A0A096NLK9_PAPAN Loading...

Zinc finger and SCAN domain containing 31

AlphaFold DB , UniProt , Accession A0A096NLK9, Species PAPAN (Papio anubis, Olive baboon), Gene ZSCAN31, Length 406 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.4	Very low	34.4	Very low	245 Å²	245	164.6 Å²	164.6	100%	1.207	85%	0.846	S	S	*	*				0	129.8	0	-82	-178.6	151.2	0	0	107.6
2	A	34.6	Very low	34.3	Very low	96 Å²	96	163.6 Å²	163.6	79%	0.793	84%	0.841	S	S	*	*			trans	64	106.9	179.5	0	0	0	0	0	115
3	S	35.3	Very low	34	Very low	118 Å²	118	160.5 Å²	160.5	83%	0.825	83%	0.833	S	S	*	*			cis	66.4	98.6	45.5	-49.3	0	0	0	0	113.7
4	T	36.6	Very low	33.6	Very low	140 Å²	140	162 Å²	162	86%	0.859	83%	0.83	S	S	*	*			trans	-144	97.3	152.3	48.3	0	0	0	0	108.4
5	E	36.7	Very low	33.4	Very low	188 Å²	188	159.7 Å²	159.7	88%	0.879	83%	0.827	S	S	*	*			trans	-75.9	123.9	163.1	-72.3	171.4	139.7	0	0	107.9
6	E	37.7	Very low	33	Very low	169 Å²	169	160.9 Å²	160.9	79%	0.79	83%	0.827	S	S	*	*			trans	-96.6	99.9	165.3	-77.8	-174.2	149.7	0	0	108.5
7	Q	33.5	Very low	32.9	Very low	155 Å²	155	162.8 Å²	162.8	72%	0.724	83%	0.832	S	S	*	*			trans	-83.7	114.7	175.4	-178.5	174.2	-25.3	0	0	109	D9	Q7-D9 PolarHBondContact NE2-OD1 3.36Å; Q7-D9 PolarHBondContact O-N 3.39Å
8	Y	32.4	Very low	32.6	Very low	208 Å²	208	162.1 Å²	162.1	82%	0.816	83%	0.83	S	S	*	*			trans	-84.6	103.3	171.5	-78.6	-86.7	0	0	0	109.9	L10	Y8-L10 PolarHBondContact O-N 2.91Å
9	D	32.1	Very low	33	Very low	132 Å²	132	159.5 Å²	159.5	71%	0.706	83%	0.825	S	S	*	*			trans	-74.4	108.2	173.2	-83.3	-25.9	0	0	0	111.4	Q7 K11	Q7-D9 PolarHBondContact NE2-OD1 3.36Å; Q7-D9 PolarHBondContact O-N 3.39Å; D9-K11 PolarHBondContact O-N 3.17Å
10	L	32	Very low	32.8	Very low	164 Å²	164	157.1 Å²	157.1	86%	0.859	82%	0.818	S	S	*	*			trans	-81.2	104.2	164.1	-86.8	155.5	0	0	0	109.2	Y8 I12	Y8-L10 PolarHBondContact O-N 2.91Å; L10-I12 PolarHBondContact O-N 2.79Å; L10-I12 VanDerWaalsContact O-N 3.13Å
11	K	31.4	Very low	32.5	Very low	196 Å²	196	161.3 Å²	161.3	85%	0.852	82%	0.823	S	S	*	*			trans	-66.7	105.7	169.3	-74.9	179.7	178.7	177	0	109.8	D9 V13	D9-K11 PolarHBondContact O-N 3.17Å; K11-V13 PolarHBondContact O-N 3.35Å
12	I	33	Very low	32.2	Very low	152 Å²	152	157 Å²	157	78%	0.779	81%	0.805	S	S	*	*			trans	-74.3	108.3	165.6	-61.5	177.5	0	0	0	107.3	L10 K14	L10-I12 PolarHBondContact O-N 2.79Å; L10-I12 VanDerWaalsContact O-N 3.13Å; I12-K14 PolarHBondContact O-N 3.25Å
13	V	30.6	Very low	31.9	Very low	123 Å²	123	160.5 Å²	160.5	75%	0.745	81%	0.805	S	S	*	*			trans	-73.9	108.3	165.9	177.6	0	0	0	0	106.9	K11 V15	K11-V13 PolarHBondContact O-N 3.35Å; V13-V15 PolarHBondContact O-N 3.48Å
14	K	28.7	Very low	31.5	Very low	182 Å²	182	163.8 Å²	163.8	79%	0.791	81%	0.807	S	S	*	*			trans	-66.3	115.8	163.1	-79.4	178	173.2	-179.7	0	107.3	I12	I12-K14 PolarHBondContact O-N 3.25Å
15	V	29.3	Very low	31	Very low	128 Å²	128	161.3 Å²	161.3	78%	0.776	80%	0.801	S	S	*	*			trans	-87.3	111.8	158.7	178.7	0	0	0	0	105.1	V13	V13-V15 PolarHBondContact O-N 3.48Å
16	E	27.9	Very low	31	Very low	179 Å²	179	161.9 Å²	161.9	84%	0.836	80%	0.803	S	S	*	*			trans	-63.1	126.4	172.9	-71.3	170.9	150.6	0	0	108.7	D18	E16-D18 PolarHBondContact O-N 3.14Å
17	E	31.6	Very low	30.5	Very low	193 Å²	193	160.7 Å²	160.7	90%	0.902	80%	0.802	S	S	*	*			trans	-75.3	112.2	167.9	-69.1	179.1	158.2	0	0	107.3
18	D	26.8	Very low	30.7	Very low	149 Å²	149	163 Å²	163	80%	0.797	81%	0.812	S	S	*	*			trans	-88.4	117.5	173	-136	-16	0	0	0	108.7	E16 T20	E16-D18 PolarHBondContact O-N 3.14Å; D18-T20 PolarHBondContact O-N 3.07Å
19	P	40.1	Very low	30.6	Very low	113 Å²	113	158.3 Å²	158.3	73%	0.734	81%	0.805	S	S	*	*			trans	-96.6	88.7	-172.9	35.2	-28.1	0	0	0	110
20	T	30.2	Very low	31	Very low	112 Å²	112	158.1 Å²	158.1	69%	0.687	80%	0.804	S	S	*	*			trans	-146.2	115.6	163.8	49.7	0	0	0	0	108.5	D18	D18-T20 PolarHBondContact O-N 3.07Å
21	W	25	Very low	31.4	Very low	245 Å²	245	156 Å²	156	93%	0.928	79%	0.794	S	S	*	*			trans	167.8	55.5	146.6	-91.2	104	0	0	0	107.9
22	D	30.1	Very low	32.1	Very low	156 Å²	156	151.9 Å²	151.9	83%	0.834	78%	0.776	S	S	*	*			trans	-95.1	133.8	153	-111.7	-23.4	0	0	0	106.9
23	Q	28.9	Very low	32.9	Very low	169 Å²	169	149 Å²	149	79%	0.79	77%	0.769	S	S	*	*			trans	106.5	123.3	163.1	-60.2	176.5	-8.5	0	0	118.2
24	E	26.3	Very low	34.1	Very low	186 Å²	186	144.5 Å²	144.5	87%	0.869	75%	0.748	S	S	*	*			trans	88.1	87	160	-64.9	-179.2	169.7	0	0	118.7
25	A	27.8	Very low	35.8	Very low	88 Å²	88	138.1 Å²	138.1	73%	0.727	72%	0.721	S	S	*	*				-163	91.9	114.3	0	0	0	0	0	110.9	L27	A25-L27 PolarHBondContact O-N 3.32Å; A25-L27 VanDerWaalsContact O-N 3.1Å
26	H	34.8	Very low	37.6	Very low	201 Å²	201	134.4 Å²	134.4	93%	0.931	70%	0.695	S	S	*	*			trans	-62.2	100.9	148.2	-89.7	-75.5	0	0	0	108
27	L	28.4	Very low	39.6	Very low	144 Å²	144	128 Å²	128	75%	0.754	67%	0.673	S	S	*	*			trans	-135.9	99.2	160.6	-81.2	170.4	0	0	0	108.4	A25 V29	A25-L27 PolarHBondContact O-N 3.32Å; A25-L27 VanDerWaalsContact O-N 3.1Å; L27-V29 PolarHBondContact O-N 3.23Å
28	Q	38.4	Very low	41.6	Very low	202 Å²	202	119.7 Å²	119.7	94%	0.944	64%	0.636	S	S	*	*			trans	-62.7	105	151.9	-76.6	179.2	-28.3	0	0	107.5
29	V	28.7	Very low	44.1	Very low	111 Å²	111	113.4 Å²	113.4	67%	0.673	60%	0.601	S	S	*	*			trans	-143.4	116.3	154	-176.2	0	0	0	0	107.3	L27 N31	L27-V29 PolarHBondContact O-N 3.23Å; V29-N31 PolarHBondContact O-N 2.98Å; V29-N31 VanDerWaalsContact O-N 3.13Å
30	N	40.8	Very low	45.7	Very low	127 Å²	127	112.3 Å²	112.3	68%	0.679	59%	0.586	S	S	*	*			trans	-22.5	108.5	159.1	-78.2	-3.2	0	0	0	113.2	F32	N30-F32 HydrophobicContact CB-CD2 3.73Å; N30-F32 HydrophobicContact CB-CE2 3.98Å; N30-F32 VanDerWaalsContact CG-CE2 3.42Å; N30-F32 WeakPolarHBondContact OD1-CE2 3.44Å
31	N	41.4	Very low	48	Very low	119 Å²	119	111.1 Å²	111.1	64%	0.636	58%	0.575	S	S	*	*			trans	-116.6	44.4	170.7	-118.2	-14.3	0	0	0	109.9	V29 S33 G34	V29-N31 PolarHBondContact O-N 2.98Å; V29-N31 VanDerWaalsContact O-N 3.13Å; N31-S33 PolarHBondContact O-N 3.4Å; N31-G34 PolarHBondContact O-N 3.27Å
32	F	45.1	Very low	50.7	Low	111 Å²	111	102 Å²	102	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-55.7	-33.1	174.5	-74	-80.2	0	0	0	111.9	N30 G34 E36 E105	N30-F32 HydrophobicContact CB-CD2 3.73Å; N30-F32 HydrophobicContact CB-CE2 3.98Å; N30-F32 VanDerWaalsContact CG-CE2 3.42Å; N30-F32 WeakPolarHBondContact OD1-CE2 3.44Å; F32-G34 VanDerWaalsContact C-N 3.31Å; F32-G34 PolarHBondContact O-N 3.13Å; F32-E36 PolarHBondContact O-N 3.46Å; F32-E105 WeakPolarHBondContact CE1-OE1 3.48Å
33	S	50.4	Low	52.9	Low	90 Å²	90	98.5 Å²	98.5	63%	0.629	52%	0.518	S	S	*	.	H	α-helix	trans	-66.8	-28.5	174.8	58.1	0	0	0	0	113.7	N31 A37	N31-S33 PolarHBondContact O-N 3.4Å; S33-A37 WeakPolarHBondContact O-CB 3.28Å; S33-A37 PolarHBondContact O-N 3.05Å
34	G	56.2	Low	55.3	Low	30 Å²	30	97.1 Å²	97.1	31%	0.309	51%	0.511	S	S	.	.	H	α-helix	trans	-77.8	-33.2	-178.9	0	0	0	0	0	113.7	N31 F32 S38	N31-G34 PolarHBondContact O-N 3.27Å; F32-G34 VanDerWaalsContact C-N 3.31Å; F32-G34 PolarHBondContact O-N 3.13Å; G34-S38 WeakPolarHBondContact O-CB 3.46Å; G34-S38 PolarHBondContact O-N 3.43Å; G34-S38 PolarHBondContact O-OG 3.36Å
35	Q	64.1	Low	57.9	Low	47 Å²	47	90.7 Å²	90.7	22%	0.22	48%	0.48	C	S	.	.	H	α-helix	trans	-74.9	-43.9	179.6	-171.1	173.4	1.1	0	0	111.6	S38 R39 W67	Q35-S38 PolarHBondContact O-N 3.38Å; Q35-R39 WeakPolarHBondContact O-CB 3.42Å; Q35-R39 PolarHBondContact O-N 3.43Å; Q35-W67 PolarHBondContact NE2-O 3.43Å
36	E	67.2	Low	60.1	Low	50 Å²	50	88.5 Å²	88.5	23%	0.234	46%	0.459	C	S	.	.	H	α-helix	trans	-67.8	-37.8	175.1	-175.9	54.8	-147.2	0	0	111.5	F32 S38 R39 Q40 R43	F32-E36 PolarHBondContact O-N 3.46Å; E36-S38 VanDerWaalsContact C-N 3.34Å; E36-S38 PolarHBondContact O-N 3.22Å; E36-R39 WeakPolarHBondContact O-CB 3.41Å; E36-R39 PolarHBondContact O-N 3.01Å; E36-R39 WeakPolarHBondContact OE2-CD 3.22Å; E36-R39 IonicContact OE2-NH1 3.74Å; E36-Q40 VanDerWaalsContact O-CG 3.31Å; E36-Q40 WeakPolarHBondContact O-CG 3.41Å; E36-Q40 PolarHBondContact O-N 3.45Å; E36-Q40 PolarHBondContact OE1-NE2 3.26Å; E36-R43 IonicContact OE1-NH1 2.72Å
37	A	69.6	Low	61.8	Low	45 Å²	45	84.2 Å²	84.2	37%	0.372	44%	0.436	S	S	.	.	H	α-helix	trans	-61.2	-41.7	171.7	0	0	0	0	0	112.3	S33 Q40 L41	S33-A37 WeakPolarHBondContact O-CB 3.28Å; S33-A37 PolarHBondContact O-N 3.05Å; A37-Q40 PolarHBondContact O-N 3.34Å; A37-L41 WeakPolarHBondContact O-CG 3.39Å; A37-L41 PolarHBondContact O-N 3.16Å
38	S	74.4	Confident	63.7	Low	18 Å²	18	82 Å²	82	13%	0.126	42%	0.421	C	S	.	.	H	α-helix	trans	-66.8	-37.3	176.6	-58.8	0	0	0	0	112.1	G34 Q35 E36 L41 F42	G34-S38 WeakPolarHBondContact O-CB 3.46Å; G34-S38 PolarHBondContact O-N 3.43Å; G34-S38 PolarHBondContact O-OG 3.36Å; Q35-S38 PolarHBondContact O-N 3.38Å; E36-S38 VanDerWaalsContact C-N 3.34Å; E36-S38 PolarHBondContact O-N 3.22Å; S38-L41 PolarHBondContact O-N 3.29Å; S38-F42 PolarHBondContact O-N 3.13Å
39	R	77.7	Confident	65.2	Low	17 Å²	17	80 Å²	80	6%	0.064	41%	0.412	C	S	.	.	H	α-helix	trans	-63.3	-43.3	173.3	-172.3	-175.8	-172.2	175.5	3.3	111.9	Q35 E36 F42 R43 W67 E85	Q35-R39 WeakPolarHBondContact O-CB 3.42Å; Q35-R39 PolarHBondContact O-N 3.43Å; E36-R39 WeakPolarHBondContact O-CB 3.41Å; E36-R39 PolarHBondContact O-N 3.01Å; E36-R39 WeakPolarHBondContact OE2-CD 3.22Å; E36-R39 IonicContact OE2-NH1 3.74Å; R39-F42 WeakPolarHBondContact O-CB 3.35Å; R39-F42 PolarHBondContact O-N 2.97Å; R39-R43 WeakPolarHBondContact O-CG 3.38Å; R39-R43 PolarHBondContact O-N 2.9Å; R39-W67 HydrophobicContact CB-CD2 4.42Å; R39-W67 HydrophobicContact CB-CG 4.04Å; R39-W67 HydrophobicContact CG-CD2 4.25Å; R39-W67 HydrophobicContact CG-CG 4.37Å; R39-W67 HydrophobicContact CG-CZ2 4.14Å; R39-E85 IonicContact CZ-OE2 3.95Å; R39-E85 VanDerWaalsContact CZ-OE2 3.28Å; R39-E85 IonicContact NE-OE2 3.2Å; R39-E85 PolarHBondContact NE-OE2 3.3Å; R39-E85 IonicContact NH2-OE2 3.19Å; R39-E85 PolarHBondContact NH2-OE2 2.85Å
40	Q	75.1	Confident	67.3	Low	90 Å²	90	76 Å²	76	42%	0.421	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-41.4	176.5	-72.6	175.9	10.2	0	0	112.1	E36 A37 F42 R43 Q44	E36-Q40 VanDerWaalsContact O-CG 3.31Å; E36-Q40 WeakPolarHBondContact O-CG 3.41Å; E36-Q40 PolarHBondContact O-N 3.45Å; E36-Q40 PolarHBondContact OE1-NE2 3.26Å; A37-Q40 PolarHBondContact O-N 3.34Å; Q40-F42 VanDerWaalsContact C-N 3.28Å; Q40-F42 PolarHBondContact O-N 2.96Å; Q40-R43 WeakPolarHBondContact O-CB 3.36Å; Q40-R43 PolarHBondContact O-N 3.4Å; Q40-Q44 WeakPolarHBondContact O-CB 3.23Å; Q40-Q44 WeakPolarHBondContact O-CG 3.38Å; Q40-Q44 PolarHBondContact O-N 3.11Å
41	L	77.7	Confident	68.6	Low	87 Å²	87	75.9 Å²	75.9	46%	0.455	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-34.9	173.6	-71.1	172.3	0	0	0	112.3	A37 S38 F45 L63	A37-L41 WeakPolarHBondContact O-CG 3.39Å; A37-L41 PolarHBondContact O-N 3.16Å; S38-L41 PolarHBondContact O-N 3.29Å; L41-F45 PolarHBondContact O-N 3.4Å; L41-L63 HydrophobicContact CB-CD2 3.85Å
42	F	81.3	Confident	70.3	Confident	55 Å²	55	71.1 Å²	71.1	24%	0.241	37%	0.373	C	S	.	.	H	α-helix	trans	-64.9	-44.3	172.4	-179.5	-98	0	0	0	112	S38 R39 Q40 Q44 F45 L60 L63 C64 W67	S38-F42 PolarHBondContact O-N 3.13Å; R39-F42 WeakPolarHBondContact O-CB 3.35Å; R39-F42 PolarHBondContact O-N 2.97Å; Q40-F42 VanDerWaalsContact C-N 3.28Å; Q40-F42 PolarHBondContact O-N 2.96Å; F42-Q44 VanDerWaalsContact C-N 3.32Å; F42-Q44 PolarHBondContact O-N 3.17Å; F42-F45 WeakPolarHBondContact O-CB 3.46Å; F42-F45 PolarHBondContact O-N 2.84Å; F42-L60 HydrophobicContact CD2-CD2 4.45Å; F42-L60 HydrophobicContact CE2-CD2 4.02Å; F42-L63 HydrophobicContact CB-CB 4.47Å; F42-L63 HydrophobicContact CD2-CB 4.17Å; F42-C64 WeakPolarHBondContact CE2-SG 3.44Å; F42-W67 HydrophobicContact CB-CE3 4.42Å; F42-W67 AromaticContact CD1-CE3 3.83Å; F42-W67 HydrophobicContact CD1-CE3 3.83Å; F42-W67 AromaticContact CD1-CZ3 3.67Å; F42-W67 HydrophobicContact CD1-CZ3 3.67Å; F42-W67 HydrophobicContact CE1-CE3 4.21Å; F42-W67 AromaticContact CE1-CZ3 3.69Å; F42-W67 HydrophobicContact CE1-CZ3 3.69Å; F42-W67 AromaticContact CG-CE3 4Å; F42-W67 HydrophobicContact CG-CE3 4Å; F42-W67 HydrophobicContact CG-CZ3 4.29Å; F42-W67 HydrophobicContact CZ-CZ3 4.33Å
43	R	76.8	Confident	71.5	Confident	82 Å²	82	70.3 Å²	70.3	31%	0.309	38%	0.379	S	S	.	.	H	α-helix	trans	-61.2	-38.4	175.6	-72.7	173.3	174.6	165.7	-1.5	113	E36 R39 Q40 F45 E85	E36-R43 IonicContact OE1-NH1 2.72Å; R39-R43 WeakPolarHBondContact O-CG 3.38Å; R39-R43 PolarHBondContact O-N 2.9Å; Q40-R43 WeakPolarHBondContact O-CB 3.36Å; Q40-R43 PolarHBondContact O-N 3.4Å; R43-F45 VanDerWaalsContact C-N 3.31Å; R43-E85 VanDerWaalsContact CG-OE1 3.29Å; R43-E85 WeakPolarHBondContact CG-OE1 3.4Å; R43-E85 IonicContact CZ-OE1 3.83Å; R43-E85 IonicContact CZ-OE2 3.98Å; R43-E85 IonicContact NE-OE1 3.26Å; R43-E85 PolarHBondContact NE-OE1 2.77Å; R43-E85 IonicContact NE-OE2 2.87Å; R43-E85 PolarHBondContact NE-OE2 2.85Å; R43-E85 IonicContact NH2-OE1 3.8Å; R43-E85 PolarHBondContact NH2-OE1 3.39Å; R43-E85 IonicContact NH2-OE2 3.11Å; R43-E85 PolarHBondContact NH2-OE2 2.85Å
44	Q	78.9	Confident	72.6	Confident	140 Å²	140	76.1 Å²	76.1	65%	0.654	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.2	-177.1	-66.9	175.1	9.4	0	0	113.3	Q40 F42 C46	Q40-Q44 WeakPolarHBondContact O-CB 3.23Å; Q40-Q44 WeakPolarHBondContact O-CG 3.38Å; Q40-Q44 PolarHBondContact O-N 3.11Å; F42-Q44 VanDerWaalsContact C-N 3.32Å; F42-Q44 PolarHBondContact O-N 3.17Å; Q44-C46 PolarHBondContact O-N 2.8Å
45	F	81.1	Confident	73.6	Confident	50 Å²	50	79.6 Å²	79.6	22%	0.219	40%	0.395	C	S	.	.			trans	-62	121.2	-176.9	178.8	-91.6	0	0	0	112.2	L41 F42 R43 T50 A56 R59 L60 L63	L41-F45 PolarHBondContact O-N 3.4Å; F42-F45 WeakPolarHBondContact O-CB 3.46Å; F42-F45 PolarHBondContact O-N 2.84Å; R43-F45 VanDerWaalsContact C-N 3.31Å; F45-T50 HydrophobicContact CE2-CG2 3.9Å; F45-T50 HydrophobicContact CZ-CG2 3.72Å; F45-A56 HydrophobicContact CZ-CB 4.16Å; F45-R59 HydrophobicContact CD2-CG 4.32Å; F45-R59 HydrophobicContact CE2-CB 3.95Å; F45-R59 HydrophobicContact CE2-CG 3.77Å; F45-L60 HydrophobicContact CB-CD2 4.39Å; F45-L60 HydrophobicContact CD1-CD1 4.28Å; F45-L60 HydrophobicContact CD1-CD2 3.37Å; F45-L60 HydrophobicContact CD1-CG 3.79Å; F45-L60 HydrophobicContact CD2-CD2 4.36Å; F45-L60 HydrophobicContact CE1-CD1 3.73Å; F45-L60 HydrophobicContact CE1-CD2 3.62Å; F45-L60 HydrophobicContact CE1-CG 3.44Å; F45-L60 VanDerWaalsContact CE1-CG 3.44Å; F45-L60 HydrophobicContact CE2-CG 4.29Å; F45-L60 HydrophobicContact CG-CD2 3.77Å; F45-L60 HydrophobicContact CG-CG 4.33Å; F45-L60 HydrophobicContact CZ-CD1 4.27Å; F45-L60 HydrophobicContact CZ-CD2 4.21Å; F45-L60 HydrophobicContact CZ-CG 3.72Å; F45-L63 HydrophobicContact CB-CD1 4.15Å; F45-L63 HydrophobicContact CD2-CD1 3.7Å; F45-L63 HydrophobicContact CG-CD1 4.24Å
46	C	73.4	Confident	74.4	Confident	42 Å²	42	77.5 Å²	77.5	28%	0.284	39%	0.386	S	S	.	.			trans	-117.4	121.2	-176.3	-168.1	0	0	0	0	110.9	Q44 Q48 E49	Q44-C46 PolarHBondContact O-N 2.8Å; C46-Q48 PolarHBondContact O-N 3.5Å; C46-Q48 VanDerWaalsContact O-N 3.16Å; C46-Q48 PolarHBondContact SG-OE1 3.13Å; C46-E49 HydrophobicContact CB-CG 4.18Å; C46-E49 PolarHBondContact O-N 2.87Å; C46-E49 VanDerWaalsContact O-N 3.14Å
47	Y	70.3	Confident	74.8	Confident	111 Å²	111	81 Å²	81	44%	0.435	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-58.5	-32	-179.1	179.9	-94.7	0	0	0	112.6	E49 T50 P53 A56	Y47-E49 PolarHBondContact O-N 3.4Å; Y47-E49 VanDerWaalsContact O-N 3.17Å; Y47-T50 PolarHBondContact O-N 2.81Å; Y47-T50 PolarHBondContact O-OG1 3.03Å; Y47-P53 HydrophobicContact CE2-CB 4.37Å; Y47-A56 HydrophobicContact CD2-CB 3.65Å; Y47-A56 HydrophobicContact CE2-CB 3.71Å
48	Q	68.3	Low	75.4	Confident	98 Å²	98	81.4 Å²	81.4	46%	0.458	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-58.1	-24	179.3	-72.2	83.4	-24.3	0	0	113.7	C46	C46-Q48 PolarHBondContact O-N 3.5Å; C46-Q48 VanDerWaalsContact O-N 3.16Å; C46-Q48 PolarHBondContact SG-OE1 3.13Å
49	E	70	Confident	75.6	Confident	161 Å²	161	85.5 Å²	85.5	75%	0.752	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-92.6	1	-175.8	-60.8	179.4	171.3	0	0	112.8	C46 Y47	C46-E49 HydrophobicContact CB-CG 4.18Å; C46-E49 PolarHBondContact O-N 2.87Å; C46-E49 VanDerWaalsContact O-N 3.14Å; Y47-E49 PolarHBondContact O-N 3.4Å; Y47-E49 VanDerWaalsContact O-N 3.17Å
50	T	74	Confident	75.8	Confident	26 Å²	26	87.6 Å²	87.6	16%	0.16	43%	0.431	C	S	.	.	S	Bend	trans	-104.3	140.9	-177.1	67.3	0	0	0	0	112.2	F45 Y47 G52 A56	F45-T50 HydrophobicContact CE2-CG2 3.9Å; F45-T50 HydrophobicContact CZ-CG2 3.72Å; Y47-T50 PolarHBondContact O-N 2.81Å; Y47-T50 PolarHBondContact O-OG1 3.03Å; T50-G52 PolarHBondContact O-N 3.29Å; T50-A56 HydrophobicContact CG2-CB 4.17Å; T50-A56 WeakPolarHBondContact OG1-CB 3.43Å
51	P	67.6	Low	76.1	Confident	125 Å²	125	92.1 Å²	92.1	81%	0.812	44%	0.444	S	S	*	.	S	Bend	trans	-61	-9.3	179	-24.2	32.1	0	0	0	115.7	E55	P51-E55 HydrophobicContact CG-CG 4.25Å
