O 3.45Å; Q517-D534 PolarHBondContact O-N 2.91Å; K519-D534 HydrophobicContact CD-CB 4.19Å; K519-D534 WeakPolarHBondContact CE-OD2 3.45Å; K519-D534 IonicContact NZ-OD2 3.86Å; K519-D534 PolarHBondContact NZ-OD2 2.94Å
535	I	85.2	Confident	67.8	Low	41 Å²	41	93.8 Å²	93.8	21%	0.21	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	102.4	-170.7	-56.7	168.6	0	0	0	109.2	A504 L509 M510 V516 L533 S537	A504-I535 HydrophobicContact CB-CD1 4.39Å; L509-I535 HydrophobicContact CB-CD1 4Å; M510-I535 HydrophobicContact CG-CD1 3.66Å; M510-I535 HydrophobicContact CG-CG1 4.24Å; M510-I535 HydrophobicContact CG-CG2 4.29Å; M510-I535 HydrophobicContact SD-CD1 4.19Å; M510-I535 HydrophobicContact SD-CG1 4.49Å; V516-I535 HydrophobicContact CG2-CG1 4.43Å; L533-I535 HydrophobicContact CB-CG1 4.43Å; I535-S537 PolarHBondContact O-N 3.33Å
536	D	80.7	Confident	66.5	Low	78 Å²	78	93.4 Å²	93.4	42%	0.417	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	93.1	172.1	-89	-15.1	0	0	0	109.6	R515 K538	R515-D536 HydrophobicContact CB-CB 4.19Å; R515-D536 PolarHBondContact N-O 2.93Å; R515-D536 PolarHBondContact O-N 3.43Å; D536-K538 VanDerWaalsContact C-N 3.33Å; D536-K538 PolarHBondContact O-N 3.38Å
537	S	63	Low	65.4	Low	34 Å²	34	98.5 Å²	98.5	24%	0.238	47%	0.469	C	S	.	.			trans	-86.9	69.4	172.4	53.9	0	0	0	0	111.1	I535 N539 K540	I535-S537 PolarHBondContact O-N 3.33Å; S537-N539 PolarHBondContact O-N 3.46Å; S537-K540 PolarHBondContact O-N 3.05Å; S537-K540 WeakPolarHBondContact OG-CD 3.4Å; S537-K540 VanDerWaalsContact OG-CE 3.29Å; S537-K540 WeakPolarHBondContact OG-CE 3.37Å; S537-K540 VanDerWaalsContact OG-CG 3.29Å; S537-K540 WeakPolarHBondContact OG-CG 3.41Å
538	K	52.7	Low	64.4	Low	196 Å²	196	96 Å²	96	85%	0.852	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-7.9	165.6	-79.4	-169.2	177.5	-178.1	0	113.3	D536	D536-K538 VanDerWaalsContact C-N 3.33Å; D536-K538 PolarHBondContact O-N 3.38Å
539	N	46.9	Very low	62.8	Low	65 Å²	65	92.1 Å²	92.1	35%	0.348	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	6.6	172.9	-86.3	-22.8	0	0	0	115.2	S537 E541 S542 L543	S537-N539 PolarHBondContact O-N 3.46Å; N539-E541 PolarHBondContact O-N 3.48Å; N539-S542 PolarHBondContact O-N 2.95Å; N539-S542 VanDerWaalsContact O-N 3.14Å; N539-L543 PolarHBondContact O-N 2.86Å; N539-L543 VanDerWaalsContact O-N 3.14Å
540	K	47.1	Very low	61	Low	141 Å²	141	94.4 Å²	94.4	61%	0.613	45%	0.453	S	S	*	.	H	α-helix	trans	-58.6	-36.2	172.2	-106.5	-177.7	-162.6	174.5	0	111.2	S537 L544	S537-K540 PolarHBondContact O-N 3.05Å; S537-K540 WeakPolarHBondContact OG-CD 3.4Å; S537-K540 VanDerWaalsContact OG-CE 3.29Å; S537-K540 WeakPolarHBondContact OG-CE 3.37Å; S537-K540 VanDerWaalsContact OG-CG 3.29Å; S537-K540 WeakPolarHBondContact OG-CG 3.41Å; K540-L544 WeakPolarHBondContact O-CB 3.28Å; K540-L544 PolarHBondContact O-N 3Å