52	G	78.1	Confident	76.3	Confident	19 Å²	19	92 Å²	92	20%	0.196	44%	0.441	C	S	.	.	S	Bend	trans	162.9	175.5	179.1	0	0	0	0	0	113.8	T50 R54 E55 A56	T50-G52 PolarHBondContact O-N 3.29Å; G52-R54 VanDerWaalsContact C-N 3.29Å; G52-R54 PolarHBondContact O-N 3.4Å; G52-E55 PolarHBondContact O-N 3.47Å; G52-E55 VanDerWaalsContact O-N 3.12Å; G52-A56 PolarHBondContact O-N 2.9Å
53	P	69.8	Low	76.4	Confident	94 Å²	94	89.7 Å²	89.7	61%	0.61	43%	0.431	S	S	*	.	H	α-helix	trans	-66.8	-27	-170.7	25.2	-34.3	0	0	0	114.4	Y47 L57	Y47-P53 HydrophobicContact CE2-CB 4.37Å; P53-L57 WeakPolarHBondContact O-CB 3.44Å; P53-L57 PolarHBondContact O-N 2.79Å
54	R	74.1	Confident	76.6	Confident	212 Å²	212	87.6 Å²	87.6	80%	0.8	43%	0.429	S	S	*	.	H	α-helix	trans	-69.9	-44.8	174.4	-178.9	-179.8	-74.9	-96.5	3.3	110.6	G52 L57 S58	G52-R54 VanDerWaalsContact C-N 3.29Å; G52-R54 PolarHBondContact O-N 3.4Å; R54-L57 PolarHBondContact O-N 3.45Å; R54-S58 PolarHBondContact O-N 2.99Å; R54-S58 PolarHBondContact O-OG 3.03Å; R54-S58 VanDerWaalsContact O-OG 3.1Å
55	E	77.1	Confident	76.6	Confident	103 Å²	103	82.9 Å²	82.9	48%	0.481	41%	0.411	S	S	.	.	H	α-helix	trans	-70	-38.4	-179.6	-158.6	59.6	-161.5	0	0	111.5	P51 G52 L57 S58 R59	P51-E55 HydrophobicContact CG-CG 4.25Å; G52-E55 PolarHBondContact O-N 3.47Å; G52-E55 VanDerWaalsContact O-N 3.12Å; E55-L57 VanDerWaalsContact C-N 3.31Å; E55-L57 PolarHBondContact O-N 3.25Å; E55-S58 PolarHBondContact O-N 3.44Å; E55-R59 WeakPolarHBondContact O-CB 3.35Å; E55-R59 PolarHBondContact O-N 3.31Å
56	A	79.4	Confident	76.6	Confident	3 Å²	3	84.1 Å²	84.1	3%	0.025	42%	0.417	C	S	.	.	H	α-helix	trans	-56.9	-45.2	171.5	0	0	0	0	0	112.3	F45 Y47 T50 G52 R59 L60	F45-A56 HydrophobicContact CZ-CB 4.16Å; Y47-A56 HydrophobicContact CD2-CB 3.65Å; Y47-A56 HydrophobicContact CE2-CB 3.71Å; T50-A56 HydrophobicContact CG2-CB 4.17Å; T50-A56 WeakPolarHBondContact OG1-CB 3.43Å; G52-A56 PolarHBondContact O-N 2.9Å; A56-R59 PolarHBondContact O-N 3.25Å; A56-L60 VanDerWaalsContact O-CB 3.28Å; A56-L60 WeakPolarHBondContact O-CB 3.44Å; A56-L60 VanDerWaalsContact O-CG 3.28Å; A56-L60 WeakPolarHBondContact O-CG 3.49Å; A56-L60 PolarHBondContact O-N 3.09Å
57	L	76.2	Confident	77	Confident	122 Å²	122	82.3 Å²	82.3	64%	0.639	40%	0.404	S	S	*	.	H	α-helix	trans	-69.4	-38.8	179.2	-170.3	121	0	0	0	111.9	P53 R54 E55 R61	P53-L57 WeakPolarHBondContact O-CB 3.44Å; P53-L57 PolarHBondContact O-N 2.79Å; R54-L57 PolarHBondContact O-N 3.45Å; E55-L57 VanDerWaalsContact C-N 3.31Å; E55-L57 PolarHBondContact O-N 3.25Å; L57-R61 VanDerWaalsContact O-CB 3.27Å; L57-R61 WeakPolarHBondContact O-CB 3.25Å; L57-R61 PolarHBondContact O-N 3.35Å
58	S	81.1	Confident	77.6	Confident	55 Å²	55	77.8 Å²	77.8	39%	0.385	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-47	173.8	-63.5	0	0	0	0	111.4	R54 E55 R61 E62	R54-S58 PolarHBondContact O-N 2.99Å; R54-S58 PolarHBondContact O-OG 3.03Å; R54-S58 VanDerWaalsContact O-OG 3.1Å; E55-S58 PolarHBondContact O-N 3.44Å; S58-R61 WeakPolarHBondContact O-CB 3.47Å; S58-R61 PolarHBondContact O-N 2.9Å; S58-E62 PolarHBondContact O-N 3.46Å
59	R	80.5	Confident	78.2	Confident	103 Å²	103	78.1 Å²	78.1	39%	0.389	39%	0.385	S	S	.	.	H	α-helix	trans	-69.1	-40.5	-179.1	-169.9	61.4	175.2	160.2	2.8	112.6	F45 E55 A56 R61 E62 L63	F45-R59 HydrophobicContact CD2-CG 4.32Å; F45-R59 HydrophobicContact CE2-CB 3.95Å; F45-R59 HydrophobicContact CE2-CG 3.77Å; E55-R59 WeakPolarHBondContact O-CB 3.35Å; E55-R59 PolarHBondContact O-N 3.31Å; A56-R59 PolarHBondContact O-N 3.25Å; R59-R61 VanDerWaalsContact C-N 3.31Å; R59-R61 PolarHBondContact O-N 2.91Å; R59-E62 IonicContact CZ-OE2 2.6Å; R59-E62 IonicContact NH1-OE1 3.7Å; R59-E62 PolarHBondContact NH1-OE1 3.32Å; R59-E62 IonicContact NH1-OE2 3.55Å; R59-E62 PolarHBondContact NH1-OE2 3.1Å; R59-E62 PolarHBondContact O-N 3.13Å; R59-L63 HydrophobicContact CG-CD1 4.44Å; R59-L63 WeakPolarHBondContact O-CG 3.24Å; R59-L63 PolarHBondContact O-N 3.47Å
60	L	80.1	Confident	78.6	Confident	61 Å²	61	73.3 Å²	73.3	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-59.9	-43	171.4	-81.7	169.6	0	0	0	111.6	F42 F45 A56 E62 L63 C64	F42-L60 HydrophobicContact CD2-CD2 4.45Å; F42-L60 HydrophobicContact CE2-CD2 4.02Å; F45-L60 HydrophobicContact CB-CD2 4.39Å; F45-L60 HydrophobicContact CD1-CD1 4.28Å; F45-L60 HydrophobicContact CD1-CD2 3.37Å; F45-L60 HydrophobicContact CD1-CG 3.79Å; F45-L60 HydrophobicContact CD2-CD2 4.36Å; F45-L60 HydrophobicContact CE1-CD1 3.73Å; F45-L60 HydrophobicContact CE1-CD2 3.62Å; F45-L60 HydrophobicContact CE1-CG 3.44Å; F45-L60 VanDerWaalsContact CE1-CG 3.44Å; F45-L60 HydrophobicContact CE2-CG 4.29Å; F45-L60 HydrophobicContact CG-CD2 3.77Å; F45-L60 HydrophobicContact CG-CG 4.33Å; F45-L60 HydrophobicContact CZ-CD1 4.27Å; F45-L60 HydrophobicContact CZ-CD2 4.21Å; F45-L60 HydrophobicContact CZ-CG 3.72Å; A56-L60 VanDerWaalsContact O-CB 3.28Å; A56-L60 WeakPolarHBondContact O-CB 3.44Å; A56-L60 VanDerWaalsContact O-CG 3.28Å; A56-L60 WeakPolarHBondContact O-CG 3.49Å; A56-L60 PolarHBondContact O-N 3.09Å; L60-E62 VanDerWaalsContact C-N 3.31Å; L60-E62 PolarHBondContact O-N 3.43Å; L60-L63 PolarHBondContact O-N 3.49Å; L60-C64 WeakPolarHBondContact O-CB 3.34Å; L60-C64 PolarHBondContact O-N 3.08Å; L60-C64 PolarHBondContact O-SG 3.34Å
61	R	81.9	Confident	78.8	Confident	185 Å²	185	78.8 Å²	78.8	70%	0.698	39%	0.392	S	S	*	.	H	α-helix	trans	-62.6	-40.8	177.8	-176.5	176.3	177.2	-126.3	-3.3	111.4	L57 S58 R59 C65	L57-R61 VanDerWaalsContact O-CB 3.27Å; L57-R61 WeakPolarHBondContact O-CB 3.25Å; L57-R61 PolarHBondContact O-N 3.35Å; S58-R61 WeakPolarHBondContact O-CB 3.47Å; S58-R61 PolarHBondContact O-N 2.9Å; R59-R61 VanDerWaalsContact C-N 3.31Å; R59-R61 PolarHBondContact O-N 2.91Å; R61-C65 WeakPolarHBondContact O-CB 3.44Å; R61-C65 PolarHBondContact O-N 3.4Å; R61-C65 PolarHBondContact O-SG 2.87Å; R61-C65 VanDerWaalsContact O-SG 3.35Å
62	E	82.1	Confident	79	Confident	86 Å²	86	77.9 Å²	77.9	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-64.4	-47.7	176.6	-169.7	-174.8	179.1	0	0	112.1	S58 R59 L60 C64 C65 Q66	S58-E62 PolarHBondContact O-N 3.46Å; R59-E62 IonicContact CZ-OE2 2.6Å; R59-E62 IonicContact NH1-OE1 3.7Å; R59-E62 PolarHBondContact NH1-OE1 3.32Å; R59-E62 IonicContact NH1-OE2 3.55Å; R59-E62 PolarHBondContact NH1-OE2 3.1Å; R59-E62 PolarHBondContact O-N 3.13Å; L60-E62 VanDerWaalsContact C-N 3.31Å; L60-E62 PolarHBondContact O-N 3.43Å; E62-C64 VanDerWaalsContact C-N 3.35Å; E62-C64 PolarHBondContact O-N 3.48Å; E62-C65 PolarHBondContact O-N 3.38Å; E62-C65 VanDerWaalsContact O-N 3.15Å; E62-Q66 WeakPolarHBondContact O-CG 3.41Å; E62-Q66 PolarHBondContact O-N 2.69Å; E62-Q66 PolarHBondContact OE1-NE2 3.3Å
63	L	82.6	Confident	79	Confident	5 Å²	5	79 Å²	79	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-62.1	-41.4	176.6	-69.9	172.1	0	0	0	111.8	L41 F42 F45 R59 L60 C65 Q66 W67	L41-L63 HydrophobicContact CB-CD2 3.85Å; F42-L63 HydrophobicContact CB-CB 4.47Å; F42-L63 HydrophobicContact CD2-CB 4.17Å; F45-L63 HydrophobicContact CB-CD1 4.15Å; F45-L63 HydrophobicContact CD2-CD1 3.7Å; F45-L63 HydrophobicContact CG-CD1 4.24Å; R59-L63 HydrophobicContact CG-CD1 4.44Å; R59-L63 WeakPolarHBondContact O-CG 3.24Å; R59-L63 PolarHBondContact O-N 3.47Å; L60-L63 PolarHBondContact O-N 3.49Å; L63-C65 PolarHBondContact O-N 3.15Å; L63-Q66 PolarHBondContact O-N 2.76Å; L63-W67 WeakPolarHBondContact O-CB 3.33Å; L63-W67 PolarHBondContact O-N 2.79Å
64	C	81.4	Confident	79.5	Confident	38 Å²	38	77.7 Å²	77.7	26%	0.257	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-41.1	173.1	-73.4	0	0	0	0	112.1	F42 L60 E62 L68	F42-C64 WeakPolarHBondContact CE2-SG 3.44Å; L60-C64 WeakPolarHBondContact O-CB 3.34Å; L60-C64 PolarHBondContact O-N 3.08Å; L60-C64 PolarHBondContact O-SG 3.34Å; E62-C64 VanDerWaalsContact C-N 3.35Å; E62-C64 PolarHBondContact O-N 3.48Å; C64-L68 HydrophobicContact CB-CD1 4.27Å; C64-L68 WeakPolarHBondContact O-CA 3.45Å; C64-L68 WeakPolarHBondContact O-CB 3.17Å; C64-L68 WeakPolarHBondContact O-CG 3.39Å; C64-L68 PolarHBondContact O-N 3.37Å
65	C	79.3	Confident	79.5	Confident	42 Å²	42	75.5 Å²	75.5	28%	0.284	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-38.9	176.1	-77.3	0	0	0	0	111.8	R61 E62 L63 R69	R61-C65 WeakPolarHBondContact O-CB 3.44Å; R61-C65 PolarHBondContact O-N 3.4Å; R61-C65 PolarHBondContact O-SG 2.87Å; R61-C65 VanDerWaalsContact O-SG 3.35Å; E62-C65 PolarHBondContact O-N 3.38Å; E62-C65 VanDerWaalsContact O-N 3.15Å; L63-C65 PolarHBondContact O-N 3.15Å; C65-R69 WeakPolarHBondContact O-CA 3.25Å; C65-R69 PolarHBondContact O-N 3.43Å
66	Q	81.4	Confident	79.4	Confident	76 Å²	76	76.8 Å²	76.8	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-69.9	-39.7	178	-71.5	173	3.6	0	0	112.6	E62 L63 R69	E62-Q66 WeakPolarHBondContact O-CG 3.41Å; E62-Q66 PolarHBondContact O-N 2.69Å; E62-Q66 PolarHBondContact OE1-NE2 3.3Å; L63-Q66 PolarHBondContact O-N 2.76Å; Q66-R69 VanDerWaalsContact O-CG 3.3Å; Q66-R69 WeakPolarHBondContact O-CG 3.48Å
67	W	82.6	Confident	79.2	Confident	3 Å²	3	81 Å²	81	1%	0.011	39%	0.391	C	S	.	.	H	α-helix	trans	-77.7	-54	178.7	170.1	37.4	0	0	0	112.7	Q35 R39 F42 L63 L81 L82 E85	Q35-W67 PolarHBondContact NE2-O 3.43Å; R39-W67 HydrophobicContact CB-CD2 4.42Å; R39-W67 HydrophobicContact CB-CG 4.04Å; R39-W67 HydrophobicContact CG-CD2 4.25Å; R39-W67 HydrophobicContact CG-CG 4.37Å; R39-W67 HydrophobicContact CG-CZ2 4.14Å; F42-W67 HydrophobicContact CB-CE3 4.42Å; F42-W67 AromaticContact CD1-CE3 3.83Å; F42-W67 HydrophobicContact CD1-CE3 3.83Å; F42-W67 AromaticContact CD1-CZ3 3.67Å; F42-W67 HydrophobicContact CD1-CZ3 3.67Å; F42-W67 HydrophobicContact CE1-CE3 4.21Å; F42-W67 AromaticContact CE1-CZ3 3.69Å; F42-W67 HydrophobicContact CE1-CZ3 3.69Å; F42-W67 AromaticContact CG-CE3 4Å; F42-W67 HydrophobicContact CG-CE3 4Å; F42-W67 HydrophobicContact CG-CZ3 4.29Å; F42-W67 HydrophobicContact CZ-CZ3 4.33Å; L63-W67 WeakPolarHBondContact O-CB 3.33Å; L63-W67 PolarHBondContact O-N 2.79Å; W67-L81 HydrophobicContact CZ2-CB 4.49Å; W67-L82 HydrophobicContact CH2-CD2 3.81Å; W67-L82 HydrophobicContact CZ3-CD2 3.85Å; W67-E85 HydrophobicContact CH2-CB 3.75Å; W67-E85 HydrophobicContact CH2-CG 3.8Å; W67-E85 HydrophobicContact CZ2-CB 4.01Å; W67-E85 HydrophobicContact CZ2-CG 4.29Å
68	L	82.6	Confident	79.4	Confident	17 Å²	17	76.8 Å²	76.8	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-83.8	-13.8	-172.6	-57.9	169.2	0	0	0	112.5	C64 H73 I78 L81 L82	C64-L68 HydrophobicContact CB-CD1 4.27Å; C64-L68 WeakPolarHBondContact O-CA 3.45Å; C64-L68 WeakPolarHBondContact O-CB 3.17Å; C64-L68 WeakPolarHBondContact O-CG 3.39Å; C64-L68 PolarHBondContact O-N 3.37Å; L68-H73 PolarHBondContact O-ND1 3.04Å; L68-I78 HydrophobicContact CB-CG1 4.44Å; L68-I78 HydrophobicContact CB-CG2 4.37Å; L68-I78 HydrophobicContact CD1-CG2 4.04Å; L68-I78 HydrophobicContact CD2-CG2 4.28Å; L68-I78 HydrophobicContact CG-CG2 4.46Å; L68-L81 HydrophobicContact CD2-CB 3.97Å; L68-L81 HydrophobicContact CD2-CD1 4.31Å; L68-L82 HydrophobicContact CD1-CD2 4.27Å; L68-L82 HydrophobicContact CD2-CD2 4.26Å; L68-L82 HydrophobicContact CD2-CG 4.29Å
69	R	81.2	Confident	79.4	Confident	104 Å²	104	79 Å²	79	39%	0.392	38%	0.376	S	S	.	.			trans	37.9	61.4	178.7	-56.9	179.9	70.5	-171.5	3.9	112.2	C65 Q66 E71 I72 H73	C65-R69 WeakPolarHBondContact O-CA 3.25Å; C65-R69 PolarHBondContact O-N 3.43Å; Q66-R69 VanDerWaalsContact O-CG 3.3Å; Q66-R69 WeakPolarHBondContact O-CG 3.48Å; R69-E71 VanDerWaalsContact C-OE2 3.26Å; R69-E71 WeakPolarHBondContact CA-OE2 3.36Å; R69-E71 PolarHBondContact O-N 2.98Å; R69-I72 VanDerWaalsContact CZ-CD1 3.4Å; R69-I72 PolarHBondContact O-N 3.39Å; R69-H73 PolarHBondContact O-N 3.31Å; R69-H73 PolarHBondContact O-ND1 3.02Å
70	P	77.4	Confident	79.4	Confident	61 Å²	61	78.3 Å²	78.3	40%	0.396	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-9.3	-174.7	29.1	-36.7	0	0	0	113.6	I72 I78	P70-I72 VanDerWaalsContact C-N 3.26Å; P70-I78 HydrophobicContact CB-CD1 3.86Å
71	E	78.4	Confident	79.4	Confident	141 Å²	141	76.2 Å²	76.2	66%	0.659	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-21.6	171.6	-54.7	74.3	-156.9	0	0	112.3	R69	R69-E71 VanDerWaalsContact C-OE2 3.26Å; R69-E71 WeakPolarHBondContact CA-OE2 3.36Å; R69-E71 PolarHBondContact O-N 2.98Å
72	I	71.3	Confident	79.4	Confident	106 Å²	106	70.8 Å²	70.8	54%	0.544	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-34.2	-174.3	-59.4	163.5	0	0	0	111.1	R69 P70	R69-I72 VanDerWaalsContact CZ-CD1 3.4Å; R69-I72 PolarHBondContact O-N 3.39Å; P70-I72 VanDerWaalsContact C-N 3.26Å
73	H	78.7	Confident	79.3	Confident	41 Å²	41	70.5 Å²	70.5	19%	0.19	35%	0.354	C	S	.	.	S	Bend	trans	-88.9	139.6	-179.5	-63.4	103.8	0	0	0	113.1	L68 R69 Q77 I78	L68-H73 PolarHBondContact O-ND1 3.04Å; R69-H73 PolarHBondContact O-N 3.31Å; R69-H73 PolarHBondContact O-ND1 3.02Å; H73-Q77 HydrophobicContact CB-CB 3.99Å; H73-I78 HydrophobicContact CB-CD1 4.39Å; H73-I78 HydrophobicContact CB-CG1 3.76Å
74	T	79.4	Confident	79.2	Confident	68 Å²	68	70.2 Å²	70.2	42%	0.417	35%	0.353	S	S	.	.			trans	-69.4	166.1	169	68.9	0	0	0	0	111.1	E76 Q77 I78	T74-E76 PolarHBondContact O-N 2.86Å; T74-E76 PolarHBondContact OG1-OE2 2.86Å; T74-Q77 PolarHBondContact O-N 3.45Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.44Å; T74-Q77 PolarHBondContact OG1-N 2.95Å; T74-Q77 PolarHBondContact OG1-OE1 2.94Å; T74-I78 VanDerWaalsContact O-CG1 3.31Å; T74-I78 WeakPolarHBondContact O-CG1 3.38Å; T74-I78 PolarHBondContact O-N 3.14Å
75	K	74.5	Confident	79.2	Confident	166 Å²	166	69.5 Å²	69.5	72%	0.722	35%	0.345	S	S	*	.	H	α-helix	trans	-60.5	-35.1	178	-70.5	178.9	-178.5	170.1	0	111.7	L79	K75-L79 VanDerWaalsContact O-CG 3.27Å; K75-L79 WeakPolarHBondContact O-CG 3.07Å; K75-L79 PolarHBondContact O-N 3.1Å
76	E	75.2	Confident	79.3	Confident	129 Å²	129	73.1 Å²	73.1	60%	0.603	36%	0.358	S	S	*	.	H	α-helix	trans	-66.6	-48	177.4	-64.1	70.2	-153.4	0	0	110.5	T74 I78 L79 E80	T74-E76 PolarHBondContact O-N 2.86Å; T74-E76 PolarHBondContact OG1-OE2 2.86Å; E76-I78 VanDerWaalsContact C-N 3.33Å; E76-I78 PolarHBondContact O-N 3.46Å; E76-L79 WeakPolarHBondContact O-CB 3.39Å; E76-L79 PolarHBondContact O-N 2.87Å; E76-L79 VanDerWaalsContact O-N 3.09Å; E76-E80 PolarHBondContact O-N 3.12Å
77	Q	74.5	Confident	79	Confident	93 Å²	93	71.8 Å²	71.8	44%	0.435	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-38.4	176.5	-71.3	169.1	-29.2	0	0	112.6	H73 T74 L79 E80 L81	H73-Q77 HydrophobicContact CB-CB 3.99Å; T74-Q77 PolarHBondContact O-N 3.45Å; T74-Q77 WeakPolarHBondContact OG1-CG 3.44Å; T74-Q77 PolarHBondContact OG1-N 2.95Å; T74-Q77 PolarHBondContact OG1-OE1 2.94Å; Q77-L79 VanDerWaalsContact C-N 3.33Å; Q77-L79 PolarHBondContact O-N 3.38Å; Q77-E80 PolarHBondContact O-N 2.95Å; Q77-L81 WeakPolarHBondContact O-CG 3.39Å; Q77-L81 PolarHBondContact O-N 2.89Å
78	I	81.5	Confident	78.6	Confident	32 Å²	32	72 Å²	72	16%	0.164	35%	0.352	C	S	.	.	H	α-helix	trans	-64.1	-39.7	174.1	-67.3	168.4	0	0	0	111.1	L68 P70 H73 T74 E76 L81 L82	L68-I78 HydrophobicContact CB-CG1 4.44Å; L68-I78 HydrophobicContact CB-CG2 4.37Å; L68-I78 HydrophobicContact CD1-CG2 4.04Å; L68-I78 HydrophobicContact CD2-CG2 4.28Å; L68-I78 HydrophobicContact CG-CG2 4.46Å; P70-I78 HydrophobicContact CB-CD1 3.86Å; H73-I78 HydrophobicContact CB-CD1 4.39Å; H73-I78 HydrophobicContact CB-CG1 3.76Å; T74-I78 VanDerWaalsContact O-CG1 3.31Å; T74-I78 WeakPolarHBondContact O-CG1 3.38Å; T74-I78 PolarHBondContact O-N 3.14Å; E76-I78 VanDerWaalsContact C-N 3.33Å; E76-I78 PolarHBondContact O-N 3.46Å; I78-L81 PolarHBondContact O-N 2.99Å; I78-L82 HydrophobicContact CG2-CD1 4.14Å; I78-L82 VanDerWaalsContact O-CG 3.27Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.13Å; I78-L82 VanDerWaalsContact O-N 3.11Å
79	L	80.8	Confident	78.2	Confident	103 Å²	103	75 Å²	75	54%	0.539	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-41.7	176.3	-74.1	170.4	0	0	0	111.2	K75 E76 Q77 L82 V83	K75-L79 VanDerWaalsContact O-CG 3.27Å; K75-L79 WeakPolarHBondContact O-CG 3.07Å; K75-L79 PolarHBondContact O-N 3.1Å; E76-L79 WeakPolarHBondContact O-CB 3.39Å; E76-L79 PolarHBondContact O-N 2.87Å; E76-L79 VanDerWaalsContact O-N 3.09Å; Q77-L79 VanDerWaalsContact C-N 3.33Å; Q77-L79 PolarHBondContact O-N 3.38Å; L79-L82 PolarHBondContact O-N 3.46Å; L79-V83 WeakPolarHBondContact O-CB 3.4Å; L79-V83 VanDerWaalsContact O-CG2 3.25Å; L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 3.1Å
80	E	79.6	Confident	77.8	Confident	87 Å²	87	75.6 Å²	75.6	41%	0.407	38%	0.382	S	S	.	.	H	α-helix	trans	-61	-44	175.6	-71.8	-53.8	135	0	0	112.3	E76 Q77 L82 V83 L84	E76-E80 PolarHBondContact O-N 3.12Å; Q77-E80 PolarHBondContact O-N 2.95Å; E80-L82 VanDerWaalsContact C-N 3.29Å; E80-L82 PolarHBondContact O-N 3.22Å; E80-V83 PolarHBondContact O-N 3.17Å; E80-L84 VanDerWaalsContact O-CB 3.28Å; E80-L84 WeakPolarHBondContact O-CB 3.47Å; E80-L84 PolarHBondContact O-N 2.75Å
81	L	81	Confident	77.3	Confident	17 Å²	17	73.8 Å²	73.8	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-61.5	-36.8	175.2	-69.5	171.9	0	0	0	112.5	W67 L68 Q77 I78 E85	W67-L81 HydrophobicContact CZ2-CB 4.49Å; L68-L81 HydrophobicContact CD2-CB 3.97Å; L68-L81 HydrophobicContact CD2-CD1 4.31Å; Q77-L81 WeakPolarHBondContact O-CG 3.39Å; Q77-L81 PolarHBondContact O-N 2.89Å; I78-L81 PolarHBondContact O-N 2.99Å; L81-E85 WeakPolarHBondContact O-CB 3.37Å; L81-E85 PolarHBondContact O-N 3.24Å; L81-E85 VanDerWaalsContact O-N 3.07Å
82	L	82.7	Confident	76.9	Confident	71 Å²	71	70.3 Å²	70.3	37%	0.372	36%	0.358	S	S	.	.	H	α-helix	trans	-73	-36.6	175.7	-69.9	171.6	0	0	0	112.6	W67 L68 I78 L79 E80 E85 Q86	W67-L82 HydrophobicContact CH2-CD2 3.81Å; W67-L82 HydrophobicContact CZ3-CD2 3.85Å; L68-L82 HydrophobicContact CD1-CD2 4.27Å; L68-L82 HydrophobicContact CD2-CD2 4.26Å; L68-L82 HydrophobicContact CD2-CG 4.29Å; I78-L82 HydrophobicContact CG2-CD1 4.14Å; I78-L82 VanDerWaalsContact O-CG 3.27Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.13Å; I78-L82 VanDerWaalsContact O-N 3.11Å; L79-L82 PolarHBondContact O-N 3.46Å; E80-L82 VanDerWaalsContact C-N 3.29Å; E80-L82 PolarHBondContact O-N 3.22Å; L82-E85 WeakPolarHBondContact O-CB 3.43Å; L82-E85 PolarHBondContact O-N 3Å; L82-Q86 PolarHBondContact O-N 3.36Å
83	V	79.4	Confident	76.5	Confident	80 Å²	80	72.9 Å²	72.9	49%	0.485	37%	0.368	S	S	.	.	H	α-helix	trans	-68.3	-46.4	176.6	167.9	0	0	0	0	110	L79 E80 E85 Q86 F87	L79-V83 WeakPolarHBondContact O-CB 3.4Å; L79-V83 VanDerWaalsContact O-CG2 3.25Å; L79-V83 WeakPolarHBondContact O-CG2 3.45Å; L79-V83 PolarHBondContact O-N 3.1Å; E80-V83 PolarHBondContact O-N 3.17Å; V83-E85 VanDerWaalsContact C-N 3.27Å; V83-E85 PolarHBondContact O-N 3.08Å; V83-Q86 CarbonylContact O-C 3.59Å; V83-Q86 PolarHBondContact O-N 3.38Å; V83-Q86 VanDerWaalsContact O-N 3.14Å; V83-F87 WeakPolarHBondContact O-CB 3.48Å; V83-F87 PolarHBondContact O-N 3.48Å
84	L	79.9	Confident	75.7	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-54.8	-45.3	172	172.6	60.9	0	0	0	110.9	E80 Q86 F87 L88 P104 S106 A110	E80-L84 VanDerWaalsContact O-CB 3.28Å; E80-L84 WeakPolarHBondContact O-CB 3.47Å; E80-L84 PolarHBondContact O-N 2.75Å; L84-Q86 PolarHBondContact O-N 3.36Å; L84-F87 PolarHBondContact O-N 3.25Å; L84-L88 HydrophobicContact CD1-CD1 4.31Å; L84-L88 HydrophobicContact CD1-CD2 4.49Å; L84-L88 HydrophobicContact CD1-CG 4.18Å; L84-L88 WeakPolarHBondContact O-CG 3.33Å; L84-L88 PolarHBondContact O-N 3.2Å; L84-P104 HydrophobicContact CD1-CB 4.49Å; L84-P104 HydrophobicContact CD1-CG 4.22Å; L84-P104 VanDerWaalsContact CD2-O 3.31Å; L84-P104 WeakPolarHBondContact CD2-O 3.21Å; L84-S106 WeakPolarHBondContact CD1-O 3.36Å; L84-A110 HydrophobicContact CD1-CB 3.47Å; L84-A110 VanDerWaalsContact CD1-CB 3.47Å
85	E	82.3	Confident	75	Confident	22 Å²	22	76.1 Å²	76.1	10%	0.103	38%	0.379	C	S	.	.	H	α-helix	trans	-59.7	-46.2	176	-175	60.3	-162	0	0	112.6	R39 R43 W67 L81 L82 V83 F87 L88 T89	R39-E85 IonicContact CZ-OE2 3.95Å; R39-E85 VanDerWaalsContact CZ-OE2 3.28Å; R39-E85 IonicContact NE-OE2 3.2Å; R39-E85 PolarHBondContact NE-OE2 3.3Å; R39-E85 IonicContact NH2-OE2 3.19Å; R39-E85 PolarHBondContact NH2-OE2 2.85Å; R43-E85 VanDerWaalsContact CG-OE1 3.29Å; R43-E85 WeakPolarHBondContact CG-OE1 3.4Å; R43-E85 IonicContact CZ-OE1 3.83Å; R43-E85 IonicContact CZ-OE2 3.98Å; R43-E85 IonicContact NE-OE1 3.26Å; R43-E85 PolarHBondContact NE-OE1 2.77Å; R43-E85 IonicContact NE-OE2 2.87Å; R43-E85 PolarHBondContact NE-OE2 2.85Å; R43-E85 IonicContact NH2-OE1 3.8Å; R43-E85 PolarHBondContact NH2-OE1 3.39Å; R43-E85 IonicContact NH2-OE2 3.11Å; R43-E85 PolarHBondContact NH2-OE2 2.85Å; W67-E85 HydrophobicContact CH2-CB 3.75Å; W67-E85 HydrophobicContact CH2-CG 3.8Å; W67-E85 HydrophobicContact CZ2-CB 4.01Å; W67-E85 HydrophobicContact CZ2-CG 4.29Å; L81-E85 WeakPolarHBondContact O-CB 3.37Å; L81-E85 PolarHBondContact O-N 3.24Å; L81-E85 VanDerWaalsContact O-N 3.07Å; L82-E85 WeakPolarHBondContact O-CB 3.43Å; L82-E85 PolarHBondContact O-N 3Å; V83-E85 VanDerWaalsContact C-N 3.27Å; V83-E85 PolarHBondContact O-N 3.08Å; E85-F87 VanDerWaalsContact C-N 3.33Å; E85-F87 PolarHBondContact O-N 3.41Å; E85-L88 PolarHBondContact O-N 3.23Å; E85-T89 WeakPolarHBondContact O-CG2 3.34Å; E85-T89 PolarHBondContact O-N 2.92Å
86	Q	81.3	Confident	74.6	Confident	119 Å²	119	69.9 Å²	69.9	56%	0.556	35%	0.352	S	S	*	.	H	α-helix	trans	-65.9	-36.4	177.1	-175.1	57.4	65.9	0	0	112	L82 V83 L84 T89	L82-Q86 PolarHBondContact O-N 3.36Å; V83-Q86 CarbonylContact O-C 3.59Å; V83-Q86 PolarHBondContact O-N 3.38Å; V83-Q86 VanDerWaalsContact O-N 3.14Å; L84-Q86 PolarHBondContact O-N 3.36Å; Q86-T89 PolarHBondContact NE2-OG1 3.27Å; Q86-T89 PolarHBondContact O-N 3.25Å; Q86-T89 PolarHBondContact O-OG1 2.97Å
87	F	74.3	Confident	74.4	Confident	48 Å²	48	66.2 Å²	66.2	21%	0.211	35%	0.345	C	S	.	.	H	α-helix	trans	-63.1	-46.6	177	-177.2	-108.3	0	0	0	111.4	V83 L84 E85 T89 I90 L91 A110 V111	V83-F87 WeakPolarHBondContact O-CB 3.48Å; V83-F87 PolarHBondContact O-N 3.48Å; L84-F87 PolarHBondContact O-N 3.25Å; E85-F87 VanDerWaalsContact C-N 3.33Å; E85-F87 PolarHBondContact O-N 3.41Å; F87-T89 PolarHBondContact O-N 3.12Å; F87-T89 VanDerWaalsContact O-N 3.12Å; F87-I90 HydrophobicContact CD2-CD1 4.05Å; F87-I90 HydrophobicContact CD2-CG1 4.39Å; F87-I90 WeakPolarHBondContact O-CG1 3.43Å; F87-I90 PolarHBondContact O-N 3.35Å; F87-L91 HydrophobicContact CD1-CD1 4.25Å; F87-L91 HydrophobicContact CE1-CD1 3.89Å; F87-L91 HydrophobicContact CE1-CD2 4.17Å; F87-L91 HydrophobicContact CE1-CG 4.22Å; F87-L91 HydrophobicContact CE2-CD2 4.43Å; F87-L91 HydrophobicContact CZ-CD1 4.47Å; F87-L91 HydrophobicContact CZ-CD2 3.9Å; F87-L91 HydrophobicContact CZ-CG 4.39Å; F87-L91 PolarHBondContact O-N 2.88Å; F87-A110 HydrophobicContact CD1-CB 3.88Å; F87-A110 HydrophobicContact CE1-CB 3.9Å; F87-V111 HydrophobicContact CE1-CG2 3.95Å; F87-V111 HydrophobicContact CE2-CG2 4.06Å; F87-V111 HydrophobicContact CZ-CG2 3.6Å
88	L	75.1	Confident	74.1	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-23.3	177.4	-64.8	178.7	0	0	0	113.5	L84 E85 L91 Q96 V99	L84-L88 HydrophobicContact CD1-CD1 4.31Å; L84-L88 HydrophobicContact CD1-CD2 4.49Å; L84-L88 HydrophobicContact CD1-CG 4.18Å; L84-L88 WeakPolarHBondContact O-CG 3.33Å; L84-L88 PolarHBondContact O-N 3.2Å; E85-L88 PolarHBondContact O-N 3.23Å; L88-L91 HydrophobicContact CD2-CD1 4.07Å; L88-Q96 PolarHBondContact O-NE2 3.24Å; L88-V99 HydrophobicContact CD2-CB 4.24Å; L88-V99 HydrophobicContact CD2-CG1 3.39Å
89	T	73.4	Confident	73.4	Confident	80 Å²	80	62.7 Å²	62.7	49%	0.491	33%	0.325	S	S	.	.	H	α-helix	trans	-81	-16.7	176.6	65	0	0	0	0	114.6	E85 Q86 F87	E85-T89 WeakPolarHBondContact O-CG2 3.34Å; E85-T89 PolarHBondContact O-N 2.92Å; Q86-T89 PolarHBondContact NE2-OG1 3.27Å; Q86-T89 PolarHBondContact O-N 3.25Å; Q86-T89 PolarHBondContact O-OG1 2.97Å; F87-T89 PolarHBondContact O-N 3.12Å; F87-T89 VanDerWaalsContact O-N 3.12Å
90	I	73.2	Confident	72.9	Confident	117 Å²	117	63.4 Å²	63.4	60%	0.6	32%	0.321	S	S	*	.	H	α-helix	trans	-98.9	-12.4	-179.6	58.4	161.9	0	0	0	112.9	F87	F87-I90 HydrophobicContact CD2-CD1 4.05Å; F87-I90 HydrophobicContact CD2-CG1 4.39Å; F87-I90 WeakPolarHBondContact O-CG1 3.43Å; F87-I90 PolarHBondContact O-N 3.35Å
91	L	67.8	Low	72.5	Confident	23 Å²	23	66.2 Å²	66.2	12%	0.12	33%	0.334	C	S	.	.	S	Bend	trans	-68.7	141.2	175.2	-70.4	176.4	0	0	0	111.3	F87 L88 L95 Q96 V99 V114	F87-L91 HydrophobicContact CD1-CD1 4.25Å; F87-L91 HydrophobicContact CE1-CD1 3.89Å; F87-L91 HydrophobicContact CE1-CD2 4.17Å; F87-L91 HydrophobicContact CE1-CG 4.22Å; F87-L91 HydrophobicContact CE2-CD2 4.43Å; F87-L91 HydrophobicContact CZ-CD1 4.47Å; F87-L91 HydrophobicContact CZ-CD2 3.9Å; F87-L91 HydrophobicContact CZ-CG 4.39Å; F87-L91 PolarHBondContact O-N 2.88Å; L88-L91 HydrophobicContact CD2-CD1 4.07Å; L91-L95 HydrophobicContact CB-CB 4.5Å; L91-Q96 HydrophobicContact CB-CB 4.48Å; L91-V99 HydrophobicContact CD1-CB 4.43Å; L91-V99 HydrophobicContact CD1-CG2 3.92Å; L91-V114 HydrophobicContact CD1-CG2 4.08Å; L91-V114 HydrophobicContact CD2-CG2 4.14Å
92	P	68.4	Low	72	Confident	68 Å²	68	70.4 Å²	70.4	44%	0.442	35%	0.353	S	S	.	.			trans	-50.1	149.3	166	-24.8	33	0	0	0	112.2	E94 L95 Q96	P92-E94 WeakPolarHBondContact CB-OE2 3.32Å; P92-E94 PolarHBondContact O-N 3.22Å; P92-L95 HydrophobicContact CG-CD1 4.18Å; P92-L95 PolarHBondContact O-N 3.31Å; P92-L95 VanDerWaalsContact O-N 3.15Å; P92-Q96 WeakPolarHBondContact O-CB 3.26Å; P92-Q96 PolarHBondContact O-N 3.05Å
93	E	63.2	Low	71.3	Confident	160 Å²	160	73.1 Å²	73.1	75%	0.748	36%	0.363	S	S	*	.	H	α-helix	trans	-59.3	-32.3	-174.7	-69.9	-173	173.9	0	0	112.3	Q96 A97	E93-Q96 PolarHBondContact O-N 3.22Å; E93-A97 PolarHBondContact O-N 2.98Å
94	E	61.9	Low	70.7	Confident	146 Å²	146	69.7 Å²	69.7	68%	0.682	34%	0.343	S	S	*	.	H	α-helix	trans	-66	-46.2	177.8	-56.2	82.4	-175.2	0	0	111.9	P92	P92-E94 WeakPolarHBondContact CB-OE2 3.32Å; P92-E94 PolarHBondContact O-N 3.22Å
95	L	64.3	Low	70	Confident	31 Å²	31	75.3 Å²	75.3	16%	0.162	37%	0.369	C	S	.	.	H	α-helix	trans	-72.8	-32.1	178	-63.9	-179.1	0	0	0	111.5	L91 P92 A97 W98 V99 V114 L117	L91-L95 HydrophobicContact CB-CB 4.5Å; P92-L95 HydrophobicContact CG-CD1 4.18Å; P92-L95 PolarHBondContact O-N 3.31Å; P92-L95 VanDerWaalsContact O-N 3.15Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.39Å; L95-W98 PolarHBondContact O-N 3.42Å; L95-V99 WeakPolarHBondContact O-CB 3.33Å; L95-V99 WeakPolarHBondContact O-CG2 3.15Å; L95-V99 PolarHBondContact O-N 3.33Å; L95-V114 HydrophobicContact CD1-CG1 4.18Å; L95-L117 HydrophobicContact CD2-CD2 3.44Å; L95-L117 VanDerWaalsContact CD2-CD2 3.44Å; L95-L117 HydrophobicContact CD2-CG 4.43Å
96	Q	67.7	Low	69.5	Low	35 Å²	35	75.5 Å²	75.5	16%	0.164	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-36.3	180	-164.7	-173.8	57	0	0	112.4	L88 L91 P92 E93 R100	L88-Q96 PolarHBondContact O-NE2 3.24Å; L91-Q96 HydrophobicContact CB-CB 4.48Å; P92-Q96 WeakPolarHBondContact O-CB 3.26Å; P92-Q96 PolarHBondContact O-N 3.05Å; E93-Q96 PolarHBondContact O-N 3.22Å; Q96-R100 VanDerWaalsContact CD-CZ 3.45Å; Q96-R100 VanDerWaalsContact NE2-NH2 3.12Å; Q96-R100 WeakPolarHBondContact O-CB 3.49Å; Q96-R100 WeakPolarHBondContact O-CD 3.36Å; Q96-R100 WeakPolarHBondContact O-CG 3.45Å; Q96-R100 PolarHBondContact O-N 3.41Å; Q96-R100 VanDerWaalsContact O-N 3.17Å; Q96-R100 VanDerWaalsContact OE1-CZ 3.31Å
97	A	70.1	Confident	68.9	Low	53 Å²	53	70.2 Å²	70.2	44%	0.438	35%	0.351	S	S	.	.	H	α-helix	trans	-66.5	-45.5	176.2	0	0	0	0	0	111.3	E93 L95 R100 E101	E93-A97 PolarHBondContact O-N 2.98Å; L95-A97 VanDerWaalsContact C-N 3.33Å; L95-A97 PolarHBondContact O-N 3.39Å; A97-R100 WeakPolarHBondContact O-CB 3.46Å; A97-R100 PolarHBondContact O-N 3.21Å; A97-E101 PolarHBondContact O-N 3.28Å
98	W	67.6	Low	68.8	Low	50 Å²	50	74.3 Å²	74.3	19%	0.189	37%	0.37	C	S	.	.	H	α-helix	trans	-68.6	-43.7	-178.6	-174.9	91.2	0	0	0	112	L95 R100 E101 H102 V113 L117	L95-W98 PolarHBondContact O-N 3.42Å; W98-R100 PolarHBondContact O-N 3.05Å; W98-E101 WeakPolarHBondContact O-CB 3.33Å; W98-E101 PolarHBondContact O-N 3.23Å; W98-H102 AromaticContact CE2-CD2 3.73Å; W98-H102 AromaticContact CE2-NE2 3.58Å; W98-H102 AromaticContact CZ2-CD2 3.75Å; W98-H102 AromaticContact CZ2-NE2 3.47Å; W98-H102 WeakPolarHBondContact CZ2-NE2 3.47Å; W98-H102 AromaticContact NE1-NE2 3.82Å; W98-H102 PolarHBondContact O-CD2 2.99Å; W98-H102 PolarHBondContact O-N 3.22Å; W98-V113 HydrophobicContact CE3-CG1 3.61Å; W98-V113 VanDerWaalsContact CH2-C 3.43Å; W98-V113 HydrophobicContact CH2-CB 4.05Å; W98-V113 HydrophobicContact CH2-CG1 3.41Å; W98-V113 VanDerWaalsContact CH2-CG1 3.41Å; W98-V113 WeakPolarHBondContact CH2-O 3.31Å; W98-V113 HydrophobicContact CZ2-CG1 4.45Å; W98-V113 HydrophobicContact CZ3-CB 3.81Å; W98-V113 HydrophobicContact CZ3-CG1 2.95Å; W98-V113 WeakPolarHBondContact CZ3-O 3.46Å; W98-L117 HydrophobicContact CB-CD2 4.19Å; W98-L117 HydrophobicContact CD2-CB 4.19Å; W98-L117 HydrophobicContact CD2-CD2 3.65Å; W98-L117 HydrophobicContact CD2-CG 4.34Å; W98-L117 HydrophobicContact CE3-CB 4.02Å; W98-L117 HydrophobicContact CE3-CD2 3.77Å; W98-L117 HydrophobicContact CE3-CG 4.48Å; W98-L117 HydrophobicContact CG-CD2 3.8Å; W98-L117 HydrophobicContact CH2-CB 3.76Å; W98-L117 HydrophobicContact CZ2-CB 3.94Å; W98-L117 HydrophobicContact CZ3-CB 3.71Å; W98-L117 HydrophobicContact CZ3-CD2 4.32Å
99	V	68.5	Low	68.7	Low	0 Å²	0	78.1 Å²	78.1	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-61.8	-31.7	173.4	178.1	0	0	0	0	112.1	L88 L91 L95 E101 H102 H103 P104 A110 V113 V114	L88-V99 HydrophobicContact CD2-CB 4.24Å; L88-V99 HydrophobicContact CD2-CG1 3.39Å; L91-V99 HydrophobicContact CD1-CB 4.43Å; L91-V99 HydrophobicContact CD1-CG2 3.92Å; L95-V99 WeakPolarHBondContact O-CB 3.33Å; L95-V99 WeakPolarHBondContact O-CG2 3.15Å; L95-V99 PolarHBondContact O-N 3.33Å; V99-E101 VanDerWaalsContact C-N 3.34Å; V99-H102 PolarHBondContact O-N 3Å; V99-H103 PolarHBondContact O-N 3.2Å; V99-P104 HydrophobicContact CG1-CG 3.66Å; V99-P104 WeakPolarHBondContact O-CD 3.36Å; V99-A110 HydrophobicContact CG1-CB 4.16Å; V99-V113 HydrophobicContact CB-CG1 4.37Å; V99-V113 HydrophobicContact CG1-CG1 4.42Å; V99-V113 HydrophobicContact CG2-CG1 4.03Å; V99-V114 HydrophobicContact CG2-CG2 3.35Å
100	R	68.9	Low	68.6	Low	119 Å²	119	74.3 Å²	74.3	45%	0.449	37%	0.365	S	S	.	.	H	α-helix	trans	-69.5	-28.5	175.4	-78	169.4	-177.1	159.7	3.6	113	Q96 A97 W98 H102 H103	Q96-R100 VanDerWaalsContact CD-CZ 3.45Å; Q96-R100 VanDerWaalsContact NE2-NH2 3.12Å; Q96-R100 WeakPolarHBondContact O-CB 3.49Å; Q96-R100 WeakPolarHBondContact O-CD 3.36Å; Q96-R100 WeakPolarHBondContact O-CG 3.45Å; Q96-R100 PolarHBondContact O-N 3.41Å; Q96-R100 VanDerWaalsContact O-N 3.17Å; Q96-R100 VanDerWaalsContact OE1-CZ 3.31Å; A97-R100 WeakPolarHBondContact O-CB 3.46Å; A97-R100 PolarHBondContact O-N 3.21Å; W98-R100 PolarHBondContact O-N 3.05Å; R100-H102 VanDerWaalsContact C-N 3.32Å; R100-H103 PolarHBondContact O-CE1 2.88Å; R100-H103 PolarHBondContact O-ND1 3.09Å
101	E	71.6	Confident	68.7	Low	145 Å²	145	71.1 Å²	71.1	68%	0.678	35%	0.351	S	S	*	.	H	α-helix	trans	-70.1	-32.3	176.1	-69.9	-175.6	168.2	0	0	111.8	A97 W98 V99 H103	A97-E101 PolarHBondContact O-N 3.28Å; W98-E101 WeakPolarHBondContact O-CB 3.33Å; W98-E101 PolarHBondContact O-N 3.23Å; V99-E101 VanDerWaalsContact C-N 3.34Å; E101-H103 PolarHBondContact O-CE1 3.18Å; E101-H103 PolarHBondContact O-ND1 3.15Å
102	H	69.8	Low	69.3	Low	106 Å²	106	72 Å²	72	49%	0.491	36%	0.361	S	S	.	.	S	Bend	trans	-86.3	-4.7	-179.6	-73.8	-84.8	0	0	0	114.9	W98 V99 R100 V113	W98-H102 AromaticContact CE2-CD2 3.73Å; W98-H102 AromaticContact CE2-NE2 3.58Å; W98-H102 AromaticContact CZ2-CD2 3.75Å; W98-H102 AromaticContact CZ2-NE2 3.47Å; W98-H102 WeakPolarHBondContact CZ2-NE2 3.47Å; W98-H102 AromaticContact NE1-NE2 3.82Å; W98-H102 PolarHBondContact O-CD2 2.99Å; W98-H102 PolarHBondContact O-N 3.22Å; V99-H102 PolarHBondContact O-N 3Å; R100-H102 VanDerWaalsContact C-N 3.32Å; H102-V113 HydrophobicContact CB-CG1 3.74Å; H102-V113 HydrophobicContact CB-CG2 4.02Å
103	H	67.8	Low	69.7	Low	127 Å²	127	69.8 Å²	69.8	59%	0.588	35%	0.346	S	S	*	.			trans	46	55.6	173.9	-60.4	79.4	0	0	0	115.2	V99 R100 E101 E105	V99-H103 PolarHBondContact O-N 3.2Å; R100-H103 PolarHBondContact O-CE1 2.88Å; R100-H103 PolarHBondContact O-ND1 3.09Å; E101-H103 PolarHBondContact O-CE1 3.18Å; E101-H103 PolarHBondContact O-ND1 3.15Å; H103-E105 PolarHBondContact O-N 3.02Å
104	P	68.7	Low	70.1	Confident	9 Å²	9	62.7 Å²	62.7	6%	0.058	31%	0.314	C	S	.	.			trans	-63.1	134	-178.3	28.3	-36.8	0	0	0	111.3	L84 V99 E109 A110	L84-P104 HydrophobicContact CD1-CB 4.49Å; L84-P104 HydrophobicContact CD1-CG 4.22Å; L84-P104 VanDerWaalsContact CD2-O 3.31Å; L84-P104 WeakPolarHBondContact CD2-O 3.21Å; V99-P104 HydrophobicContact CG1-CG 3.66Å; V99-P104 WeakPolarHBondContact O-CD 3.36Å; P104-E109 HydrophobicContact CB-CB 3.79Å; P104-A110 HydrophobicContact CB-CB 3.76Å; P104-A110 HydrophobicContact CG-CB 3.68Å
105	E	65.1	Low	70.9	Confident	117 Å²	117	61.2 Å²	61.2	55%	0.547	31%	0.307	S	S	.	.	S	Bend	trans	-92.6	-16.1	179.9	-58.4	-169.9	171.4	0	0	111.8	F32 H103 E109	F32-E105 WeakPolarHBondContact CE1-OE1 3.48Å; H103-E105 PolarHBondContact O-N 3.02Å; E105-E109 PolarHBondContact N-OE2 3.2Å
106	S	69.9	Low	71.5	Confident	26 Å²	26	64 Å²	64	18%	0.182	32%	0.322	C	S	.	.	S	Bend	trans	-133	161.2	176.1	72.4	0	0	0	0	112.8	L84 E108 E109 A110	L84-S106 WeakPolarHBondContact CD1-O 3.36Å; S106-E108 PolarHBondContact O-N 3.16Å; S106-E109 PolarHBondContact O-N 3.1Å; S106-E109 WeakPolarHBondContact OG-CG 3.44Å; S106-E109 PolarHBondContact OG-N 3.32Å; S106-E109 VanDerWaalsContact OG-N 3.09Å; S106-A110 PolarHBondContact O-N 3.4Å; S106-A110 VanDerWaalsContact O-N 3.11Å