541	E	44	Very low	59.3	Low	145 Å²	145	94.7 Å²	94.7	68%	0.678	47%	0.468	S	S	*	.	H	α-helix	trans	-68	-39.7	175.6	-71.2	-174.2	160.8	0	0	112	N539 Q545	N539-E541 PolarHBondContact O-N 3.48Å; E541-Q545 WeakPolarHBondContact O-CB 3.49Å; E541-Q545 WeakPolarHBondContact O-CG 3.29Å; E541-Q545 PolarHBondContact O-N 3.47Å
542	S	46.5	Very low	57.3	Low	40 Å²	40	105.6 Å²	105.6	28%	0.28	51%	0.51	S	S	.	.	H	α-helix	trans	-75.2	-35.2	-175.3	118.1	0	0	0	0	113.7	N539 R546	N539-S542 PolarHBondContact O-N 2.95Å; N539-S542 VanDerWaalsContact O-N 3.14Å; S542-R546 WeakPolarHBondContact O-CB 3.41Å; S542-R546 WeakPolarHBondContact O-CG 3.41Å; S542-R546 PolarHBondContact O-N 3.44Å
543	L	41.2	Very low	55.2	Low	91 Å²	91	110.6 Å²	110.6	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-78.1	-44.4	178.7	-80	169.7	0	0	0	112.5	N539 R546 F547	N539-L543 PolarHBondContact O-N 2.86Å; N539-L543 VanDerWaalsContact O-N 3.14Å; L543-R546 PolarHBondContact O-N 2.97Å; L543-F547 WeakPolarHBondContact O-CD2 3.33Å; L543-F547 PolarHBondContact O-N 3.05Å
544	L	47.6	Very low	53.5	Low	110 Å²	110	115.1 Å²	115.1	58%	0.576	56%	0.559	S	S	*	*	H	α-helix	trans	-66.3	-38.5	174.8	-79.6	163.2	0	0	0	111.3	K540 F547 Q548	K540-L544 WeakPolarHBondContact O-CB 3.28Å; K540-L544 PolarHBondContact O-N 3Å; L544-F547 PolarHBondContact O-N 2.93Å; L544-Q548 VanDerWaalsContact O-CB 3.27Å; L544-Q548 WeakPolarHBondContact O-CB 3.42Å; L544-Q548 VanDerWaalsContact O-CG 3.23Å; L544-Q548 WeakPolarHBondContact O-CG 3.49Å; L544-Q548 PolarHBondContact O-N 3.48Å
545	Q	47.7	Very low	51.7	Low	120 Å²	120	118 Å²	118	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-68.7	-35.6	172.8	-72.8	175.4	-10.9	0	0	112.5	E541 Q548 S549	E541-Q545 WeakPolarHBondContact O-CB 3.49Å; E541-Q545 WeakPolarHBondContact O-CG 3.29Å; E541-Q545 PolarHBondContact O-N 3.47Å; Q545-Q548 PolarHBondContact O-N 3.46Å; Q545-S549 VanDerWaalsContact O-CB 3.3Å; Q545-S549 WeakPolarHBondContact O-CB 3.5Å; Q545-S549 PolarHBondContact O-N 2.91Å; Q545-S549 PolarHBondContact O-OG 2.94Å
546	R	41.8	Very low	49.8	Very low	170 Å²	170	122.3 Å²	122.3	64%	0.642	59%	0.591	S	S	*	*	H	α-helix	trans	-67.1	-39.9	174.5	-84.7	176.8	173	-172.2	-1.1	112.4	S542 L543 S549 F550	S542-R546 WeakPolarHBondContact O-CB 3.41Å; S542-R546 WeakPolarHBondContact O-CG 3.41Å; S542-R546 PolarHBondContact O-N 3.44Å; L543-R546 PolarHBondContact O-N 2.97Å; R546-S549 WeakPolarHBondContact CA-OG 3.37Å; R546-S549 PolarHBondContact O-N 3.01Å; R546-S549 PolarHBondContact O-OG 3.41Å; R546-F550 WeakPolarHBondContact O-CB 3.37Å; R546-F550 WeakPolarHBondContact O-CD2 3.29Å; R546-F550 PolarHBondContact O-N 3.4Å
547	F	47	Very low	48	Very low	153 Å²	153	124.9 Å²	124.9	67%	0.671	60%	0.602	S	S	*	*	H	α-helix	trans	-67.9	-40.4	173.4	-89.7	-75.6	0	0	0	111.6	L543 L544 S549 F550 A551	L543-F547 WeakPolarHBondContact O-CD2 3.33Å; L543-F547 PolarHBondContact O-N 3.05Å; L544-F547 PolarHBondContact O-N 2.93Å; F547-S549 VanDerWaalsContact C-N 3.34Å; F547-S549 PolarHBondContact O-N 3.06Å; F547-F550 PolarHBondContact O-N 3.37Å; F547-A551 WeakPolarHBondContact O-CB 3.28Å; F547-A551 PolarHBondContact O-N 2.98Å
548	Q	51.8	Low	47.1	Very low	125 Å²	125	130.6 Å²	130.6	58%	0.584	62%	0.624	S	S	*	*	H	α-helix	trans	-68.5	-30.3	174.9	-75	179	-11.6	0	0	113	L544 Q545 R552	L544-Q548 VanDerWaalsContact O-CB 3.27Å; L544-Q548 WeakPolarHBondContact O-CB 3.42Å; L544-Q548 VanDerWaalsContact O-CG 3.23Å; L544-Q548 WeakPolarHBondContact O-CG 3.49Å; L544-Q548 PolarHBondContact O-N 3.48Å; Q545-Q548 PolarHBondContact O-N 3.46Å; Q548-R552 WeakPolarHBondContact O-CB 3.47Å; Q548-R552 WeakPolarHBondContact O-CG 3.34Å; Q548-R552 PolarHBondContact O-N 2.66Å
549	S	46.5	Very low	46.7	Very low	63 Å²	63	126.2 Å²	126.2	44%	0.441	61%	0.609	S	S	.	*	H	α-helix	trans	-75	-36	174	66.2	0	0	0	0	112	Q545 R546 F547 R552	Q545-S549 VanDerWaalsContact O-CB 3.3Å; Q545-S549 WeakPolarHBondContact O-CB 3.5Å; Q545-S549 PolarHBondContact O-N 2.91Å; Q545-S549 PolarHBondContact O-OG 2.94Å; R546-S549 WeakPolarHBondContact CA-OG 3.37Å; R546-S549 PolarHBondContact O-N 3.01Å; R546-S549 PolarHBondContact O-OG 3.41Å; F547-S549 VanDerWaalsContact C-N 3.34Å; F547-S549 PolarHBondContact O-N 3.06Å; S549-R552 PolarHBondContact O-N 3.02Å
550	F	47.1	Very low	46.7	Very low	157 Å²	157	130.6 Å²	130.6	69%	0.689	63%	0.628	S	S	*	*	H	α-helix	trans	-71.6	-32.5	173.7	-99.3	-82.9	0	0	0	112.7	R546 F547 R552	R546-F550 WeakPolarHBondContact O-CB 3.37Å; R546-F550 WeakPolarHBondContact O-CD2 3.29Å; R546-F550 PolarHBondContact O-N 3.4Å; F547-F550 PolarHBondContact O-N 3.37Å; F550-R552 PolarHBondContact O-N 3.24Å
551	A	52.7	Low	46.6	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-5.2	174.7	0	0	0	0	0	113.7	F547	F547-A551 WeakPolarHBondContact O-CB 3.28Å; F547-A551 PolarHBondContact O-N 2.98Å
552	R	47.8	Very low	46.8	Very low	230 Å²	230	128.5 Å²	128.5	87%	0.868	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	1.4	177	-83.1	-172.7	176.3	-174.5	1	114.2	Q548 S549 F550	Q548-R552 WeakPolarHBondContact O-CB 3.47Å; Q548-R552 WeakPolarHBondContact O-CG 3.34Å; Q548-R552 PolarHBondContact O-N 2.66Å; S549-R552 PolarHBondContact O-N 3.02Å; F550-R552 PolarHBondContact O-N 3.24Å
553	I	44.5	Very low	46.9	Very low	199 Å²	199	136.5 Å²	136.5	100%	1.021	66%	0.657	S	S	*	*			trans	-102.1	0	165.8	-57.7	170.9	0	0	0	106.6

Retrieved 553 of 553 residues in 113.7 ms (Link to these results)

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