107	G	69.1	Low	71.7	Confident	9 Å²	9	63.4 Å²	63.4	9%	0.093	32%	0.32	C	S	.	.	H	α-helix	trans	-60.9	-34.1	172.8	0	0	0	0	0	112.4	A110 V111	G107-A110 PolarHBondContact O-N 3.17Å; G107-V111 VanDerWaalsContact O-CG2 3.3Å; G107-V111 WeakPolarHBondContact O-CG2 3.35Å; G107-V111 PolarHBondContact O-N 3.14Å; G107-V111 VanDerWaalsContact O-N 3.08Å
108	E	72.9	Confident	71.6	Confident	134 Å²	134	65.9 Å²	65.9	63%	0.626	32%	0.322	S	S	*	.	H	α-helix	trans	-67	-43.7	177.8	-64	-179.1	168.6	0	0	111.4	S106 A110 V111 A112	S106-E108 PolarHBondContact O-N 3.16Å; E108-A110 VanDerWaalsContact C-N 3.35Å; E108-A110 PolarHBondContact O-N 2.84Å; E108-V111 PolarHBondContact O-N 3.18Å; E108-A112 PolarHBondContact O-N 2.96Å
109	E	72.9	Confident	71.7	Confident	86 Å²	86	69.2 Å²	69.2	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-40.8	174.3	-76.3	166.6	-150.8	0	0	112	P104 E105 S106 V111 A112 V113	P104-E109 HydrophobicContact CB-CB 3.79Å; E105-E109 PolarHBondContact N-OE2 3.2Å; S106-E109 PolarHBondContact O-N 3.1Å; S106-E109 WeakPolarHBondContact OG-CG 3.44Å; S106-E109 PolarHBondContact OG-N 3.32Å; S106-E109 VanDerWaalsContact OG-N 3.09Å; E109-V111 VanDerWaalsContact C-N 3.28Å; E109-V111 PolarHBondContact O-N 2.85Å; E109-A112 PolarHBondContact O-N 2.9Å; E109-V113 VanDerWaalsContact O-CB 3.24Å; E109-V113 WeakPolarHBondContact O-CB 3.45Å; E109-V113 WeakPolarHBondContact O-CG2 3.42Å; E109-V113 PolarHBondContact O-N 3.34Å
110	A	72.1	Confident	71.8	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-64.4	-34.5	177.2	0	0	0	0	0	112.4	L84 F87 V99 P104 S106 G107 E108 V114	L84-A110 HydrophobicContact CD1-CB 3.47Å; L84-A110 VanDerWaalsContact CD1-CB 3.47Å; F87-A110 HydrophobicContact CD1-CB 3.88Å; F87-A110 HydrophobicContact CE1-CB 3.9Å; V99-A110 HydrophobicContact CG1-CB 4.16Å; P104-A110 HydrophobicContact CB-CB 3.76Å; P104-A110 HydrophobicContact CG-CB 3.68Å; S106-A110 PolarHBondContact O-N 3.4Å; S106-A110 VanDerWaalsContact O-N 3.11Å; G107-A110 PolarHBondContact O-N 3.17Å; E108-A110 VanDerWaalsContact C-N 3.35Å; E108-A110 PolarHBondContact O-N 2.84Å; A110-V114 VanDerWaalsContact O-CG2 3.3Å; A110-V114 WeakPolarHBondContact O-CG2 3.34Å; A110-V114 PolarHBondContact O-N 3.49Å; A110-V114 VanDerWaalsContact O-N 3.13Å
111	V	74.4	Confident	71.3	Confident	50 Å²	50	76.9 Å²	76.9	30%	0.303	39%	0.385	S	S	.	.	H	α-helix	trans	-71.8	-46.9	176	170.4	0	0	0	0	110.7	F87 G107 E108 E109 V113 V114 E115	F87-V111 HydrophobicContact CE1-CG2 3.95Å; F87-V111 HydrophobicContact CE2-CG2 4.06Å; F87-V111 HydrophobicContact CZ-CG2 3.6Å; G107-V111 VanDerWaalsContact O-CG2 3.3Å; G107-V111 WeakPolarHBondContact O-CG2 3.35Å; G107-V111 PolarHBondContact O-N 3.14Å; G107-V111 VanDerWaalsContact O-N 3.08Å; E108-V111 PolarHBondContact O-N 3.18Å; E109-V111 VanDerWaalsContact C-N 3.28Å; E109-V111 PolarHBondContact O-N 2.85Å; V111-V113 VanDerWaalsContact C-N 3.28Å; V111-V113 PolarHBondContact O-N 3.27Å; V111-V114 PolarHBondContact O-N 3.5Å; V111-E115 HydrophobicContact CG1-CG 4.16Å; V111-E115 WeakPolarHBondContact O-CG 3.4Å; V111-E115 PolarHBondContact O-N 3.49Å
112	A	79.8	Confident	70.5	Confident	42 Å²	42	74.2 Å²	74.2	35%	0.347	38%	0.382	S	S	.	.	H	α-helix	trans	-58.7	-43.3	178.9	0	0	0	0	0	111.4	E108 E109 E115 D116	E108-A112 PolarHBondContact O-N 2.96Å; E109-A112 PolarHBondContact O-N 2.9Å; A112-E115 PolarHBondContact O-N 3.35Å; A112-D116 WeakPolarHBondContact O-CB 3.35Å; A112-D116 VanDerWaalsContact O-CG 3.23Å; A112-D116 PolarHBondContact O-N 3.41Å
113	V	77.1	Confident	69.6	Low	20 Å²	20	75.6 Å²	75.6	12%	0.121	39%	0.389	C	S	.	.	H	α-helix	trans	-54.2	-59.3	171.2	167.7	0	0	0	0	107.9	W98 V99 H102 E109 V111 E115 D116 L117	W98-V113 HydrophobicContact CE3-CG1 3.61Å; W98-V113 VanDerWaalsContact CH2-C 3.43Å; W98-V113 HydrophobicContact CH2-CB 4.05Å; W98-V113 HydrophobicContact CH2-CG1 3.41Å; W98-V113 VanDerWaalsContact CH2-CG1 3.41Å; W98-V113 WeakPolarHBondContact CH2-O 3.31Å; W98-V113 HydrophobicContact CZ2-CG1 4.45Å; W98-V113 HydrophobicContact CZ3-CB 3.81Å; W98-V113 HydrophobicContact CZ3-CG1 2.95Å; W98-V113 WeakPolarHBondContact CZ3-O 3.46Å; V99-V113 HydrophobicContact CB-CG1 4.37Å; V99-V113 HydrophobicContact CG1-CG1 4.42Å; V99-V113 HydrophobicContact CG2-CG1 4.03Å; H102-V113 HydrophobicContact CB-CG1 3.74Å; H102-V113 HydrophobicContact CB-CG2 4.02Å; E109-V113 VanDerWaalsContact O-CB 3.24Å; E109-V113 WeakPolarHBondContact O-CB 3.45Å; E109-V113 WeakPolarHBondContact O-CG2 3.42Å; E109-V113 PolarHBondContact O-N 3.34Å; V111-V113 VanDerWaalsContact C-N 3.28Å; V111-V113 PolarHBondContact O-N 3.27Å; V113-E115 VanDerWaalsContact C-N 3.29Å; V113-E115 PolarHBondContact O-N 3.4Å; V113-D116 WeakPolarHBondContact O-CB 3.49Å; V113-D116 PolarHBondContact O-N 3.13Å; V113-D116 VanDerWaalsContact O-N 3.12Å; V113-L117 PolarHBondContact O-N 3.32Å
114	V	72.9	Confident	68.4	Low	12 Å²	12	75.2 Å²	75.2	7%	0.073	40%	0.397	C	S	.	.	H	α-helix	trans	-56.5	-40.6	-178.4	172.9	0	0	0	0	113.2	L91 L95 V99 A110 V111 L117 E118	L91-V114 HydrophobicContact CD1-CG2 4.08Å; L91-V114 HydrophobicContact CD2-CG2 4.14Å; L95-V114 HydrophobicContact CD1-CG1 4.18Å; V99-V114 HydrophobicContact CG2-CG2 3.35Å; A110-V114 VanDerWaalsContact O-CG2 3.3Å; A110-V114 WeakPolarHBondContact O-CG2 3.34Å; A110-V114 PolarHBondContact O-N 3.49Å; A110-V114 VanDerWaalsContact O-N 3.13Å; V111-V114 PolarHBondContact O-N 3.5Å; V114-L117 PolarHBondContact O-N 3.06Å; V114-E118 HydrophobicContact CG1-CG 4.47Å; V114-E118 WeakPolarHBondContact O-CG 3.35Å; V114-E118 PolarHBondContact O-N 2.9Å
115	E	77	Confident	67.2	Low	114 Å²	114	78.2 Å²	78.2	53%	0.533	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-39	178.6	-71.3	178	156.3	0	0	112.2	V111 A112 V113 L117 E118 Q119	V111-E115 HydrophobicContact CG1-CG 4.16Å; V111-E115 WeakPolarHBondContact O-CG 3.4Å; V111-E115 PolarHBondContact O-N 3.49Å; A112-E115 PolarHBondContact O-N 3.35Å; V113-E115 VanDerWaalsContact C-N 3.29Å; V113-E115 PolarHBondContact O-N 3.4Å; E115-L117 VanDerWaalsContact C-N 3.33Å; E115-L117 PolarHBondContact O-N 2.84Å; E115-E118 PolarHBondContact O-N 3.19Å; E115-Q119 WeakPolarHBondContact O-CB 3.42Å; E115-Q119 PolarHBondContact O-N 3.3Å
116	D	77	Confident	65.5	Low	90 Å²	90	80 Å²	80	48%	0.481	44%	0.444	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175.1	-73	-20.5	0	0	0	111.1	A112 V113 Q119 E120	A112-D116 WeakPolarHBondContact O-CB 3.35Å; A112-D116 VanDerWaalsContact O-CG 3.23Å; A112-D116 PolarHBondContact O-N 3.41Å; V113-D116 WeakPolarHBondContact O-CB 3.49Å; V113-D116 PolarHBondContact O-N 3.13Å; V113-D116 VanDerWaalsContact O-N 3.12Å; D116-Q119 PolarHBondContact O-N 2.97Å; D116-E120 WeakPolarHBondContact O-CG 3.44Å; D116-E120 PolarHBondContact O-N 2.89Å
117	L	71.8	Confident	63.9	Low	23 Å²	23	87.7 Å²	87.7	12%	0.12	48%	0.477	C	S	.	.	H	α-helix	trans	-67.7	-40.9	176.4	179.9	63	0	0	0	112.1	L95 W98 V113 V114 E115 Q119 E120 L121	L95-L117 HydrophobicContact CD2-CD2 3.44Å; L95-L117 VanDerWaalsContact CD2-CD2 3.44Å; L95-L117 HydrophobicContact CD2-CG 4.43Å; W98-L117 HydrophobicContact CB-CD2 4.19Å; W98-L117 HydrophobicContact CD2-CB 4.19Å; W98-L117 HydrophobicContact CD2-CD2 3.65Å; W98-L117 HydrophobicContact CD2-CG 4.34Å; W98-L117 HydrophobicContact CE3-CB 4.02Å; W98-L117 HydrophobicContact CE3-CD2 3.77Å; W98-L117 HydrophobicContact CE3-CG 4.48Å; W98-L117 HydrophobicContact CG-CD2 3.8Å; W98-L117 HydrophobicContact CH2-CB 3.76Å; W98-L117 HydrophobicContact CZ2-CB 3.94Å; W98-L117 HydrophobicContact CZ3-CB 3.71Å; W98-L117 HydrophobicContact CZ3-CD2 4.32Å; V113-L117 PolarHBondContact O-N 3.32Å; V114-L117 PolarHBondContact O-N 3.06Å; E115-L117 VanDerWaalsContact C-N 3.33Å; E115-L117 PolarHBondContact O-N 2.84Å; L117-Q119 PolarHBondContact O-N 3.47Å; L117-E120 PolarHBondContact O-N 3.21Å; L117-L121 HydrophobicContact CD1-CD1 4.3Å; L117-L121 HydrophobicContact CD1-CG 4.34Å; L117-L121 HydrophobicContact CG-CD1 4.08Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 VanDerWaalsContact O-CG 3.25Å; L117-L121 WeakPolarHBondContact O-CG 3.36Å; L117-L121 PolarHBondContact O-N 2.95Å
118	E	69	Low	62.2	Low	104 Å²	104	91.3 Å²	91.3	49%	0.486	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-34.2	175.1	-73.8	-175.3	161.9	0	0	111.6	V114 E115 S122	V114-E118 HydrophobicContact CG1-CG 4.47Å; V114-E118 WeakPolarHBondContact O-CG 3.35Å; V114-E118 PolarHBondContact O-N 2.9Å; E115-E118 PolarHBondContact O-N 3.19Å; E118-S122 VanDerWaalsContact O-CB 3.26Å; E118-S122 WeakPolarHBondContact O-CB 3.24Å; E118-S122 PolarHBondContact O-N 3.5Å; E118-S122 VanDerWaalsContact O-N 3.14Å; E118-S122 PolarHBondContact O-OG 2.99Å
119	Q	69.9	Low	60.4	Low	121 Å²	121	91.9 Å²	91.9	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-71.1	-41.9	174.8	-167.6	169.7	-2.8	0	0	111.9	E115 D116 L117 L121 S122 E123	E115-Q119 WeakPolarHBondContact O-CB 3.42Å; E115-Q119 PolarHBondContact O-N 3.3Å; D116-Q119 PolarHBondContact O-N 2.97Å; L117-Q119 PolarHBondContact O-N 3.47Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.28Å; Q119-S122 PolarHBondContact O-N 2.72Å; Q119-S122 VanDerWaalsContact O-N 3.12Å; Q119-E123 PolarHBondContact O-N 3.28Å
120	E	69.1	Low	58.3	Low	145 Å²	145	94.1 Å²	94.1	68%	0.678	53%	0.527	S	S	*	.	H	α-helix	trans	-61.6	-35.5	173.4	-75	-173.1	169.1	0	0	112.7	D116 L117 S122	D116-E120 WeakPolarHBondContact O-CG 3.44Å; D116-E120 PolarHBondContact O-N 2.89Å; L117-E120 PolarHBondContact O-N 3.21Å; E120-S122 VanDerWaalsContact C-N 3.32Å
121	L	60	Low	56.3	Low	135 Å²	135	103.3 Å²	103.3	71%	0.707	57%	0.57	S	S	*	*	H	α-helix	trans	-78.2	-14.8	176.4	-67.3	171.4	0	0	0	113.5	L117 Q119	L117-L121 HydrophobicContact CD1-CD1 4.3Å; L117-L121 HydrophobicContact CD1-CG 4.34Å; L117-L121 HydrophobicContact CG-CD1 4.08Å; L117-L121 WeakPolarHBondContact O-CB 3.41Å; L117-L121 VanDerWaalsContact O-CG 3.25Å; L117-L121 WeakPolarHBondContact O-CG 3.36Å; L117-L121 PolarHBondContact O-N 2.95Å; Q119-L121 VanDerWaalsContact C-N 3.29Å; Q119-L121 PolarHBondContact O-N 3.28Å
122	S	53.6	Low	54.4	Low	89 Å²	89	108.8 Å²	108.8	62%	0.622	59%	0.592	S	S	*	*	H	α-helix	trans	-97.5	-6.8	-175.8	-65.1	0	0	0	0	114.4	E118 Q119 E120 P124	E118-S122 VanDerWaalsContact O-CB 3.26Å; E118-S122 WeakPolarHBondContact O-CB 3.24Å; E118-S122 PolarHBondContact O-N 3.5Å; E118-S122 VanDerWaalsContact O-N 3.14Å; E118-S122 PolarHBondContact O-OG 2.99Å; Q119-S122 PolarHBondContact O-N 2.72Å; Q119-S122 VanDerWaalsContact O-N 3.12Å; E120-S122 VanDerWaalsContact C-N 3.32Å; S122-P124 WeakPolarHBondContact O-CD 3.5Å
123	E	51.6	Low	52	Low	134 Å²	134	115.3 Å²	115.3	63%	0.626	62%	0.615	S	S	*	*			trans	-85.2	111.7	179.2	-72.6	-67.4	149	0	0	111.8	Q119 G125	Q119-E123 PolarHBondContact O-N 3.28Å; E123-G125 PolarHBondContact O-N 3.32Å
124	P	42.2	Very low	49.5	Very low	119 Å²	119	117.5 Å²	117.5	77%	0.773	64%	0.641	S	S	*	*			trans	-72.3	112.4	167.6	29.5	-30.7	0	0	0	108.8	S122	S122-P124 WeakPolarHBondContact O-CD 3.5Å
125	G	43.9	Very low	47.4	Very low	73 Å²	73	126.2 Å²	126.2	75%	0.753	68%	0.681	S	S	*	*			trans	-51.8	152	-163.7	0	0	0	0	0	117.5	E123	E123-G125 PolarHBondContact O-N 3.32Å
126	N	29.8	Very low	45	Very low	155 Å²	155	126.3 Å²	126.3	83%	0.829	69%	0.694	S	S	*	*			trans	-151.6	86.5	155.1	-129.2	-6.6	0	0	0	111.6
127	Q	35.2	Very low	42.7	Very low	186 Å²	186	130.8 Å²	130.8	87%	0.869	71%	0.712	S	S	*	*				-179.1	109.3	116.3	-93.9	166.4	46.9	0	0	110.6
128	A	34.2	Very low	40.6	Very low	86 Å²	86	135.4 Å²	135.4	71%	0.711	74%	0.741	S	S	*	*			trans	-55.5	144.3	157.2	0	0	0	0	0	109.2
129	L	34	Very low	38.5	Very low	145 Å²	145	138 Å²	138	76%	0.759	76%	0.757	S	S	*	*				-159.1	135.2	68.3	-77.7	164.6	0	0	0	112.7
130	D	29.6	Very low	36.6	Very low	133 Å²	133	137.4 Å²	137.4	71%	0.711	77%	0.767	S	S	*	*			trans	72.3	99.7	138.4	-59	-10.3	0	0	0	121.4
131	H	29.8	Very low	34.7	Very low	194 Å²	194	139.1 Å²	139.1	90%	0.898	77%	0.774	S	S	*	*				-162.6	135.4	113.2	-103.1	-69	0	0	0	111.5
132	E	34.6	Very low	33.2	Very low	164 Å²	164	141.6 Å²	141.6	77%	0.766	78%	0.783	S	S	*	*			trans	-58.1	138.8	-174.8	-56.5	178.9	117	0	0	115.2
133	H	29.1	Very low	32	Very low	180 Å²	180	144.6 Å²	144.6	83%	0.833	80%	0.796	S	S	*	*				158.1	125.3	119	-88.5	76.1	0	0	0	112.4
134	G	26.1	Very low	31	Very low	65 Å²	65	146.2 Å²	146.2	67%	0.67	80%	0.804	S	S	*	*			trans	108.7	95.1	137.2	0	0	0	0	0	120.1
135	H	28.6	Very low	30.4	Very low	196 Å²	196	148.4 Å²	148.4	91%	0.907	80%	0.804	S	S	*	*			trans	69.2	116.6	136.8	-72	-81	0	0	0	123.1
136	S	26.5	Very low	29.5	Very low	115 Å²	115	152.8 Å²	152.8	80%	0.804	81%	0.809	S	S	*	*				106.1	97.3	124.1	-162	0	0	0	0	117.5
137	E	28.1	Very low	29.5	Very low	185 Å²	185	155.7 Å²	155.7	86%	0.864	81%	0.814	S	S	*	*			trans	-120.8	110.5	167.6	-162.6	177.3	-166.8	0	0	108.5
138	V	28	Very low	29	Very low	120 Å²	120	153 Å²	153	73%	0.727	81%	0.811	S	S	*	*			trans	-141	141.3	166	-169.9	0	0	0	0	106.3
139	L	25.4	Very low	28.6	Very low	158 Å²	158	158.6 Å²	158.6	83%	0.827	82%	0.819	S	S	*	*			trans	101.6	58.6	167.2	-49.5	177.2	0	0	0	116.3
140	S	29	Very low	28.3	Very low	109 Å²	109	160.6 Å²	160.6	76%	0.762	82%	0.824	S	S	*	*			trans	-97.7	80.3	148.9	-60.8	0	0	0	0	108.8
141	E	29.2	Very low	28	Very low	180 Å²	180	163 Å²	163	84%	0.841	83%	0.831	S	S	*	*			trans	-169.5	141.1	163.4	-109.5	161.9	-158.9	0	0	108.9
142	E	28.5	Very low	28.4	Very low	188 Å²	188	158.7 Å²	158.7	88%	0.879	82%	0.82	S	S	*	*			trans	82.2	82.3	-176.3	-54.9	-179.7	140.2	0	0	116.1
143	V	27.9	Very low	27.8	Very low	151 Å²	151	157.7 Å²	157.7	92%	0.915	83%	0.826	S	S	*	*				-165.4	68.7	107.8	-169	0	0	0	0	109
144	E	32.2	Very low	27.7	Very low	169 Å²	169	156 Å²	156	79%	0.79	82%	0.823	S	S	*	*			trans	-113	109.8	157.1	-102.5	-85.2	166.7	0	0	105
145	H	28.6	Very low	27.8	Very low	164 Å²	164	160.1 Å²	160.1	76%	0.759	83%	0.828	S	S	*	*			trans	147.2	98	152.4	-81.9	47.5	0	0	0	111.1
146	L	26	Very low	28.3	Very low	166 Å²	166	159.4 Å²	159.4	87%	0.869	83%	0.825	S	S	*	*			trans	-171.9	92.3	130.3	-98.3	160.7	0	0	0	109.7
147	K	28.1	Very low	28.8	Very low	215 Å²	215	160.7 Å²	160.7	94%	0.935	82%	0.822	S	S	*	*			trans	-78.9	113.1	172.3	-147.7	152.3	-175.9	165.6	0	108.3
148	V	25.9	Very low	29.3	Very low	131 Å²	131	159.4 Å²	159.4	79%	0.794	82%	0.816	S	S	*	*			trans	-106	130.2	165.8	178.2	0	0	0	0	109.1
149	K	25.3	Very low	29.9	Very low	202 Å²	202	157.6 Å²	157.6	88%	0.878	81%	0.807	S	S	*	*			trans	-57.4	133.7	-168.9	-63.3	168.9	175.8	178.7	0	113.3
150	Q	28.7	Very low	30.6	Very low	187 Å²	187	156.1 Å²	156.1	87%	0.874	80%	0.797	S	S	*	*			trans	-88.2	142.4	159.2	-74	-179.1	-6.6	0	0	110.3
151	E	21.7	Very low	31.3	Very low	183 Å²	183	155.4 Å²	155.4	86%	0.855	79%	0.788	S	S	*	*			trans	173.1	158.8	130.1	-89.8	-144.6	177.1	0	0	109.4
152	P	39	Very low	32.1	Very low	104 Å²	104	150.1 Å²	150.1	68%	0.675	77%	0.768	S	S	*	*				-130.4	151.5	-55.2	34.2	-17.2	0	0	0	111
153	T	22.7	Very low	32.7	Very low	143 Å²	143	146 Å²	146	88%	0.877	75%	0.749	S	S	*	*			trans	-144.8	105.4	154.4	46.2	0	0	0	0	109.9	I155	T153-I155 PolarHBondContact O-N 3.39Å
154	D	27.1	Very low	33.4	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	72%	0.719	S	S	*	*			trans	-41.3	130.9	149.2	-91.5	-45.8	0	0	0	110.6
155	I	28.2	Very low	34.2	Very low	153 Å²	153	140.4 Å²	140.4	79%	0.785	71%	0.712	S	S	*	*				-159.9	95.7	123.9	-83.5	141.1	0	0	0	104.4	T153 L157	T153-I155 PolarHBondContact O-N 3.39Å; I155-L157 HydrophobicContact CG2-CB 4.22Å; I155-L157 PolarHBondContact O-N 3.42Å
156	Q	38.3	Very low	34.8	Very low	181 Å²	181	139.3 Å²	139.3	85%	0.846	70%	0.702	S	S	*	*			trans	-58.2	113.5	153.7	-78.9	-177.9	-47.3	0	0	107.1
157	L	38.1	Very low	35.6	Very low	141 Å²	141	134.4 Å²	134.4	74%	0.738	68%	0.675	S	S	*	*			trans	-168.9	61	154.6	-97.1	160	0	0	0	108.2	I155	I155-L157 HydrophobicContact CG2-CB 4.22Å; I155-L157 PolarHBondContact O-N 3.42Å
158	Q	36.6	Very low	36.5	Very low	159 Å²	159	127.3 Å²	127.3	74%	0.743	65%	0.652	S	S	*	*			trans	-125.8	47.8	167.8	-77	-94.7	-36.7	0	0	112.6	T162	Q158-T162 PolarHBondContact O-OG1 2.94Å
159	P	41.4	Very low	37.5	Very low	82 Å²	82	126.7 Å²	126.7	53%	0.532	64%	0.639	S	S	.	*	S	Bend	trans	-95	-32.9	176.9	-4.4	26.4	0	0	0	114.3	T162 Q163	P159-T162 PolarHBondContact O-OG1 3.11Å; P159-Q163 WeakPolarHBondContact O-CB 2.82Å; P159-Q163 PolarHBondContact O-N 2.88Å; P159-Q163 VanDerWaalsContact O-N 3.17Å
160	M	40.3	Very low	38.2	Very low	127 Å²	127	122 Å²	122	63%	0.626	62%	0.616	S	S	*	*	H	α-helix	trans	-90.9	-33.9	-161.6	-61.1	-169.4	91.9	0	0	115.4	T162 Q163 L164	M160-T162 PolarHBondContact O-N 3.43Å; M160-Q163 PolarHBondContact O-N 3.02Å; M160-L164 PolarHBondContact O-N 3.36Å
161	V	43.5	Very low	38.9	Very low	94 Å²	94	117.4 Å²	117.4	57%	0.57	60%	0.597	S	S	*	*	H	α-helix	trans	-70.2	-30.1	173.9	178.5	0	0	0	0	110.7	K165	V161-K165 WeakPolarHBondContact O-CG 3.43Å; V161-K165 PolarHBondContact O-N 2.9Å
162	T	45.9	Very low	40.1	Very low	69 Å²	69	113.7 Å²	113.7	42%	0.423	58%	0.579	S	S	.	*	H	α-helix	trans	-70.5	-34	173.9	-4.2	0	0	0	0	111.3	Q158 P159 M160 K165 Y166	Q158-T162 PolarHBondContact O-OG1 2.94Å; P159-T162 PolarHBondContact O-OG1 3.11Å; M160-T162 PolarHBondContact O-N 3.43Å; T162-K165 PolarHBondContact O-N 2.89Å; T162-Y166 WeakPolarHBondContact O-CB 3.43Å; T162-Y166 PolarHBondContact O-N 3.28Å
163	Q	41.4	Very low	40.2	Very low	100 Å²	100	114.3 Å²	114.3	47%	0.467	57%	0.573	S	S	.	*	H	α-helix	trans	-69.8	-40.7	178.8	-159.6	166	5.5	0	0	112.8	P159 M160 Y166 E167	P159-Q163 WeakPolarHBondContact O-CB 2.82Å; P159-Q163 PolarHBondContact O-N 2.88Å; P159-Q163 VanDerWaalsContact O-N 3.17Å; M160-Q163 PolarHBondContact O-N 3.02Å; Q163-Y166 CarbonylContact O-C 3.25Å; Q163-Y166 PolarHBondContact O-N 3.46Å; Q163-E167 WeakPolarHBondContact O-CB 3.44Å; Q163-E167 WeakPolarHBondContact O-CG 3.35Å; Q163-E167 PolarHBondContact O-N 2.91Å
164	L	43.4	Very low	40.7	Very low	56 Å²	56	115 Å²	115	29%	0.293	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-36.6	174.2	-73.9	169	0	0	0	112.7	M160 S168 E197 L201	M160-L164 PolarHBondContact O-N 3.36Å; L164-S168 VanDerWaalsContact O-CB 3.27Å; L164-S168 WeakPolarHBondContact O-CB 3.22Å; L164-S168 PolarHBondContact O-N 3.45Å; L164-E197 HydrophobicContact CD2-CG 4.37Å; L164-L201 HydrophobicContact CD1-CD1 3.85Å
165	K	46.9	Very low	41.5	Very low	148 Å²	148	115.8 Å²	115.8	64%	0.643	56%	0.557	S	S	*	*	H	α-helix	trans	-66.5	-39.5	171.5	-73.3	-179.7	177.5	-170.3	0	111.4	V161 T162 F169	V161-K165 WeakPolarHBondContact O-CG 3.43Å; V161-K165 PolarHBondContact O-N 2.9Å; T162-K165 PolarHBondContact O-N 2.89Å; K165-F169 WeakPolarHBondContact O-CB 3.47Å; K165-F169 PolarHBondContact O-N 3.31Å
166	Y	42	Very low	42.3	Very low	141 Å²	141	116.4 Å²	116.4	55%	0.553	56%	0.556	S	S	*	*	H	α-helix	trans	-69.7	-33.8	177.5	-177.7	-102.2	0	0	0	112.5	T162 Q163 R170	T162-Y166 WeakPolarHBondContact O-CB 3.43Å; T162-Y166 PolarHBondContact O-N 3.28Å; Q163-Y166 CarbonylContact O-C 3.25Å; Q163-Y166 PolarHBondContact O-N 3.46Å; Y166-R170 WeakPolarHBondContact O-CB 3.28Å; Y166-R170 PolarHBondContact O-N 3Å
167	E	42.8	Very low	42.5	Very low	62 Å²	62	115.8 Å²	115.8	29%	0.29	55%	0.553	S	S	.	*	H	α-helix	trans	-79.3	-34.9	174.7	-76.2	-179.3	173	0	0	112.8	Q163 F169 R170 L171	Q163-E167 WeakPolarHBondContact O-CB 3.44Å; Q163-E167 WeakPolarHBondContact O-CG 3.35Å; Q163-E167 PolarHBondContact O-N 2.91Å; E167-F169 VanDerWaalsContact C-N 3.27Å; E167-F169 PolarHBondContact O-N 3Å; E167-R170 PolarHBondContact O-N 3.2Å; E167-R170 IonicContact OE1-NH2 3.3Å; E167-R170 PolarHBondContact OE1-NH2 3.38Å; E167-L171 WeakPolarHBondContact O-CG 3.28Å; E167-L171 PolarHBondContact O-N 2.81Å
168	S	46.2	Very low	42.4	Very low	66 Å²	66	115.8 Å²	115.8	46%	0.462	55%	0.554	S	S	.	*	H	α-helix	trans	-62.1	-37.4	167.4	-166.2	0	0	0	0	111.6	L164 H172	L164-S168 VanDerWaalsContact O-CB 3.27Å; L164-S168 WeakPolarHBondContact O-CB 3.22Å; L164-S168 PolarHBondContact O-N 3.45Å; S168-H172 PolarHBondContact O-N 2.89Å
169	F	47.3	Very low	42.8	Very low	118 Å²	118	112.8 Å²	112.8	52%	0.518	57%	0.565	S	S	.	*	H	α-helix	trans	-70.5	-41.2	172.6	-173.4	-96.3	0	0	0	111.9	K165 E167 L171 H172 Q173	K165-F169 WeakPolarHBondContact O-CB 3.47Å; K165-F169 PolarHBondContact O-N 3.31Å; E167-F169 VanDerWaalsContact C-N 3.27Å; E167-F169 PolarHBondContact O-N 3Å; F169-L171 VanDerWaalsContact C-N 3.32Å; F169-L171 PolarHBondContact O-N 3.05Å; F169-H172 WeakPolarHBondContact O-CB 3.37Å; F169-H172 PolarHBondContact O-N 3.43Å; F169-H172 VanDerWaalsContact O-N 3.09Å; F169-Q173 PolarHBondContact O-N 2.97Å
170	R	40.4	Very low	42.9	Very low	104 Å²	104	117 Å²	117	39%	0.392	58%	0.578	S	S	.	*	H	α-helix	trans	-61.5	-37.7	176.7	-134	-167.3	-63.5	163.6	8.3	112.3	Y166 E167 H172 Q173 F174	Y166-R170 WeakPolarHBondContact O-CB 3.28Å; Y166-R170 PolarHBondContact O-N 3Å; E167-R170 PolarHBondContact O-N 3.2Å; E167-R170 IonicContact OE1-NH2 3.3Å; E167-R170 PolarHBondContact OE1-NH2 3.38Å; R170-H172 VanDerWaalsContact C-N 3.35Å; R170-Q173 PolarHBondContact O-N 3.35Å; R170-F174 VanDerWaalsContact O-CD2 3.32Å; R170-F174 WeakPolarHBondContact O-CD2 3.48Å; R170-F174 PolarHBondContact O-N 3.26Å
171	L	43.4	Very low	43.1	Very low	91 Å²	91	116.5 Å²	116.5	48%	0.476	59%	0.587	S	S	.	*	H	α-helix	trans	-69.9	-30.2	174.9	-75.1	169.8	0	0	0	112.7	E167 F169	E167-L171 WeakPolarHBondContact O-CG 3.28Å; E167-L171 PolarHBondContact O-N 2.81Å; F169-L171 VanDerWaalsContact C-N 3.32Å; F169-L171 PolarHBondContact O-N 3.05Å
172	H	47	Very low	43.2	Very low	104 Å²	104	116.9 Å²	116.9	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-71.8	-36.4	171.7	-111.8	-96.3	0	0	0	111.9	S168 F169 R170 F174 R175	S168-H172 PolarHBondContact O-N 2.89Å; F169-H172 WeakPolarHBondContact O-CB 3.37Å; F169-H172 PolarHBondContact O-N 3.43Å; F169-H172 VanDerWaalsContact O-N 3.09Å; R170-H172 VanDerWaalsContact C-N 3.35Å; H172-F174 VanDerWaalsContact C-N 3.33Å; H172-F174 PolarHBondContact O-N 3.46Å; H172-R175 VanDerWaalsContact O-CB 3.3Å; H172-R175 WeakPolarHBondContact O-CB 3.27Å; H172-R175 PolarHBondContact O-N 2.95Å; H172-R175 VanDerWaalsContact O-N 3.17Å
173	Q	41.5	Very low	43.4	Very low	118 Å²	118	117.3 Å²	117.3	55%	0.551	59%	0.589	S	S	*	*	H	α-helix	trans	-71.9	-21.6	-178.4	-137.6	172.4	8.7	0	0	114	F169 R170 R175	F169-Q173 PolarHBondContact O-N 2.97Å; R170-Q173 PolarHBondContact O-N 3.35Å; Q173-R175 PolarHBondContact O-N 3.42Å
174	F	33.6	Very low	43.8	Very low	158 Å²	158	121.1 Å²	121.1	69%	0.693	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-9	171.6	-89.4	-73.4	0	0	0	113.9	R170 H172 E176	R170-F174 VanDerWaalsContact O-CD2 3.32Å; R170-F174 WeakPolarHBondContact O-CD2 3.48Å; R170-F174 PolarHBondContact O-N 3.26Å; H172-F174 VanDerWaalsContact C-N 3.33Å; H172-F174 PolarHBondContact O-N 3.46Å; F174-E176 VanDerWaalsContact C-N 3.31Å
175	R	42.5	Very low	44	Very low	160 Å²	160	124.9 Å²	124.9	60%	0.604	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-12.8	178.5	-166.4	176.5	-86.8	-162	-6.2	113	H172 Q173 E187	H172-R175 VanDerWaalsContact O-CB 3.3Å; H172-R175 WeakPolarHBondContact O-CB 3.27Å; H172-R175 PolarHBondContact O-N 2.95Å; H172-R175 VanDerWaalsContact O-N 3.17Å; Q173-R175 PolarHBondContact O-N 3.42Å; R175-E187 IonicContact NH2-OE2 2.78Å
176	E	45.3	Very low	44	Very low	165 Å²	165	123.2 Å²	123.2	77%	0.771	62%	0.621	S	S	*	*	S	Bend	trans	-107.6	-2.5	-168.3	-71.6	-82.9	123.3	0	0	114.8	F174	F174-E176 VanDerWaalsContact C-N 3.31Å
177	Q	43.3	Very low	44.5	Very low	168 Å²	168	120.5 Å²	120.5	79%	0.785	61%	0.614	S	S	*	*	S	Bend	trans	-120.9	-11.5	-171.7	-77.6	-169.9	-13.2	0	0	118.7
178	D	35.5	Very low	45.1	Very low	142 Å²	142	122.1 Å²	122.1	76%	0.759	62%	0.624	S	S	*	*			trans	-143.2	122.1	170.4	-70.7	-55.8	0	0	0	109.7	E180	D178-E180 PolarHBondContact O-N 3.46Å
179	G	45.2	Very low	45.4	Very low	95 Å²	95	120.8 Å²	120.8	98%	0.979	62%	0.617	S	S	*	*			trans	-70.4	50.2	-179.1	0	0	0	0	0	114.4
180	E	43.7	Very low	45.9	Very low	171 Å²	171	116.7 Å²	116.7	80%	0.799	60%	0.603	S	S	*	*			trans	-113.4	123	168.8	-72.3	-169	158.4	0	0	110.1	D178 I182	D178-E180 PolarHBondContact O-N 3.46Å; E180-I182 PolarHBondContact O-N 3Å; E180-I182 VanDerWaalsContact O-N 3.14Å
181	S	44.7	Very low	46.9	Very low	117 Å²	117	117.2 Å²	117.2	82%	0.818	61%	0.608	S	S	*	*			trans	-60.1	114.3	176.9	53.9	0	0	0	0	110.9	P183	S181-P183 WeakPolarHBondContact O-CD 3.28Å
182	I	45.8	Very low	47.8	Very low	101 Å²	101	117.4 Å²	117.4	52%	0.518	61%	0.607	S	S	.	*			trans	-62.4	120.8	168.1	-59.4	176.6	0	0	0	107.5	E180 E184 Q186	E180-I182 PolarHBondContact O-N 3Å; E180-I182 VanDerWaalsContact O-N 3.14Å; I182-E184 PolarHBondContact O-N 3.25Å; I182-Q186 HydrophobicContact CG2-CB 3.46Å; I182-Q186 VanDerWaalsContact CG2-CB 3.46Å; I182-Q186 HydrophobicContact CG2-CG 4.31Å
183	P	48.9	Very low	48.9	Very low	79 Å²	79	118.3 Å²	118.3	51%	0.513	61%	0.611	S	S	.	*			trans	-58.6	139.8	179.2	-21.8	32	0	0	0	110.8	S181 N185 Q186	S181-P183 WeakPolarHBondContact O-CD 3.28Å; P183-N185 PolarHBondContact O-N 3.41Å; P183-Q186 WeakPolarHBondContact O-CB 3.39Å; P183-Q186 PolarHBondContact O-N 2.99Å
184	E	49.6	Very low	49.9	Very low	179 Å²	179	115.9 Å²	115.9	84%	0.836	60%	0.601	S	S	*	*	H	α-helix	trans	-49.9	-23.5	-179.4	-143.1	173	-175	0	0	113.8	I182 L188	I182-E184 PolarHBondContact O-N 3.25Å; E184-L188 PolarHBondContact O-N 2.88Å
185	N	48.3	Very low	51.3	Low	136 Å²	136	113.8 Å²	113.8	73%	0.727	60%	0.597	S	S	*	*	H	α-helix	trans	-69.1	-27.7	173	-86	-25.8	0	0	0	114.7	P183 A189	P183-N185 PolarHBondContact O-N 3.41Å; N185-A189 WeakPolarHBondContact O-CB 3.13Å; N185-A189 PolarHBondContact O-N 3.43Å; N185-A189 VanDerWaalsContact O-N 3.13Å
186	Q	48	Very low	52.6	Low	112 Å²	112	112.1 Å²	112.1	52%	0.523	59%	0.594	S	S	.	*	H	α-helix	trans	-79.3	-36.1	179.9	-122.4	169.8	-15.9	0	0	111.6	I182 P183 A189 S190	I182-Q186 HydrophobicContact CG2-CB 3.46Å; I182-Q186 VanDerWaalsContact CG2-CB 3.46Å; I182-Q186 HydrophobicContact CG2-CG 4.31Å; P183-Q186 WeakPolarHBondContact O-CB 3.39Å; P183-Q186 PolarHBondContact O-N 2.99Å; Q186-A189 WeakPolarHBondContact O-CB 3.11Å; Q186-A189 PolarHBondContact O-N 3.46Å; Q186-S190 PolarHBondContact O-N 2.79Å; Q186-S190 PolarHBondContact O-OG 3.08Å; Q186-S190 VanDerWaalsContact O-OG 3.07Å
187	E	52.5	Low	53.7	Low	85 Å²	85	108.1 Å²	108.1	40%	0.397	58%	0.575	S	S	.	*	H	α-helix	trans	-68.9	-38.8	174.7	-166.7	-175.3	143.1	0	0	111.8	R175 A189 S190 K191	R175-E187 IonicContact NH2-OE2 2.78Å; E187-A189 VanDerWaalsContact C-N 3.32Å; E187-S190 PolarHBondContact O-N 3.46Å; E187-K191 PolarHBondContact O-N 3.44Å; E187-K191 WeakPolarHBondContact OE1-CE 3.47Å; E187-K191 IonicContact OE1-NZ 3.28Å; E187-K191 PolarHBondContact OE1-NZ 3.47Å
188	L	54.4	Low	54.4	Low	95 Å²	95	105.6 Å²	105.6	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-36.5	172.8	-169.6	66.4	0	0	0	111.5	E184 Q192	E184-L188 PolarHBondContact O-N 2.88Å; L188-Q192 WeakPolarHBondContact O-CB 3.33Å; L188-Q192 VanDerWaalsContact O-CG 3.27Å; L188-Q192 WeakPolarHBondContact O-CG 3.41Å; L188-Q192 PolarHBondContact O-N 2.68Å
189	A	52.9	Low	55.9	Low	39 Å²	39	104.3 Å²	104.3	32%	0.322	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-44.8	173.8	0	0	0	0	0	111.7	N185 Q186 E187 Q192 E193	N185-A189 WeakPolarHBondContact O-CB 3.13Å; N185-A189 PolarHBondContact O-N 3.43Å; N185-A189 VanDerWaalsContact O-N 3.13Å; Q186-A189 WeakPolarHBondContact O-CB 3.11Å; Q186-A189 PolarHBondContact O-N 3.46Å; E187-A189 VanDerWaalsContact C-N 3.32Å; A189-Q192 PolarHBondContact O-N 3.34Å; A189-E193 WeakPolarHBondContact O-CG 3.32Å; A189-E193 PolarHBondContact O-N 2.74Å
190	S	57.8	Low	57	Low	32 Å²	32	105.6 Å²	105.6	22%	0.224	53%	0.534	C	S	.	.	H	α-helix	trans	-64.6	-41.1	176.9	-55.9	0	0	0	0	112.9	Q186 E187 Q192 E193 I194	Q186-S190 PolarHBondContact O-N 2.79Å; Q186-S190 PolarHBondContact O-OG 3.08Å; Q186-S190 VanDerWaalsContact O-OG 3.07Å; E187-S190 PolarHBondContact O-N 3.46Å; S190-Q192 VanDerWaalsContact C-N 3.34Å; S190-Q192 PolarHBondContact O-N 2.76Å; S190-E193 PolarHBondContact O-N 3.46Å; S190-I194 WeakPolarHBondContact O-CG1 3.4Å; S190-I194 PolarHBondContact O-N 2.79Å
191	K	61.7	Low	58	Low	114 Å²	114	100.3 Å²	100.3	50%	0.496	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-38.7	173.7	-74.2	176	-173.9	163.6	0	112	E187 E193 L195	E187-K191 PolarHBondContact O-N 3.44Å; E187-K191 WeakPolarHBondContact OE1-CE 3.47Å; E187-K191 IonicContact OE1-NZ 3.28Å; E187-K191 PolarHBondContact OE1-NZ 3.47Å; K191-E193 VanDerWaalsContact C-N 3.35Å; K191-L195 WeakPolarHBondContact O-CG 3.19Å; K191-L195 PolarHBondContact O-N 3.07Å
192	Q	62.5	Low	59.1	Low	95 Å²	95	101.5 Å²	101.5	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-35.5	173.9	-76.2	179.3	7.7	0	0	112	L188 A189 S190 K196	L188-Q192 WeakPolarHBondContact O-CB 3.33Å; L188-Q192 VanDerWaalsContact O-CG 3.27Å; L188-Q192 WeakPolarHBondContact O-CG 3.41Å; L188-Q192 PolarHBondContact O-N 2.68Å; A189-Q192 PolarHBondContact O-N 3.34Å; S190-Q192 VanDerWaalsContact C-N 3.34Å; S190-Q192 PolarHBondContact O-N 2.76Å; Q192-K196 WeakPolarHBondContact O-CB 3.31Å; Q192-K196 WeakPolarHBondContact O-CD 3.48Å; Q192-K196 WeakPolarHBondContact O-CG 3.5Å; Q192-K196 PolarHBondContact O-N 2.93Å
193	E	68.4	Low	60.3	Low	124 Å²	124	100.4 Å²	100.4	58%	0.579	49%	0.493	S	S	*	.	H	α-helix	trans	-66.5	-45	174.5	-79.5	175.9	166.2	0	0	112	A189 S190 K191 L195 K196 E197	A189-E193 WeakPolarHBondContact O-CG 3.32Å; A189-E193 PolarHBondContact O-N 2.74Å; S190-E193 PolarHBondContact O-N 3.46Å; K191-E193 VanDerWaalsContact C-N 3.35Å; E193-L195 VanDerWaalsContact C-N 3.34Å; E193-L195 PolarHBondContact O-N 2.78Å; E193-K196 CarbonylContact O-C 3.59Å; E193-K196 WeakPolarHBondContact O-CB 3.35Å; E193-K196 PolarHBondContact O-N 2.69Å; E193-E197 WeakPolarHBondContact O-CB 3.36Å; E193-E197 PolarHBondContact O-N 3.14Å
194	I	62.9	Low	61.2	Low	67 Å²	67	98.2 Å²	98.2	34%	0.344	48%	0.48	S	S	.	.	H	α-helix	trans	-61	-43.3	175.4	-66.1	165.9	0	0	0	110.9	S190 E197 M198	S190-I194 WeakPolarHBondContact O-CG1 3.4Å; S190-I194 PolarHBondContact O-N 2.79Å; I194-E197 PolarHBondContact O-N 2.9Å; I194-M198 WeakPolarHBondContact O-CG 3.37Å; I194-M198 PolarHBondContact O-N 2.78Å
195	L	63.8	Low	62.1	Low	114 Å²	114	91.8 Å²	91.8	60%	0.597	45%	0.448	S	S	*	.	H	α-helix	trans	-63.7	-41.9	176	-75.1	172.5	0	0	0	112.1	K191 E193 E197 M198 E199	K191-L195 WeakPolarHBondContact O-CG 3.19Å; K191-L195 PolarHBondContact O-N 3.07Å; E193-L195 VanDerWaalsContact C-N 3.34Å; E193-L195 PolarHBondContact O-N 2.78Å; L195-E197 VanDerWaalsContact C-N 3.3Å; L195-E197 PolarHBondContact O-N 2.69Å; L195-M198 PolarHBondContact O-N 3.31Å; L195-E199 WeakPolarHBondContact O-CB 3.46Å; L195-E199 PolarHBondContact O-N 3.4Å
196	K	69.9	Low	63.1	Low	125 Å²	125	88.8 Å²	88.8	54%	0.543	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-37.1	174.3	-75.4	166.7	-173.7	170.5	0	111.6	Q192 E193 E199 H200	Q192-K196 WeakPolarHBondContact O-CB 3.31Å; Q192-K196 WeakPolarHBondContact O-CD 3.48Å; Q192-K196 WeakPolarHBondContact O-CG 3.5Å; Q192-K196 PolarHBondContact O-N 2.93Å; E193-K196 CarbonylContact O-C 3.59Å; E193-K196 WeakPolarHBondContact O-CB 3.35Å; E193-K196 PolarHBondContact O-N 2.69Å; K196-E199 PolarHBondContact O-N 2.67Å; K196-H200 VanDerWaalsContact O-CB 3.3Å; K196-H200 WeakPolarHBondContact O-CB 3.41Å; K196-H200 PolarHBondContact O-N 3.5Å
197	E	67.8	Low	64.2	Low	80 Å²	80	89.9 Å²	89.9	37%	0.374	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-41.8	178	-169.1	169.1	-172.5	0	0	111.7	L164 E193 I194 L195 E199 H200 L201	L164-E197 HydrophobicContact CD2-CG 4.37Å; E193-E197 WeakPolarHBondContact O-CB 3.36Å; E193-E197 PolarHBondContact O-N 3.14Å; I194-E197 PolarHBondContact O-N 2.9Å; L195-E197 VanDerWaalsContact C-N 3.3Å; L195-E197 PolarHBondContact O-N 2.69Å; E197-E199 VanDerWaalsContact C-N 3.28Å; E197-E199 PolarHBondContact O-N 2.83Å; E197-H200 PolarHBondContact O-N 3.15Å; E197-L201 HydrophobicContact CG-CD1 4.42Å; E197-L201 WeakPolarHBondContact O-CB 3.37Å; E197-L201 VanDerWaalsContact O-CG 3.24Å; E197-L201 WeakPolarHBondContact O-CG 3.13Å; E197-L201 PolarHBondContact O-N 2.88Å
198	M	58.1	Low	65.2	Low	115 Å²	115	91.6 Å²	91.6	57%	0.567	44%	0.439	S	S	*	.	H	α-helix	trans	-61.4	-37	171.3	-71	-168.4	79.6	0	0	112.4	I194 L195 R202	I194-M198 WeakPolarHBondContact O-CG 3.37Å; I194-M198 PolarHBondContact O-N 2.78Å; L195-M198 PolarHBondContact O-N 3.31Å; M198-R202 WeakPolarHBondContact O-CB 3.44Å; M198-R202 PolarHBondContact O-N 2.91Å
199	E	66.9	Low	66.1	Low	115 Å²	115	87.6 Å²	87.6	54%	0.537	42%	0.418	S	S	.	.	H	α-helix	trans	-69.2	-44.6	174.7	-170.2	163.8	-145	0	0	111.4	L195 K196 E197 L201 R202 D203	L195-E199 WeakPolarHBondContact O-CB 3.46Å; L195-E199 PolarHBondContact O-N 3.4Å; K196-E199 PolarHBondContact O-N 2.67Å; E197-E199 VanDerWaalsContact C-N 3.28Å; E197-E199 PolarHBondContact O-N 2.83Å; E199-L201 VanDerWaalsContact C-N 3.35Å; E199-L201 PolarHBondContact O-N 3.31Å; E199-R202 CarbonylContact O-C 3.6Å; E199-R202 WeakPolarHBondContact O-CA 3.47Å; E199-R202 WeakPolarHBondContact O-CB 3.43Å; E199-R202 PolarHBondContact O-N 3.27Å; E199-R202 VanDerWaalsContact O-N 3.13Å; E199-D203 PolarHBondContact O-N 3.36Å
200	H	68.8	Low	67	Low	122 Å²	122	89.8 Å²	89.8	57%	0.565	43%	0.427	S	S	*	.	H	α-helix	trans	-62.3	-39.3	174.8	-179	-94.7	0	0	0	112.5	K196 E197 D203 S204	K196-H200 VanDerWaalsContact O-CB 3.3Å; K196-H200 WeakPolarHBondContact O-CB 3.41Å; K196-H200 PolarHBondContact O-N 3.5Å; E197-H200 PolarHBondContact O-N 3.15Å; H200-D203 PolarHBondContact O-N 2.88Å; H200-S204 PolarHBondContact CE1-OG 3Å; H200-S204 VanDerWaalsContact O-CB 3.24Å; H200-S204 WeakPolarHBondContact O-CB 3.29Å; H200-S204 PolarHBondContact O-N 3.44Å; H200-S204 PolarHBondContact O-OG 3.29Å
201	L	65	Low	67.9	Low	60 Å²	60	91.9 Å²	91.9	31%	0.314	44%	0.442	S	S	.	.	H	α-helix	trans	-66.2	-38.9	173.8	-73.3	171.9	0	0	0	111.5	L164 E197 E199 R205	L164-L201 HydrophobicContact CD1-CD1 3.85Å; E197-L201 HydrophobicContact CG-CD1 4.42Å; E197-L201 WeakPolarHBondContact O-CB 3.37Å; E197-L201 VanDerWaalsContact O-CG 3.24Å; E197-L201 WeakPolarHBondContact O-CG 3.13Å; E197-L201 PolarHBondContact O-N 2.88Å; E199-L201 VanDerWaalsContact C-N 3.35Å; E199-L201 PolarHBondContact O-N 3.31Å; L201-R205 VanDerWaalsContact O-CB 3.26Å; L201-R205 WeakPolarHBondContact O-CB 3.32Å; L201-R205 PolarHBondContact O-N 2.73Å
202	R	67.8	Low	68.5	Low	143 Å²	143	89 Å²	89	54%	0.54	43%	0.432	S	S	.	.	H	α-helix	trans	-62.4	-45.2	172.9	179.3	-173.7	-69.8	-175	-3.3	110.8	M198 E199 R205 L206	M198-R202 WeakPolarHBondContact O-CB 3.44Å; M198-R202 PolarHBondContact O-N 2.91Å; E199-R202 CarbonylContact O-C 3.6Å; E199-R202 WeakPolarHBondContact O-CA 3.47Å; E199-R202 WeakPolarHBondContact O-CB 3.43Å; E199-R202 PolarHBondContact O-N 3.27Å; E199-R202 VanDerWaalsContact O-N 3.13Å; R202-R205 PolarHBondContact O-N 3.05Å; R202-L206 HydrophobicContact CG-CD1 4.31Å; R202-L206 WeakPolarHBondContact O-CG 3.24Å; R202-L206 PolarHBondContact O-N 3.43Å
203	D	70.6	Confident	69	Low	77 Å²	77	87.4 Å²	87.4	41%	0.412	43%	0.427	S	S	.	.	H	α-helix	trans	-68.8	-43.7	179.9	-76.9	-11.3	0	0	0	112.2	E199 H200 R205 L206 Q207	E199-D203 PolarHBondContact O-N 3.36Å; H200-D203 PolarHBondContact O-N 2.88Å; D203-R205 VanDerWaalsContact C-N 3.25Å; D203-R205 PolarHBondContact O-N 3.18Å; D203-L206 PolarHBondContact O-N 3.43Å; D203-L206 VanDerWaalsContact O-N 3.15Å; D203-Q207 WeakPolarHBondContact O-CG 3.21Å; D203-Q207 PolarHBondContact O-N 2.77Å
204	S	67.1	Low	69.3	Low	33 Å²	33	84.2 Å²	84.2	23%	0.231	42%	0.418	C	S	.	.	H	α-helix	trans	-58.5	-38.4	173.2	-64.8	0	0	0	0	111.6	H200 R208	H200-S204 PolarHBondContact CE1-OG 3Å; H200-S204 VanDerWaalsContact O-CB 3.24Å; H200-S204 WeakPolarHBondContact O-CB 3.29Å; H200-S204 PolarHBondContact O-N 3.44Å; H200-S204 PolarHBondContact O-OG 3.29Å; S204-R208 WeakPolarHBondContact O-CG 3.27Å; S204-R208 PolarHBondContact O-N 3.45Å; S204-R208 VanDerWaalsContact O-N 3.09Å
205	R	69.1	Low	69.8	Low	44 Å²	44	87.8 Å²	87.8	17%	0.166	43%	0.431	C	S	.	.	H	α-helix	trans	-68.8	-43.6	174.8	-169	177.2	-67.6	-172	1.6	111.6	L201 R202 D203 Q207 R208 D209 E270 E271 R286	L201-R205 VanDerWaalsContact O-CB 3.26Å; L201-R205 WeakPolarHBondContact O-CB 3.32Å; L201-R205 PolarHBondContact O-N 2.73Å; R202-R205 PolarHBondContact O-N 3.05Å; D203-R205 VanDerWaalsContact C-N 3.25Å; D203-R205 PolarHBondContact O-N 3.18Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-Q207 PolarHBondContact O-N 3.11Å; R205-R208 PolarHBondContact O-N 2.86Å; R205-D209 PolarHBondContact O-N 3.4Å; R205-E270 IonicContact CZ-OE2 3.06Å; R205-E270 VanDerWaalsContact CZ-OE2 3.26Å; R205-E270 IonicContact NE-OE2 2.69Å; R205-E270 PolarHBondContact NE-OE2 3.35Å; R205-E270 IonicContact NH2-OE2 2.74Å; R205-E270 PolarHBondContact NH2-OE2 3.46Å; R205-E271 IonicContact NH1-OE1 2.9Å; R205-E271 PolarHBondContact NH1-OE1 3.06Å; R205-R286 VanDerWaalsContact NH1-NH2 3.18Å
206	L	70.1	Confident	69.9	Low	73 Å²	73	85.3 Å²	85.3	38%	0.382	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.5	-73.7	171.7	0	0	0	111.9	R202 D203 D209 V210	R202-L206 HydrophobicContact CG-CD1 4.31Å; R202-L206 WeakPolarHBondContact O-CG 3.24Å; R202-L206 PolarHBondContact O-N 3.43Å; D203-L206 PolarHBondContact O-N 3.43Å; D203-L206 VanDerWaalsContact O-N 3.15Å; L206-D209 PolarHBondContact O-N 3.37Å; L206-V210 VanDerWaalsContact O-CG2 3.29Å; L206-V210 WeakPolarHBondContact O-CG2 3.31Å; L206-V210 PolarHBondContact O-N 2.97Å
207	Q	71	Confident	69.8	Low	136 Å²	136	85.9 Å²	85.9	64%	0.636	41%	0.413	S	S	*	.	H	α-helix	trans	-63.6	-44	175.7	-73.2	178.5	7.5	0	0	112	D203 R205 D209 V210 S211	D203-Q207 WeakPolarHBondContact O-CG 3.21Å; D203-Q207 PolarHBondContact O-N 2.77Å; R205-Q207 VanDerWaalsContact C-N 3.32Å; R205-Q207 PolarHBondContact O-N 3.11Å; Q207-D209 VanDerWaalsContact C-N 3.34Å; Q207-D209 PolarHBondContact O-N 3.46Å; Q207-V210 PolarHBondContact O-N 3.38Å; Q207-S211 WeakPolarHBondContact O-CB 3.36Å; Q207-S211 PolarHBondContact O-N 3.38Å
208	R	73	Confident	69.9	Low	120 Å²	120	87 Å²	87	45%	0.453	42%	0.418	S	S	.	.	H	α-helix	trans	-59.7	-44.4	174.3	-78.4	-173	-68.3	139.2	-10.6	112.1	S204 R205 V210 S211 L212 E270	S204-R208 WeakPolarHBondContact O-CG 3.27Å; S204-R208 PolarHBondContact O-N 3.45Å; S204-R208 VanDerWaalsContact O-N 3.09Å; R205-R208 PolarHBondContact O-N 2.86Å; R208-V210 PolarHBondContact O-N 3.22Å; R208-S211 WeakPolarHBondContact O-CB 3.5Å; R208-S211 PolarHBondContact O-N 2.96Å; R208-L212 WeakPolarHBondContact O-CG 3.46Å; R208-L212 PolarHBondContact O-N 3.41Å; R208-E270 IonicContact CZ-OE1 2.71Å; R208-E270 IonicContact NH1-OE1 3.07Å; R208-E270 PolarHBondContact NH1-OE1 3.18Å; R208-E270 VanDerWaalsContact NH2-CD 3.34Å; R208-E270 IonicContact NH2-OE1 3.32Å; R208-E270 PolarHBondContact NH2-OE1 2.75Å; R208-E270 IonicContact NH2-OE2 3.8Å; R208-E270 PolarHBondContact NH2-OE2 3.29Å
209	D	72.4	Confident	70.2	Confident	11 Å²	11	84.5 Å²	84.5	6%	0.059	41%	0.409	C	S	.	.	H	α-helix	trans	-61.4	-46.5	176	-70.7	-21.2	0	0	0	110.9	R205 L206 Q207 S211 L212 D213 R279	R205-D209 PolarHBondContact O-N 3.4Å; L206-D209 PolarHBondContact O-N 3.37Å; Q207-D209 VanDerWaalsContact C-N 3.34Å; Q207-D209 PolarHBondContact O-N 3.46Å; D209-S211 VanDerWaalsContact C-N 3.3Å; D209-S211 PolarHBondContact O-N 2.9Å; D209-L212 WeakPolarHBondContact O-CB 3.45Å; D209-L212 PolarHBondContact O-N 3.1Å; D209-D213 PolarHBondContact O-N 3.35Å; D209-R279 VanDerWaalsContact C-CZ 3.45Å; D209-R279 HydrophobicContact CB-CG 4.18Å; D209-R279 PolarHBondContact O-NH2 3.14Å
210	V	73	Confident	69.9	Low	85 Å²	85	80.3 Å²	80.3	52%	0.515	39%	0.389	S	S	.	.	H	α-helix	trans	-58.4	-41.1	176.8	173.7	0	0	0	0	111.6	L206 Q207 R208 D213 S214 R279	L206-V210 VanDerWaalsContact O-CG2 3.29Å; L206-V210 WeakPolarHBondContact O-CG2 3.31Å; L206-V210 PolarHBondContact O-N 2.97Å; Q207-V210 PolarHBondContact O-N 3.38Å; R208-V210 PolarHBondContact O-N 3.22Å; V210-D213 PolarHBondContact O-N 3.27Å; V210-S214 PolarHBondContact O-N 3.04Å; V210-R279 VanDerWaalsContact CA-NH2 3.29Å; V210-R279 VanDerWaalsContact CG2-NH1 3.32Å; V210-R279 VanDerWaalsContact N-NH2 3.13Å
211	S	77.1	Confident	69.6	Low	76 Å²	76	79.9 Å²	79.9	53%	0.531	39%	0.385	S	S	.	.	H	α-helix	trans	-61.6	-44.5	176	-177.1	0	0	0	0	112	Q207 R208 D209 D213 S214 K215	Q207-S211 WeakPolarHBondContact O-CB 3.36Å; Q207-S211 PolarHBondContact O-N 3.38Å; R208-S211 WeakPolarHBondContact O-CB 3.5Å; R208-S211 PolarHBondContact O-N 2.96Å; D209-S211 VanDerWaalsContact C-N 3.3Å; D209-S211 PolarHBondContact O-N 2.9Å; S211-D213 PolarHBondContact O-N 3.15Å; S211-S214 PolarHBondContact O-N 2.93Å; S211-K215 WeakPolarHBondContact O-CB 3.49Å; S211-K215 PolarHBondContact O-N 3.2Å
212	L	73.6	Confident	69.3	Low	55 Å²	55	83.2 Å²	83.2	29%	0.288	40%	0.399	S	S	.	.	H	α-helix	trans	-58.1	-50.4	173.5	-70.5	168.3	0	0	0	110.8	R208 D209 S214 K215 Y216 Y267	R208-L212 WeakPolarHBondContact O-CG 3.46Å; R208-L212 PolarHBondContact O-N 3.41Å; D209-L212 WeakPolarHBondContact O-CB 3.45Å; D209-L212 PolarHBondContact O-N 3.1Å; L212-S214 VanDerWaalsContact C-N 3.28Å; L212-S214 PolarHBondContact O-N 3.07Å; L212-K215 PolarHBondContact O-N 2.77Å; L212-Y216 VanDerWaalsContact O-CD2 3.22Å; L212-Y216 WeakPolarHBondContact O-CD2 3.31Å; L212-Y216 PolarHBondContact O-N 3.32Å; L212-Y267 HydrophobicContact CB-CE1 4.4Å; L212-Y267 HydrophobicContact CD1-CD1 4.39Å
213	D	71.8	Confident	68.7	Low	61 Å²	61	81.3 Å²	81.3	33%	0.326	40%	0.4	S	S	.	.	H	α-helix	trans	-58	-37.6	177.7	-80.1	41.1	0	0	0	113.3	D209 V210 S211 R217 Y267 R279	D209-D213 PolarHBondContact O-N 3.35Å; V210-D213 PolarHBondContact O-N 3.27Å; S211-D213 PolarHBondContact O-N 3.15Å; D213-R217 VanDerWaalsContact O-CB 3.27Å; D213-R217 WeakPolarHBondContact O-CB 3.18Å; D213-R217 PolarHBondContact O-N 2.6Å; D213-Y267 VanDerWaalsContact OD1-CE1 3.25Å; D213-Y267 WeakPolarHBondContact OD1-CE1 3.29Å; D213-Y267 VanDerWaalsContact OD1-CZ 3.24Å; D213-Y267 PolarHBondContact OD1-OH 3.17Å; D213-R279 IonicContact OD1-CZ 2.63Å; D213-R279 IonicContact OD1-NE 2.69Å; D213-R279 IonicContact OD1-NH2 3.31Å; D213-R279 PolarHBondContact OD1-NH2 3.46Å; D213-R279 IonicContact OD2-CZ 3.27Å; D213-R279 IonicContact OD2-NH2 2.76Å; D213-R279 PolarHBondContact OD2-NH2 2.94Å
214	S	74.9	Confident	68	Low	56 Å²	56	79.1 Å²	79.1	39%	0.392	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-49.7	177.9	-162.8	0	0	0	0	111.7	V210 S211 L212 Y216 R217 E218	V210-S214 PolarHBondContact O-N 3.04Å; S211-S214 PolarHBondContact O-N 2.93Å; L212-S214 VanDerWaalsContact C-N 3.28Å; L212-S214 PolarHBondContact O-N 3.07Å; S214-Y216 VanDerWaalsContact C-N 3.31Å; S214-Y216 PolarHBondContact O-N 3.16Å; S214-R217 WeakPolarHBondContact O-CB 3.48Å; S214-R217 PolarHBondContact O-N 3.27Å; S214-R217 VanDerWaalsContact O-N 3.08Å; S214-E218 WeakPolarHBondContact O-CG 3.36Å; S214-E218 PolarHBondContact O-N 3.47Å
215	K	74.1	Confident	67.5	Low	143 Å²	143	86.3 Å²	86.3	62%	0.622	41%	0.413	S	S	*	.	H	α-helix	trans	-55.7	-45.9	177.8	-175	179.1	179.1	-179.4	0	111.4	S211 L212 E218 T219	S211-K215 WeakPolarHBondContact O-CB 3.49Å; S211-K215 PolarHBondContact O-N 3.2Å; L212-K215 PolarHBondContact O-N 2.77Å; K215-E218 PolarHBondContact O-N 2.96Å; K215-T219 PolarHBondContact O-N 2.92Å; K215-T219 VanDerWaalsContact O-N 3.14Å
216	Y	66.3	Low	66.6	Low	61 Å²	61	87.8 Å²	87.8	24%	0.239	43%	0.434	C	S	.	.	H	α-helix	trans	-69.6	-31.6	177.8	-84.2	-83.4	0	0	0	113.5	L212 S214 E218 T219 Y220 P266	L212-Y216 VanDerWaalsContact O-CD2 3.22Å; L212-Y216 WeakPolarHBondContact O-CD2 3.31Å; L212-Y216 PolarHBondContact O-N 3.32Å; S214-Y216 VanDerWaalsContact C-N 3.31Å; S214-Y216 PolarHBondContact O-N 3.16Å; Y216-E218 VanDerWaalsContact C-N 3.29Å; Y216-T219 PolarHBondContact O-OG1 3.13Å; Y216-Y220 PolarHBondContact O-N 3.49Å; Y216-P266 HydrophobicContact CD2-CB 4.33Å; Y216-P266 HydrophobicContact CD2-CG 4.38Å; Y216-P266 HydrophobicContact CE1-CG 4.06Å; Y216-P266 HydrophobicContact CE2-CB 3.54Å; Y216-P266 HydrophobicContact CE2-CG 3.69Å; Y216-P266 VanDerWaalsContact CZ-CG 3.49Å; Y216-P266 WeakPolarHBondContact OH-CG 3.47Å
217	R	67.6	Low	65.7	Low	138 Å²	138	89.8 Å²	89.8	52%	0.521	44%	0.442	S	S	.	.	H	α-helix	trans	-69	-32.7	174.5	-177.8	-176.9	-68.3	-126.9	2.1	111.2	D213 S214 K221	D213-R217 VanDerWaalsContact O-CB 3.27Å; D213-R217 WeakPolarHBondContact O-CB 3.18Å; D213-R217 PolarHBondContact O-N 2.6Å; S214-R217 WeakPolarHBondContact O-CB 3.48Å; S214-R217 PolarHBondContact O-N 3.27Å; S214-R217 VanDerWaalsContact O-N 3.08Å; R217-K221 HydrophobicContact CG-CD 4.37Å; R217-K221 WeakPolarHBondContact O-CB 3.31Å; R217-K221 WeakPolarHBondContact O-CG 3.41Å; R217-K221 PolarHBondContact O-N 2.85Å; R217-K221 VanDerWaalsContact O-N 3.15Å
218	E	68.8	Low	64.8	Low	104 Å²	104	90 Å²	90	49%	0.486	44%	0.44	S	S	.	.	H	α-helix	trans	-73.9	-44.6	179.3	-76.2	169.2	-167.1	0	0	112.7	S214 K215 Y216 Y220 K221 Q222	S214-E218 WeakPolarHBondContact O-CG 3.36Å; S214-E218 PolarHBondContact O-N 3.47Å; K215-E218 PolarHBondContact O-N 2.96Å; Y216-E218 VanDerWaalsContact C-N 3.29Å; E218-Y220 VanDerWaalsContact C-N 3.33Å; E218-Y220 PolarHBondContact O-N 3.37Å; E218-K221 PolarHBondContact O-N 3.46Å; E218-K221 VanDerWaalsContact O-N 3.17Å; E218-Q222 WeakPolarHBondContact O-CG 3.19Å; E218-Q222 PolarHBondContact O-N 2.82Å; E218-Q222 VanDerWaalsContact O-N 3.12Å
219	T	65	Low	63.8	Low	62 Å²	62	92.6 Å²	92.6	38%	0.38	46%	0.458	S	S	.	.	H	α-helix	trans	-56.5	-47.2	175.5	54.6	0	0	0	0	111.2	K215 Y216 K221 Q222 D223	K215-T219 PolarHBondContact O-N 2.92Å; K215-T219 VanDerWaalsContact O-N 3.14Å; Y216-T219 PolarHBondContact O-OG1 3.13Å; T219-K221 PolarHBondContact O-N 3.34Å; T219-Q222 WeakPolarHBondContact O-CB 3.33Å; T219-Q222 PolarHBondContact O-N 3.14Å; T219-Q222 VanDerWaalsContact O-N 3.1Å; T219-D223 PolarHBondContact O-N 3.17Å; T219-D223 VanDerWaalsContact O-N 3.14Å
220	Y	60.3	Low	62.6	Low	26 Å²	26	100.8 Å²	100.8	10%	0.102	50%	0.496	C	S	.	.	H	α-helix	trans	-70.8	-30.6	178.5	-172.7	-95.3	0	0	0	114.1	Y216 E218 Q222 D223 S224 L254 I255 Q258	Y216-Y220 PolarHBondContact O-N 3.49Å; E218-Y220 VanDerWaalsContact C-N 3.33Å; E218-Y220 PolarHBondContact O-N 3.37Å; Y220-Q222 PolarHBondContact O-N 2.6Å; Y220-D223 PolarHBondContact O-N 3.29Å; Y220-S224 WeakPolarHBondContact O-CB 3.3Å; Y220-S224 PolarHBondContact O-N 3.14Å; Y220-L254 VanDerWaalsContact OH-CD2 3.26Å; Y220-L254 WeakPolarHBondContact OH-CD2 3.31Å; Y220-I255 VanDerWaalsContact CB-CD1 3.45Å; Y220-I255 HydrophobicContact CD1-CD1 3.29Å; Y220-I255 HydrophobicContact CD1-CG1 3.44Å; Y220-I255 VanDerWaalsContact CD1-CG1 3.44Å; Y220-I255 HydrophobicContact CD2-CD1 4.15Å; Y220-I255 HydrophobicContact CD2-CG1 3.51Å; Y220-I255 HydrophobicContact CE1-CD1 4.01Å; Y220-I255 HydrophobicContact CE1-CG1 3.79Å; Y220-I255 HydrophobicContact CE2-CG1 3.86Å; Y220-I255 HydrophobicContact CG-CD1 3.35Å; Y220-I255 HydrophobicContact CG-CG1 3.26Å; Y220-Q258 VanDerWaalsContact CE2-OE1 3.32Å
221	K	62.4	Low	61.5	Low	113 Å²	113	100 Å²	100	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-63	-29.2	172.3	-82.7	171.3	178.9	176.5	0	111.2	R217 E218 T219 R225	R217-K221 HydrophobicContact CG-CD 4.37Å; R217-K221 WeakPolarHBondContact O-CB 3.31Å; R217-K221 WeakPolarHBondContact O-CG 3.41Å; R217-K221 PolarHBondContact O-N 2.85Å; R217-K221 VanDerWaalsContact O-N 3.15Å; E218-K221 PolarHBondContact O-N 3.46Å; E218-K221 VanDerWaalsContact O-N 3.17Å; T219-K221 PolarHBondContact O-N 3.34Å; K221-R225 WeakPolarHBondContact O-CB 3.38Å; K221-R225 VanDerWaalsContact O-CG 3.25Å; K221-R225 WeakPolarHBondContact O-CG 3.39Å; K221-R225 PolarHBondContact O-N 2.92Å
222	Q	59.3	Low	59.9	Low	130 Å²	130	105.6 Å²	105.6	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-72.9	-45.2	173.6	-65.8	169.8	-18.4	0	0	110.6	E218 T219 Y220 S224 R225 A226	E218-Q222 WeakPolarHBondContact O-CG 3.19Å; E218-Q222 PolarHBondContact O-N 2.82Å; E218-Q222 VanDerWaalsContact O-N 3.12Å; T219-Q222 WeakPolarHBondContact O-CB 3.33Å; T219-Q222 PolarHBondContact O-N 3.14Å; T219-Q222 VanDerWaalsContact O-N 3.1Å; Y220-Q222 PolarHBondContact O-N 2.6Å; Q222-S224 PolarHBondContact O-N 3.35Å; Q222-R225 WeakPolarHBondContact O-CB 3.43Å; Q222-R225 PolarHBondContact O-N 2.95Å; Q222-A226 PolarHBondContact O-N 3.4Å
223	D	55.8	Low	58.6	Low	103 Å²	103	107.4 Å²	107.4	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-64.7	-40.9	178	-60.8	-26.1	0	0	0	112.8	T219 Y220 R225 A226	T219-D223 PolarHBondContact O-N 3.17Å; T219-D223 VanDerWaalsContact O-N 3.14Å; Y220-D223 PolarHBondContact O-N 3.29Å; D223-R225 VanDerWaalsContact C-N 3.32Å; D223-R225 PolarHBondContact O-N 3.37Å; D223-A226 WeakPolarHBondContact O-CB 3.18Å; D223-A226 PolarHBondContact O-N 3.27Å
224	S	55.7	Low	57.5	Low	32 Å²	32	111.3 Å²	111.3	22%	0.224	57%	0.566	C	S	.	*	H	α-helix	trans	-73.8	-20.1	177.6	-173.5	0	0	0	0	113.4	Y220 Q222 A226 E227 K228	Y220-S224 WeakPolarHBondContact O-CB 3.3Å; Y220-S224 PolarHBondContact O-N 3.14Å; Q222-S224 PolarHBondContact O-N 3.35Å; S224-A226 VanDerWaalsContact C-N 3.33Å; S224-E227 PolarHBondContact O-N 3.48Å; S224-K228 PolarHBondContact O-N 3.28Å
225	R	55.2	Low	56.2	Low	184 Å²	184	113 Å²	113	69%	0.694	58%	0.583	S	S	*	*	H	α-helix	trans	-71.2	-29.7	171	-87	174.6	-180	174.8	0.3	111.7	K221 Q222 D223 E227 K228	K221-R225 WeakPolarHBondContact O-CB 3.38Å; K221-R225 VanDerWaalsContact O-CG 3.25Å; K221-R225 WeakPolarHBondContact O-CG 3.39Å; K221-R225 PolarHBondContact O-N 2.92Å; Q222-R225 WeakPolarHBondContact O-CB 3.43Å; Q222-R225 PolarHBondContact O-N 2.95Å; D223-R225 VanDerWaalsContact C-N 3.32Å; D223-R225 PolarHBondContact O-N 3.37Å; R225-E227 VanDerWaalsContact C-N 3.3Å; R225-E227 PolarHBondContact O-N 3.25Å; R225-K228 PolarHBondContact O-N 3.39Å
226	A	50.7	Low	55.5	Low	75 Å²	75	113.9 Å²	113.9	62%	0.62	59%	0.589	S	S	*	*	H	α-helix	trans	-66	-32.4	172.7	0	0	0	0	0	112.1	Q222 D223 S224	Q222-A226 PolarHBondContact O-N 3.4Å; D223-A226 WeakPolarHBondContact O-CB 3.18Å; D223-A226 PolarHBondContact O-N 3.27Å; S224-A226 VanDerWaalsContact C-N 3.33Å
227	E	50.9	Low	55.2	Low	115 Å²	115	119.8 Å²	119.8	54%	0.537	61%	0.611	S	S	.	*	H	α-helix	trans	-81.6	-13.4	179.9	-64.3	-179.8	151	0	0	114.1	S224 R225 Q229	S224-E227 PolarHBondContact O-N 3.48Å; R225-E227 VanDerWaalsContact C-N 3.3Å; R225-E227 PolarHBondContact O-N 3.25Å; E227-Q229 PolarHBondContact O-N 2.78Å
228	K	52.5	Low	55.6	Low	140 Å²	140	120.2 Å²	120.2	61%	0.609	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	0.9	-175.6	-117	-179.5	-174.8	-178.2	0	114.9	S224 R225	S224-K228 PolarHBondContact O-N 3.28Å; R225-K228 PolarHBondContact O-N 3.39Å
229	Q	53.3	Low	56.3	Low	175 Å²	175	117.3 Å²	117.3	82%	0.818	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-1.8	178.5	-69.1	-175.7	5	0	0	114.3	E227	E227-Q229 PolarHBondContact O-N 2.78Å
230	Q	45.7	Very low	57.3	Low	183 Å²	183	121.7 Å²	121.7	86%	0.855	61%	0.608	S	S	*	*	S	Bend	trans	-116	102.2	172.5	-69.4	179.7	1	0	0	109.8
231	G	49.8	Very low	58.6	Low	69 Å²	69	120.5 Å²	120.5	71%	0.711	60%	0.604	S	S	*	*			trans	-71.8	133.4	-177.1	0	0	0	0	0	112.6
232	H	44.9	Very low	59.7	Low	192 Å²	192	121 Å²	121	89%	0.889	61%	0.612	S	S	*	*			trans	-152.8	147.8	147.2	-117.3	-79.8	0	0	0	111.7
233	S	45.8	Very low	60.9	Low	93 Å²	93	120.5 Å²	120.5	65%	0.65	61%	0.61	S	S	*	*			trans	-75.1	144	-162.5	54.5	0	0	0	0	116.2	A235	S233-A235 PolarHBondContact O-N 3.07Å
234	T	48.9	Very low	62.5	Low	144 Å²	144	118.1 Å²	118.1	88%	0.883	60%	0.601	S	S	*	*			trans	9.7	93.4	148.7	55.2	0	0	0	0	119.7
235	A	48.2	Very low	64	Low	90 Å²	90	118.1 Å²	118.1	74%	0.744	61%	0.606	S	S	*	*	S	Bend	trans	-157.8	125.8	134.8	0	0	0	0	0	106	S233 R237	S233-A235 PolarHBondContact O-N 3.07Å; A235-R237 PolarHBondContact O-N 3.12Å
236	E	58.5	Low	65.5	Low	163 Å²	163	115.3 Å²	115.3	76%	0.762	60%	0.598	S	S	*	*			trans	15.3	93.1	-177.5	-86	-174.6	163.4	0	0	115.4	R238	E236-R238 VanDerWaalsContact C-N 3.29Å; E236-R238 PolarHBondContact O-N 3.42Å
237	R	59.1	Low	67.3	Low	184 Å²	184	113.7 Å²	113.7	69%	0.694	58%	0.583	S	S	*	*			trans	-60.7	89.9	-177.6	-158.5	177.4	-163.9	145.4	5.9	110.1	A235	A235-R237 PolarHBondContact O-N 3.12Å
238	R	77.2	Confident	69	Low	148 Å²	148	109.9 Å²	109.9	56%	0.558	57%	0.565	S	S	*	*			trans	-89.5	127.2	-178.8	-156.4	-179.4	-79.2	-178.5	-6.9	108.3	E236 R240 F248	E236-R238 VanDerWaalsContact C-N 3.29Å; E236-R238 PolarHBondContact O-N 3.42Å; R238-R240 PolarHBondContact O-N 2.77Å; R238-F248 CarbonylContact C-O 3.59Å; R238-F248 WeakPolarHBondContact CA-O 3.41Å; R238-F248 WeakPolarHBondContact CG-O 3.3Å
239	H	82.8	Confident	70.6	Confident	43 Å²	43	108.5 Å²	108.5	20%	0.199	57%	0.568	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.7	110	-179.1	-67.2	-81.9	0	0	0	109.1	S247 F248 K250 S251 L254	H239-S247 CarbonylContact O-C 3.32Å; H239-S247 WeakPolarHBondContact O-CA 3.36Å; H239-F248 PolarHBondContact N-O 2.91Å; H239-F248 WeakPolarHBondContact O-CD2 3.37Å; H239-F248 PolarHBondContact O-N 3.48Å; H239-K250 VanDerWaalsContact CD2-C 3.42Å; H239-S251 PolarHBondContact CD2-N 3.15Å; H239-S251 PolarHBondContact NE2-N 3.18Å; H239-L254 HydrophobicContact CB-CB 3.91Å; H239-L254 HydrophobicContact CB-CD2 3.65Å; H239-L254 HydrophobicContact CB-CG 4.41Å
240	R	86.7	Confident	72.1	Confident	153 Å²	153	106.4 Å²	106.4	58%	0.577	56%	0.556	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.3	136.8	-177.4	-175.4	-177.8	-67	-91.5	8.7	111	R238 G245 K246 L254	R238-R240 PolarHBondContact O-N 2.77Å; R240-G245 PolarHBondContact NH1-O 3.28Å; R240-K246 CarbonylContact C-O 3.59Å; R240-K246 WeakPolarHBondContact CA-O 3.43Å; R240-L254 WeakPolarHBondContact O-CD2 3.48Å
241	C	86.8	Confident	73.8	Confident	1 Å²	1	100 Å²	100	1%	0.007	53%	0.531	C	S	.	.			trans	-79.3	124.5	167.4	178.9	0	0	0	0	109.5	E243 C244 G245 K246 F248 L254	C241-E243 VanDerWaalsContact C-N 3.29Å; C241-E243 PolarHBondContact O-N 2.82Å; C241-C244 VanDerWaalsContact SG-SG 3.67Å; C241-G245 WeakPolarHBondContact O-CA 3.46Å; C241-G245 PolarHBondContact O-N 3.43Å; C241-K246 PolarHBondContact N-O 3.46Å; C241-F248 HydrophobicContact CB-CE2 4.24Å; C241-L254 HydrophobicContact CB-CD1 3.54Å
242	N	85.1	Confident	75.3	Confident	123 Å²	123	99.1 Å²	99.1	66%	0.658	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-24.1	-179.4	-64.9	-22.8	0	0	0	112.7
243	E	85.9	Confident	77.2	Confident	121 Å²	121	92.5 Å²	92.5	57%	0.565	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-39.2	-177.4	-65.1	-173.4	-133.3	0	0	114	C241 H261	C241-E243 VanDerWaalsContact C-N 3.29Å; C241-E243 PolarHBondContact O-N 2.82Å; E243-H261 WeakPolarHBondContact OE1-CB 3.27Å; E243-H261 IonicContact OE1-CG 2.99Å; E243-H261 WeakPolarHBondContact OE2-CB 3.26Å; E243-H261 IonicContact OE2-CE1 3.01Å; E243-H261 IonicContact OE2-CG 3.2Å; E243-H261 IonicContact OE2-ND1 3.81Å; E243-H261 PolarHBondContact OE2-ND1 3.34Å
244	C	88.9	Confident	79.1	Confident	53 Å²	53	88.2 Å²	88.2	36%	0.358	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.9	4	-178.2	70.5	0	0	0	0	114.4	C241 K246 H257 H261	C241-C244 VanDerWaalsContact SG-SG 3.67Å; C244-K246 PolarHBondContact O-N 3.21Å; C244-K246 VanDerWaalsContact SG-CG 3.54Å; C244-H257 PolarHBondContact SG-NE2 2.81Å; C244-H261 PolarHBondContact SG-NE2 3Å
245	G	86.4	Confident	80.7	Confident	32 Å²	32	82.5 Å²	82.5	33%	0.33	42%	0.421	S	S	.	.			trans	69.3	-2.9	178.6	0	0	0	0	0	115.3	R240 C241 S247	R240-G245 PolarHBondContact NH1-O 3.28Å; C241-G245 WeakPolarHBondContact O-CA 3.46Å; C241-G245 PolarHBondContact O-N 3.43Å; G245-S247 PolarHBondContact O-OG 3.2Å
246	K	86.9	Confident	82.5	Confident	124 Å²	124	81 Å²	81	54%	0.539	40%	0.399	S	S	.	.			trans	-62.7	140.2	179.6	-72.9	179.8	-175.6	172.3	0	110.8	R240 C241 C244 F248	R240-K246 CarbonylContact C-O 3.59Å; R240-K246 WeakPolarHBondContact CA-O 3.43Å; C241-K246 PolarHBondContact N-O 3.46Å; C244-K246 PolarHBondContact O-N 3.21Å; C244-K246 VanDerWaalsContact SG-CG 3.54Å; K246-F248 HydrophobicContact CB-CE2 3.78Å; K246-F248 HydrophobicContact CB-CZ 3.8Å; K246-F248 HydrophobicContact CD-CZ 4.49Å
247	S	89.3	Confident	83.9	Confident	42 Å²	42	73.9 Å²	73.9	29%	0.294	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.8	-173.5	-53.3	0	0	0	0	110.7	H239 G245	H239-S247 CarbonylContact O-C 3.32Å; H239-S247 WeakPolarHBondContact O-CA 3.36Å; G245-S247 PolarHBondContact O-OG 3.2Å
248	F	85.9	Confident	85.1	Confident	35 Å²	35	67.7 Å²	67.7	15%	0.154	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	146.3	-171.6	-57.6	-86.3	0	0	0	111.2	R238 H239 C241 K246 K250 V253 L254 H257	R238-F248 CarbonylContact C-O 3.59Å; R238-F248 WeakPolarHBondContact CA-O 3.41Å; R238-F248 WeakPolarHBondContact CG-O 3.3Å; H239-F248 PolarHBondContact N-O 2.91Å; H239-F248 WeakPolarHBondContact O-CD2 3.37Å; H239-F248 PolarHBondContact O-N 3.48Å; C241-F248 HydrophobicContact CB-CE2 4.24Å; K246-F248 HydrophobicContact CB-CE2 3.78Å; K246-F248 HydrophobicContact CB-CZ 3.8Å; K246-F248 HydrophobicContact CD-CZ 4.49Å; F248-K250 VanDerWaalsContact C-N 3.3Å; F248-K250 PolarHBondContact O-N 3.14Å; F248-V253 HydrophobicContact CB-CB 4.4Å; F248-V253 HydrophobicContact CB-CG1 4.49Å; F248-V253 HydrophobicContact CD1-CB 4.33Å; F248-V253 HydrophobicContact CD1-CG1 3.57Å; F248-V253 HydrophobicContact CE1-CG1 4.22Å; F248-V253 HydrophobicContact CG-CG1 4.31Å; F248-L254 HydrophobicContact CB-CB 4.24Å; F248-L254 HydrophobicContact CD2-CB 3.79Å; F248-L254 HydrophobicContact CD2-CD1 3.6Å; F248-L254 HydrophobicContact CD2-CG 4.27Å; F248-L254 HydrophobicContact CE2-CD1 3.71Å; F248-L254 HydrophobicContact CG-CB 4.21Å; F248-H257 HydrophobicContact CE1-CB 3.94Å; F248-H257 HydrophobicContact CE2-CB 3.93Å; F248-H257 AromaticContact CE2-CD2 3.32Å; F248-H257 WeakPolarHBondContact CE2-CD2 3.49Å; F248-H257 AromaticContact CE2-CG 3.64Å; F248-H257 HydrophobicContact CZ-CB 3.49Å; F248-H257 VanDerWaalsContact CZ-CB 3.49Å; F248-H257 AromaticContact CZ-CD2 3.29Å; F248-H257 WeakPolarHBondContact CZ-CD2 3.4Å; F248-H257 AromaticContact CZ-CG 3.16Å; F248-H257 AromaticContact CZ-ND1 3.69Å; F248-H257 AromaticContact CZ-NE2 3.83Å
249	T	86.8	Confident	85.6	Confident	111 Å²	111	61.5 Å²	61.5	68%	0.681	32%	0.321	S	S	*	.	S	Bend	trans	-75	-19.5	-179.5	52.2	0	0	0	0	113.4
250	K	84.3	Confident	85.8	Confident	131 Å²	131	64.6 Å²	64.6	57%	0.57	34%	0.338	S	S	*	.	S	Bend	trans	-132.6	139.4	-179.1	-63.5	179.8	-179.2	179.3	0	110.1	H239 F248 S252 V253 L254	H239-K250 VanDerWaalsContact CD2-C 3.42Å; F248-K250 VanDerWaalsContact C-N 3.3Å; F248-K250 PolarHBondContact O-N 3.14Å; K250-S252 VanDerWaalsContact C-N 3.27Å; K250-S252 PolarHBondContact O-N 3.47Å; K250-V253 HydrophobicContact CB-CG2 4.06Å; K250-V253 PolarHBondContact O-N 3.38Å; K250-V253 VanDerWaalsContact O-N 3.15Å; K250-L254 PolarHBondContact O-N 3.07Å
251	S	81.2	Confident	85.8	Confident	48 Å²	48	60.6 Å²	60.6	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-57.8	-40.8	175.7	52.7	0	0	0	0	112	H239 V253 L254 I255	H239-S251 PolarHBondContact CD2-N 3.15Å; H239-S251 PolarHBondContact NE2-N 3.18Å; S251-V253 PolarHBondContact O-N 2.97Å; S251-L254 WeakPolarHBondContact O-CB 3.48Å; S251-L254 PolarHBondContact O-N 3.17Å; S251-I255 WeakPolarHBondContact O-CG1 3.36Å; S251-I255 PolarHBondContact O-N 3.5Å
252	S	81.5	Confident	85.8	Confident	51 Å²	51	64.4 Å²	64.4	36%	0.357	35%	0.349	S	S	.	.	H	α-helix	trans	-57.4	-34.8	178.7	62.2	0	0	0	0	113.3	K250 E256	K250-S252 VanDerWaalsContact C-N 3.27Å; K250-S252 PolarHBondContact O-N 3.47Å; S252-E256 WeakPolarHBondContact O-CB 3.5Å; S252-E256 PolarHBondContact O-N 3.11Å; S252-E256 VanDerWaalsContact O-N 3.16Å
253	V	84.9	Confident	85.9	Confident	52 Å²	52	60.9 Å²	60.9	32%	0.315	34%	0.341	S	S	.	.	H	α-helix	trans	-77.3	-34.1	178.6	-176.5	0	0	0	0	110.7	F248 K250 S251 H257	F248-V253 HydrophobicContact CB-CB 4.4Å; F248-V253 HydrophobicContact CB-CG1 4.49Å; F248-V253 HydrophobicContact CD1-CB 4.33Å; F248-V253 HydrophobicContact CD1-CG1 3.57Å; F248-V253 HydrophobicContact CE1-CG1 4.22Å; F248-V253 HydrophobicContact CG-CG1 4.31Å; K250-V253 HydrophobicContact CB-CG2 4.06Å; K250-V253 PolarHBondContact O-N 3.38Å; K250-V253 VanDerWaalsContact O-N 3.15Å; S251-V253 PolarHBondContact O-N 2.97Å; V253-H257 VanDerWaalsContact O-CB 3.27Å; V253-H257 WeakPolarHBondContact O-CB 3.44Å; V253-H257 PolarHBondContact O-N 2.82Å
254	L	85.7	Confident	86	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.016	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-45.3	171.4	172.1	61	0	0	0	111.3	Y220 H239 R240 C241 F248 K250 S251 E256 H257 Q258	Y220-L254 VanDerWaalsContact OH-CD2 3.26Å; Y220-L254 WeakPolarHBondContact OH-CD2 3.31Å; H239-L254 HydrophobicContact CB-CB 3.91Å; H239-L254 HydrophobicContact CB-CD2 3.65Å; H239-L254 HydrophobicContact CB-CG 4.41Å; R240-L254 WeakPolarHBondContact O-CD2 3.48Å; C241-L254 HydrophobicContact CB-CD1 3.54Å; F248-L254 HydrophobicContact CB-CB 4.24Å; F248-L254 HydrophobicContact CD2-CB 3.79Å; F248-L254 HydrophobicContact CD2-CD1 3.6Å; F248-L254 HydrophobicContact CD2-CG 4.27Å; F248-L254 HydrophobicContact CE2-CD1 3.71Å; F248-L254 HydrophobicContact CG-CB 4.21Å; K250-L254 PolarHBondContact O-N 3.07Å; S251-L254 WeakPolarHBondContact O-CB 3.48Å; S251-L254 PolarHBondContact O-N 3.17Å; L254-E256 VanDerWaalsContact C-N 3.34Å; L254-E256 PolarHBondContact O-N 3.43Å; L254-H257 CarbonylContact O-C 3.53Å; L254-H257 WeakPolarHBondContact O-CA 3.49Å; L254-H257 WeakPolarHBondContact O-CB 3.37Å; L254-H257 PolarHBondContact O-N 3.09Å; L254-H257 VanDerWaalsContact O-N 3.11Å; L254-Q258 HydrophobicContact CD1-CG 4.16Å; L254-Q258 WeakPolarHBondContact O-CG 3.43Å; L254-Q258 PolarHBondContact O-N 3.05Å
255	I	83.8	Confident	86	Confident	24 Å²	24	62.7 Å²	62.7	12%	0.123	34%	0.343	C	S	.	.	H	α-helix	trans	-57.1	-50.4	177.1	-62.9	166.5	0	0	0	110.4	Y220 S251 H257 Q258 R259	Y220-I255 VanDerWaalsContact CB-CD1 3.45Å; Y220-I255 HydrophobicContact CD1-CD1 3.29Å; Y220-I255 HydrophobicContact CD1-CG1 3.44Å; Y220-I255 VanDerWaalsContact CD1-CG1 3.44Å; Y220-I255 HydrophobicContact CD2-CD1 4.15Å; Y220-I255 HydrophobicContact CD2-CG1 3.51Å; Y220-I255 HydrophobicContact CE1-CD1 4.01Å; Y220-I255 HydrophobicContact CE1-CG1 3.79Å; Y220-I255 HydrophobicContact CE2-CG1 3.86Å; Y220-I255 HydrophobicContact CG-CD1 3.35Å; Y220-I255 HydrophobicContact CG-CG1 3.26Å; S251-I255 WeakPolarHBondContact O-CG1 3.36Å; S251-I255 PolarHBondContact O-N 3.5Å; I255-H257 PolarHBondContact O-N 3.34Å; I255-Q258 WeakPolarHBondContact O-CB 3.47Å; I255-Q258 PolarHBondContact O-N 3.3Å; I255-Q258 VanDerWaalsContact O-N 3.14Å; I255-R259 PolarHBondContact O-N 3.26Å
256	E	85.2	Confident	86	Confident	60 Å²	60	62.1 Å²	62.1	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-37.1	178.4	-169	-155.7	107.4	0	0	111.6	S252 L254 R259 R278	S252-E256 WeakPolarHBondContact O-CB 3.5Å; S252-E256 PolarHBondContact O-N 3.11Å; S252-E256 VanDerWaalsContact O-N 3.16Å; L254-E256 VanDerWaalsContact C-N 3.34Å; L254-E256 PolarHBondContact O-N 3.43Å; E256-R259 WeakPolarHBondContact O-CB 3.45Å; E256-R259 PolarHBondContact O-N 3.48Å; E256-R278 HydrophobicContact CG-CG 4.03Å; E256-R278 IonicContact OE1-CZ 3.89Å; E256-R278 IonicContact OE1-NE 3.32Å; E256-R278 PolarHBondContact OE1-NE 3.44Å; E256-R278 IonicContact OE1-NH2 3.77Å; E256-R278 PolarHBondContact OE1-NH2 3.23Å
257	H	86.7	Confident	86.1	Confident	13 Å²	13	56.6 Å²	56.6	6%	0.06	31%	0.309	C	S	.	.	H	α-helix	trans	-66.9	-38.8	175	170.1	65.5	0	0	0	112.9	C244 F248 V253 L254 I255 R259 I260 H261	C244-H257 PolarHBondContact SG-NE2 2.81Å; F248-H257 HydrophobicContact CE1-CB 3.94Å; F248-H257 HydrophobicContact CE2-CB 3.93Å; F248-H257 AromaticContact CE2-CD2 3.32Å; F248-H257 WeakPolarHBondContact CE2-CD2 3.49Å; F248-H257 AromaticContact CE2-CG 3.64Å; F248-H257 HydrophobicContact CZ-CB 3.49Å; F248-H257 VanDerWaalsContact CZ-CB 3.49Å; F248-H257 AromaticContact CZ-CD2 3.29Å; F248-H257 WeakPolarHBondContact CZ-CD2 3.4Å; F248-H257 AromaticContact CZ-CG 3.16Å; F248-H257 AromaticContact CZ-ND1 3.69Å; F248-H257 AromaticContact CZ-NE2 3.83Å; V253-H257 VanDerWaalsContact O-CB 3.27Å; V253-H257 WeakPolarHBondContact O-CB 3.44Å; V253-H257 PolarHBondContact O-N 2.82Å; L254-H257 CarbonylContact O-C 3.53Å; L254-H257 WeakPolarHBondContact O-CA 3.49Å; L254-H257 WeakPolarHBondContact O-CB 3.37Å; L254-H257 PolarHBondContact O-N 3.09Å; L254-H257 VanDerWaalsContact O-N 3.11Å; I255-H257 PolarHBondContact O-N 3.34Å; H257-R259 PolarHBondContact O-N 3.41Å; H257-I260 VanDerWaalsContact O-CB 3.24Å; H257-I260 WeakPolarHBondContact O-CB 3.34Å; H257-I260 WeakPolarHBondContact O-CG1 3.39Å; H257-I260 PolarHBondContact O-N 3.48Å; H257-H261 AromaticContact CE1-NE2 3.77Å; H257-H261 AromaticContact NE2-CD2 3.83Å; H257-H261 AromaticContact NE2-NE2 3.44Å; H257-H261 PolarHBondContact NE2-NE2 3.45Å
258	Q	84.4	Confident	86.1	Confident	53 Å²	53	60.4 Å²	60.4	25%	0.248	32%	0.322	C	S	.	.	H	α-helix	trans	-60.8	-27.1	177.2	-75.1	173.2	-51.7	0	0	112.3	Y220 L254 I255 I260 H261 T262	Y220-Q258 VanDerWaalsContact CE2-OE1 3.32Å; L254-Q258 HydrophobicContact CD1-CG 4.16Å; L254-Q258 WeakPolarHBondContact O-CG 3.43Å; L254-Q258 PolarHBondContact O-N 3.05Å; I255-Q258 WeakPolarHBondContact O-CB 3.47Å; I255-Q258 PolarHBondContact O-N 3.3Å; I255-Q258 VanDerWaalsContact O-N 3.14Å; Q258-I260 PolarHBondContact O-N 2.91Å; Q258-I260 VanDerWaalsContact O-N 3.1Å; Q258-H261 WeakPolarHBondContact O-CA 3.22Å; Q258-H261 VanDerWaalsContact O-CB 3.3Å; Q258-H261 WeakPolarHBondContact O-CB 3.47Å; Q258-H261 PolarHBondContact O-N 3Å; Q258-T262 PolarHBondContact O-N 3.32Å; Q258-T262 PolarHBondContact O-OG1 2.97Å
259	R	88.5	Confident	86.2	Confident	18 Å²	18	58.8 Å²	58.8	7%	0.068	32%	0.315	C	S	.	.	H	α-helix	trans	-59.8	-22	172.3	-62	178.7	179.9	167.5	-2.3	113.8	I255 E256 H257 H261 T262 G263 E264 Y267 S277	I255-R259 PolarHBondContact O-N 3.26Å; E256-R259 WeakPolarHBondContact O-CB 3.45Å; E256-R259 PolarHBondContact O-N 3.48Å; H257-R259 PolarHBondContact O-N 3.41Å; R259-H261 VanDerWaalsContact C-N 3.29Å; R259-T262 WeakPolarHBondContact CA-OG1 3.3Å; R259-G263 CarbonylContact O-C 3.3Å; R259-G263 VanDerWaalsContact O-CA 3.31Å; R259-G263 WeakPolarHBondContact O-CA 3.43Å; R259-G263 PolarHBondContact O-N 3.11Å; R259-E264 HydrophobicContact CB-CB 4.44Å; R259-E264 HydrophobicContact CG-CB 4.3Å; R259-E264 PolarHBondContact O-N 3.32Å; R259-Y267 PolarHBondContact NH1-OH 3Å; R259-S277 WeakPolarHBondContact CD-O 3.35Å; R259-S277 PolarHBondContact NH1-O 3.28Å
260	I	87.8	Confident	86.2	Confident	109 Å²	109	58.5 Å²	58.5	56%	0.559	31%	0.306	S	S	*	.	H	α-helix	trans	-69.8	-33.4	174.3	-58.1	176.3	0	0	0	110.6	H257 Q258	H257-I260 VanDerWaalsContact O-CB 3.24Å; H257-I260 WeakPolarHBondContact O-CB 3.34Å; H257-I260 WeakPolarHBondContact O-CG1 3.39Å; H257-I260 PolarHBondContact O-N 3.48Å; Q258-I260 PolarHBondContact O-N 2.91Å; Q258-I260 VanDerWaalsContact O-N 3.1Å
261	H	86.9	Confident	86.2	Confident	69 Å²	69	56 Å²	56	32%	0.319	30%	0.296	S	S	.	.	H	α-helix	trans	-79.8	-47.2	-179.5	-73.7	-79.9	0	0	0	111.9	E243 C244 H257 Q258 R259 G263	E243-H261 WeakPolarHBondContact OE1-CB 3.27Å; E243-H261 IonicContact OE1-CG 2.99Å; E243-H261 WeakPolarHBondContact OE2-CB 3.26Å; E243-H261 IonicContact OE2-CE1 3.01Å; E243-H261 IonicContact OE2-CG 3.2Å; E243-H261 IonicContact OE2-ND1 3.81Å; E243-H261 PolarHBondContact OE2-ND1 3.34Å; C244-H261 PolarHBondContact SG-NE2 3Å; H257-H261 AromaticContact CE1-NE2 3.77Å; H257-H261 AromaticContact NE2-CD2 3.83Å; H257-H261 AromaticContact NE2-NE2 3.44Å; H257-H261 PolarHBondContact NE2-NE2 3.45Å; Q258-H261 WeakPolarHBondContact O-CA 3.22Å; Q258-H261 VanDerWaalsContact O-CB 3.3Å; Q258-H261 WeakPolarHBondContact O-CB 3.47Å; Q258-H261 PolarHBondContact O-N 3Å; R259-H261 VanDerWaalsContact C-N 3.29Å; H261-G263 VanDerWaalsContact C-N 3.28Å; H261-G263 PolarHBondContact O-N 3.23Å
262	T	86.6	Confident	86.5	Confident	81 Å²	81	56.2 Å²	56.2	50%	0.497	30%	0.297	S	S	.	.	H	α-helix	trans	-75.9	-19	178.8	61.7	0	0	0	0	112.8	Q258 R259 E264	Q258-T262 PolarHBondContact O-N 3.32Å; Q258-T262 PolarHBondContact O-OG1 2.97Å; R259-T262 WeakPolarHBondContact CA-OG1 3.3Å; T262-E264 PolarHBondContact O-N 2.87Å; T262-E264 WeakPolarHBondContact OG1-CB 3.23Å; T262-E264 WeakPolarHBondContact OG1-CG 3.47Å; T262-E264 PolarHBondContact OG1-N 3.45Å
263	G	86.9	Confident	86.9	Confident	48 Å²	48	55.8 Å²	55.8	50%	0.495	30%	0.301	S	S	.	.			trans	74.4	5.3	-173.8	0	0	0	0	0	113.8	R259 H261 K265	R259-G263 CarbonylContact O-C 3.3Å; R259-G263 VanDerWaalsContact O-CA 3.31Å; R259-G263 WeakPolarHBondContact O-CA 3.43Å; R259-G263 PolarHBondContact O-N 3.11Å; H261-G263 VanDerWaalsContact C-N 3.28Å; H261-G263 PolarHBondContact O-N 3.23Å; G263-K265 PolarHBondContact O-N 3.2Å
264	E	86.8	Confident	87.2	Confident	86 Å²	86	59.2 Å²	59.2	40%	0.402	31%	0.312	S	S	.	.			trans	-59	131	180	-76.9	178.9	-177.9	0	0	112	R259 T262	R259-E264 HydrophobicContact CB-CB 4.44Å; R259-E264 HydrophobicContact CG-CB 4.3Å; R259-E264 PolarHBondContact O-N 3.32Å; T262-E264 PolarHBondContact O-N 2.87Å; T262-E264 WeakPolarHBondContact OG1-CB 3.23Å; T262-E264 WeakPolarHBondContact OG1-CG 3.47Å; T262-E264 PolarHBondContact OG1-N 3.45Å
265	K	89.8	Confident	87.5	Confident	127 Å²	127	60.6 Å²	60.6	55%	0.552	32%	0.323	S	S	*	.			trans	-130.5	78.7	179.5	-72.7	166.8	172.1	-170.9	0	109.6	G263 Y267 A275 F276	G263-K265 PolarHBondContact O-N 3.2Å; K265-Y267 PolarHBondContact O-N 3.21Å; K265-A275 HydrophobicContact CB-CB 3.54Å; K265-A275 HydrophobicContact CD-CB 4.25Å; K265-A275 WeakPolarHBondContact CD-O 3.39Å; K265-F276 CarbonylContact C-O 3.55Å; K265-F276 VanDerWaalsContact CA-O 3.27Å; K265-F276 WeakPolarHBondContact CA-O 3.27Å
266	P	87	Confident	87.8	Confident	20 Å²	20	61.6 Å²	61.6	13%	0.13	33%	0.327	C	S	.	.			trans	-69.2	-17.8	-169.9	-22.3	35.7	0	0	0	114.7	Y216	Y216-P266 HydrophobicContact CD2-CB 4.33Å; Y216-P266 HydrophobicContact CD2-CG 4.38Å; Y216-P266 HydrophobicContact CE1-CG 4.06Å; Y216-P266 HydrophobicContact CE2-CB 3.54Å; Y216-P266 HydrophobicContact CE2-CG 3.69Å; Y216-P266 VanDerWaalsContact CZ-CG 3.49Å; Y216-P266 WeakPolarHBondContact OH-CG 3.47Å
267	Y	88.6	Confident	88	Confident	7 Å²	7	60.4 Å²	60.4	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	101.3	-174.1	-49.2	-80.9	0	0	0	109.7	L212 D213 R259 K265 A275 F276 S277 R279	L212-Y267 HydrophobicContact CB-CE1 4.4Å; L212-Y267 HydrophobicContact CD1-CD1 4.39Å; D213-Y267 VanDerWaalsContact OD1-CE1 3.25Å; D213-Y267 WeakPolarHBondContact OD1-CE1 3.29Å; D213-Y267 VanDerWaalsContact OD1-CZ 3.24Å; D213-Y267 PolarHBondContact OD1-OH 3.17Å; R259-Y267 PolarHBondContact NH1-OH 3Å; K265-Y267 PolarHBondContact O-N 3.21Å; Y267-A275 CarbonylContact O-C 3.19Å; Y267-A275 WeakPolarHBondContact O-CA 2.99Å; Y267-F276 WeakPolarHBondContact CD2-O 3.44Å; Y267-F276 PolarHBondContact N-O 2.91Å; Y267-F276 VanDerWaalsContact N-O 3.11Å; Y267-F276 PolarHBondContact O-N 3.23Å; Y267-S277 WeakPolarHBondContact CE2-O 3.33Å; Y267-R279 HydrophobicContact CD1-CB 4.08Å; Y267-R279 HydrophobicContact CD1-CG 4.42Å; Y267-R279 VanDerWaalsContact CD2-N 3.35Å; Y267-R279 HydrophobicContact CE1-CB 3.9Å; Y267-R279 HydrophobicContact CE1-CG 4.46Å; Y267-R279 HydrophobicContact CE2-CB 4.47Å; Y267-R279 VanDerWaalsContact CE2-N 3.33Å; Y267-R279 HydrophobicContact CG-CB 4.45Å
268	E	89.3	Confident	88	Confident	122 Å²	122	64.7 Å²	64.7	57%	0.57	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	139	-180	-167.2	174.2	163.7	0	0	111.9	E270 G273 A275	E268-E270 PolarHBondContact O-N 3.06Å; E268-G273 WeakPolarHBondContact OE1-CA 3.39Å; E268-A275 HydrophobicContact CB-CB 4.47Å; E268-A275 HydrophobicContact CG-CB 4.46Å
269	C	87.9	Confident	88	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.007	34%	0.337	C	S	.	.			trans	-81.6	112.7	171.2	-176.3	0	0	0	0	109.9	E271 C272 G273 K274 F276 L282	C269-E271 PolarHBondContact O-N 2.49Å; C269-C272 PolarHBondContact O-N 2.76Å; C269-G273 VanDerWaalsContact O-CA 3.26Å; C269-G273 WeakPolarHBondContact O-CA 3.3Å; C269-G273 PolarHBondContact O-N 2.82Å; C269-K274 HydrophobicContact CB-CB 4.47Å; C269-K274 VanDerWaalsContact CB-O 3.3Å; C269-K274 WeakPolarHBondContact CB-O 3.39Å; C269-K274 PolarHBondContact N-O 3.45Å; C269-F276 HydrophobicContact CB-CE2 4.47Å; C269-L282 HydrophobicContact CB-CD1 3.62Å
270	E	86	Confident	87.9	Confident	105 Å²	105	67.2 Å²	67.2	49%	0.491	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.8	178.6	-56.2	-176.2	138.7	0	0	113.4	R205 R208 E268	R205-E270 IonicContact CZ-OE2 3.06Å; R205-E270 VanDerWaalsContact CZ-OE2 3.26Å; R205-E270 IonicContact NE-OE2 2.69Å; R205-E270 PolarHBondContact NE-OE2 3.35Å; R205-E270 IonicContact NH2-OE2 2.74Å; R205-E270 PolarHBondContact NH2-OE2 3.46Å; R208-E270 IonicContact CZ-OE1 2.71Å; R208-E270 IonicContact NH1-OE1 3.07Å; R208-E270 PolarHBondContact NH1-OE1 3.18Å; R208-E270 VanDerWaalsContact NH2-CD 3.34Å; R208-E270 IonicContact NH2-OE1 3.32Å; R208-E270 PolarHBondContact NH2-OE1 2.75Å; R208-E270 IonicContact NH2-OE2 3.8Å; R208-E270 PolarHBondContact NH2-OE2 3.29Å; E268-E270 PolarHBondContact O-N 3.06Å
271	E	84.5	Confident	88	Confident	79 Å²	79	63.9 Å²	63.9	37%	0.369	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-26	-175.6	-66.6	159.7	-137.5	0	0	112.5	R205 C269 R286 H289	R205-E271 IonicContact NH1-OE1 2.9Å; R205-E271 PolarHBondContact NH1-OE1 3.06Å; C269-E271 PolarHBondContact O-N 2.49Å; E271-R286 IonicContact OE1-NE 3.83Å; E271-H289 WeakPolarHBondContact OE2-CB 3.36Å; E271-H289 IonicContact OE2-CD2 2.79Å; E271-H289 PolarHBondContact OE2-CD2 3.1Å; E271-H289 IonicContact OE2-CG 3.11Å
272	C	88.3	Confident	88.2	Confident	53 Å²	53	60.9 Å²	60.9	36%	0.358	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.4	9.2	-177.3	72	0	0	0	0	115.8	C269 K274 H285 H289	C269-C272 PolarHBondContact O-N 2.76Å; C272-K274 PolarHBondContact O-N 2.89Å; C272-H285 PolarHBondContact SG-NE2 3.37Å; C272-H289 PolarHBondContact SG-NE2 3.16Å; C272-H289 VanDerWaalsContact SG-NE2 3.37Å
273	G	89	Confident	88.2	Confident	42 Å²	42	59.5 Å²	59.5	43%	0.433	32%	0.322	S	S	.	.			trans	66	4.4	-179.2	0	0	0	0	0	114.9	E268 C269 A275	E268-G273 WeakPolarHBondContact OE1-CA 3.39Å; C269-G273 VanDerWaalsContact O-CA 3.26Å; C269-G273 WeakPolarHBondContact O-CA 3.3Å; C269-G273 PolarHBondContact O-N 2.82Å; G273-A275 PolarHBondContact O-N 3.19Å
274	K	91.1	Very high	88.2	Confident	124 Å²	124	61 Å²	61	54%	0.539	32%	0.317	S	S	.	.			trans	-73.8	122.7	-178.8	-75.4	-179.6	-175.8	168	0	110.7	C269 C272 F276	C269-K274 HydrophobicContact CB-CB 4.47Å; C269-K274 VanDerWaalsContact CB-O 3.3Å; C269-K274 WeakPolarHBondContact CB-O 3.39Å; C269-K274 PolarHBondContact N-O 3.45Å; C272-K274 PolarHBondContact O-N 2.89Å; K274-F276 HydrophobicContact CB-CE2 3.94Å; K274-F276 HydrophobicContact CB-CZ 4.14Å; K274-F276 WeakPolarHBondContact O-CD2 3.25Å; K274-F276 VanDerWaalsContact O-CE2 3.22Å; K274-F276 WeakPolarHBondContact O-CE2 3.49Å
275	A	92.1	Very high	88.4	Confident	32 Å²	32	58.3 Å²	58.3	26%	0.264	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	144.2	179.1	0	0	0	0	0	113.4	K265 Y267 E268 G273	K265-A275 HydrophobicContact CB-CB 3.54Å; K265-A275 HydrophobicContact CD-CB 4.25Å; K265-A275 WeakPolarHBondContact CD-O 3.39Å; Y267-A275 CarbonylContact O-C 3.19Å; Y267-A275 WeakPolarHBondContact O-CA 2.99Å; E268-A275 HydrophobicContact CB-CB 4.47Å; E268-A275 HydrophobicContact CG-CB 4.46Å; G273-A275 PolarHBondContact O-N 3.19Å
276	F	90.8	Very high	88.2	Confident	45 Å²	45	55.2 Å²	55.2	20%	0.197	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149	-178	-59.4	-90.1	0	0	0	111	K265 Y267 C269 K274 R278 L282 H285	K265-F276 CarbonylContact C-O 3.55Å; K265-F276 VanDerWaalsContact CA-O 3.27Å; K265-F276 WeakPolarHBondContact CA-O 3.27Å; Y267-F276 WeakPolarHBondContact CD2-O 3.44Å; Y267-F276 PolarHBondContact N-O 2.91Å; Y267-F276 VanDerWaalsContact N-O 3.11Å; Y267-F276 PolarHBondContact O-N 3.23Å; C269-F276 HydrophobicContact CB-CE2 4.47Å; K274-F276 HydrophobicContact CB-CE2 3.94Å; K274-F276 HydrophobicContact CB-CZ 4.14Å; K274-F276 WeakPolarHBondContact O-CD2 3.25Å; K274-F276 VanDerWaalsContact O-CE2 3.22Å; K274-F276 WeakPolarHBondContact O-CE2 3.49Å; F276-R278 VanDerWaalsContact C-N 3.3Å; F276-L282 HydrophobicContact CB-CB 4.31Å; F276-L282 HydrophobicContact CD2-CB 3.88Å; F276-L282 HydrophobicContact CD2-CD1 3.77Å; F276-L282 HydrophobicContact CD2-CG 4.44Å; F276-L282 HydrophobicContact CE2-CD1 3.96Å; F276-L282 HydrophobicContact CG-CB 4.25Å; F276-H285 HydrophobicContact CE1-CB 3.89Å; F276-H285 HydrophobicContact CE2-CB 3.81Å; F276-H285 AromaticContact CE2-CD2 3.27Å; F276-H285 WeakPolarHBondContact CE2-CD2 3.46Å; F276-H285 AromaticContact CE2-CG 3.62Å; F276-H285 HydrophobicContact CZ-CB 3.34Å; F276-H285 AromaticContact CZ-CD2 3.34Å; F276-H285 WeakPolarHBondContact CZ-CD2 3.41Å; F276-H285 AromaticContact CZ-CG 3.2Å; F276-H285 AromaticContact CZ-ND1 3.87Å
277	S	89.1	Confident	88.2	Confident	34 Å²	34	57.3 Å²	57.3	24%	0.238	29%	0.294	C	S	.	.	S	Bend	trans	-80.9	-12.2	176	58	0	0	0	0	113.4	R259 Y267	R259-S277 WeakPolarHBondContact CD-O 3.35Å; R259-S277 PolarHBondContact NH1-O 3.28Å; Y267-S277 WeakPolarHBondContact CE2-O 3.33Å
278	R	86.5	Confident	88.2	Confident	104 Å²	104	60.8 Å²	60.8	39%	0.392	32%	0.319	S	S	.	.	S	Bend	trans	-134.1	139.1	-178	-64	171	178.8	164.1	-8.3	111	E256 F276 S280 S281 L282	E256-R278 HydrophobicContact CG-CG 4.03Å; E256-R278 IonicContact OE1-CZ 3.89Å; E256-R278 IonicContact OE1-NE 3.32Å; E256-R278 PolarHBondContact OE1-NE 3.44Å; E256-R278 IonicContact OE1-NH2 3.77Å; E256-R278 PolarHBondContact OE1-NH2 3.23Å; F276-R278 VanDerWaalsContact C-N 3.3Å; R278-S280 PolarHBondContact O-N 3.36Å; R278-S281 WeakPolarHBondContact O-CB 3.39Å; R278-S281 PolarHBondContact O-N 3.39Å; R278-L282 PolarHBondContact O-N 3.04Å
279	R	85.6	Confident	87.9	Confident	45 Å²	45	58.8 Å²	58.8	17%	0.17	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-43.1	173.6	-168.8	-167.3	-51.3	-149.2	-6.8	112.8	D209 V210 D213 Y267 S281 L282 N283	D209-R279 VanDerWaalsContact C-CZ 3.45Å; D209-R279 HydrophobicContact CB-CG 4.18Å; D209-R279 PolarHBondContact O-NH2 3.14Å; V210-R279 VanDerWaalsContact CA-NH2 3.29Å; V210-R279 VanDerWaalsContact CG2-NH1 3.32Å; V210-R279 VanDerWaalsContact N-NH2 3.13Å; D213-R279 IonicContact OD1-CZ 2.63Å; D213-R279 IonicContact OD1-NE 2.69Å; D213-R279 IonicContact OD1-NH2 3.31Å; D213-R279 PolarHBondContact OD1-NH2 3.46Å; D213-R279 IonicContact OD2-CZ 3.27Å; D213-R279 IonicContact OD2-NH2 2.76Å; D213-R279 PolarHBondContact OD2-NH2 2.94Å; Y267-R279 HydrophobicContact CD1-CB 4.08Å; Y267-R279 HydrophobicContact CD1-CG 4.42Å; Y267-R279 VanDerWaalsContact CD2-N 3.35Å; Y267-R279 HydrophobicContact CE1-CB 3.9Å; Y267-R279 HydrophobicContact CE1-CG 4.46Å; Y267-R279 HydrophobicContact CE2-CB 4.47Å; Y267-R279 VanDerWaalsContact CE2-N 3.33Å; Y267-R279 HydrophobicContact CG-CB 4.45Å; R279-S281 PolarHBondContact O-N 3.39Å; R279-L282 PolarHBondContact O-N 3.27Å; R279-L282 VanDerWaalsContact O-N 3.13Å; R279-N283 PolarHBondContact O-N 3.24Å
280	S	85.9	Confident	87.7	Confident	79 Å²	79	62.2 Å²	62.2	55%	0.552	33%	0.331	S	S	*	.	H	α-helix	trans	-59.1	-36.1	178.7	52.8	0	0	0	0	112.2	R278 N283 E284	R278-S280 PolarHBondContact O-N 3.36Å; S280-N283 PolarHBondContact O-N 3.24Å; S280-E284 WeakPolarHBondContact O-CB 3.12Å; S280-E284 PolarHBondContact O-N 3.44Å
281	S	90.2	Very high	87.7	Confident	39 Å²	39	59.4 Å²	59.4	27%	0.273	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-39.9	175.5	-58.9	0	0	0	0	112.5	R278 R279 E284 H285	R278-S281 WeakPolarHBondContact O-CB 3.39Å; R278-S281 PolarHBondContact O-N 3.39Å; R279-S281 PolarHBondContact O-N 3.39Å; S281-E284 PolarHBondContact O-N 2.97Å; S281-H285 VanDerWaalsContact O-CB 3.3Å; S281-H285 WeakPolarHBondContact O-CB 3.27Å; S281-H285 PolarHBondContact O-N 3.28Å
282	L	89.9	Confident	87.8	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-60.7	-46.6	171.4	173.1	61.8	0	0	0	110.9	C269 F276 R278 R279 E284 H285 R286	C269-L282 HydrophobicContact CB-CD1 3.62Å; F276-L282 HydrophobicContact CB-CB 4.31Å; F276-L282 HydrophobicContact CD2-CB 3.88Å; F276-L282 HydrophobicContact CD2-CD1 3.77Å; F276-L282 HydrophobicContact CD2-CG 4.44Å; F276-L282 HydrophobicContact CE2-CD1 3.96Å; F276-L282 HydrophobicContact CG-CB 4.25Å; R278-L282 PolarHBondContact O-N 3.04Å; R279-L282 PolarHBondContact O-N 3.27Å; R279-L282 VanDerWaalsContact O-N 3.13Å; L282-E284 PolarHBondContact O-N 3.24Å; L282-H285 WeakPolarHBondContact O-CB 3.33Å; L282-H285 PolarHBondContact O-N 3.04Å; L282-H285 VanDerWaalsContact O-N 3.14Å; L282-R286 HydrophobicContact CD1-CG 4.22Å; L282-R286 WeakPolarHBondContact O-CG 3.38Å; L282-R286 PolarHBondContact O-N 3.41Å
283	N	86.9	Confident	88	Confident	52 Å²	52	63.7 Å²	63.7	28%	0.278	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-41.5	179.5	-76.9	-19.6	0	0	0	112.7	R279 S280 H285 R286	R279-N283 PolarHBondContact O-N 3.24Å; S280-N283 PolarHBondContact O-N 3.24Å; N283-H285 VanDerWaalsContact C-N 3.34Å; N283-R286 PolarHBondContact O-N 3.41Å
284	E	87.9	Confident	88	Confident	80 Å²	80	65.2 Å²	65.2	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-41.9	172.7	-175.2	-176.4	148.1	0	0	111.4	S280 S281 L282 R287 A306	S280-E284 WeakPolarHBondContact O-CB 3.12Å; S280-E284 PolarHBondContact O-N 3.44Å; S281-E284 PolarHBondContact O-N 2.97Å; L282-E284 PolarHBondContact O-N 3.24Å; E284-R287 WeakPolarHBondContact O-CB 3.2Å; E284-R287 PolarHBondContact O-N 2.95Å; E284-A306 VanDerWaalsContact CD-CB 3.42Å; E284-A306 HydrophobicContact CG-CB 3.93Å; E284-A306 VanDerWaalsContact OE1-CB 3.31Å; E284-A306 WeakPolarHBondContact OE1-CB 3.31Å
285	H	89.8	Confident	88.2	Confident	28 Å²	28	63.1 Å²	63.1	13%	0.13	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-40.3	177.6	169.2	59.1	0	0	0	112.6	C272 F276 S281 L282 N283 R287 S288 H289	C272-H285 PolarHBondContact SG-NE2 3.37Å; F276-H285 HydrophobicContact CE1-CB 3.89Å; F276-H285 HydrophobicContact CE2-CB 3.81Å; F276-H285 AromaticContact CE2-CD2 3.27Å; F276-H285 WeakPolarHBondContact CE2-CD2 3.46Å; F276-H285 AromaticContact CE2-CG 3.62Å; F276-H285 HydrophobicContact CZ-CB 3.34Å; F276-H285 AromaticContact CZ-CD2 3.34Å; F276-H285 WeakPolarHBondContact CZ-CD2 3.41Å; F276-H285 AromaticContact CZ-CG 3.2Å; F276-H285 AromaticContact CZ-ND1 3.87Å; S281-H285 VanDerWaalsContact O-CB 3.3Å; S281-H285 WeakPolarHBondContact O-CB 3.27Å; S281-H285 PolarHBondContact O-N 3.28Å; L282-H285 WeakPolarHBondContact O-CB 3.33Å; L282-H285 PolarHBondContact O-N 3.04Å; L282-H285 VanDerWaalsContact O-N 3.14Å; N283-H285 VanDerWaalsContact C-N 3.34Å; H285-R287 PolarHBondContact O-N 3.35Å; H285-R287 VanDerWaalsContact O-N 3.17Å; H285-S288 PolarHBondContact ND1-OG 3.13Å; H285-S288 WeakPolarHBondContact O-CA 3.48Å; H285-S288 VanDerWaalsContact O-CB 3.23Å; H285-S288 WeakPolarHBondContact O-CB 3.44Å; H285-S288 PolarHBondContact O-N 2.76Å; H285-S288 PolarHBondContact O-OG 3.43Å; H285-H289 AromaticContact CE1-NE2 3.64Å; H285-H289 AromaticContact NE2-NE2 3.34Å; H285-H289 PolarHBondContact NE2-NE2 3.39Å
286	R	85.1	Confident	88.4	Confident	62 Å²	62	67.6 Å²	67.6	23%	0.234	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-31.3	177.2	-75.8	-176.3	62.9	-130.9	-3.9	113.2	R205 E271 L282 N283 S288 H289 T290	R205-R286 VanDerWaalsContact NH1-NH2 3.18Å; E271-R286 IonicContact OE1-NE 3.83Å; L282-R286 HydrophobicContact CD1-CG 4.22Å; L282-R286 WeakPolarHBondContact O-CG 3.38Å; L282-R286 PolarHBondContact O-N 3.41Å; N283-R286 PolarHBondContact O-N 3.41Å; R286-S288 PolarHBondContact O-N 2.87Å; R286-S288 VanDerWaalsContact O-N 3.14Å; R286-H289 WeakPolarHBondContact O-CB 3.27Å; R286-H289 PolarHBondContact O-N 3.18Å; R286-T290 PolarHBondContact O-N 3.46Å
287	R	88.6	Confident	88.6	Confident	64 Å²	64	65.5 Å²	65.5	24%	0.242	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-17.8	173.3	-62.5	178.1	179.9	156.8	2.4	113.4	E284 H285 H289 G291 E292 S305	E284-R287 WeakPolarHBondContact O-CB 3.2Å; E284-R287 PolarHBondContact O-N 2.95Å; H285-R287 PolarHBondContact O-N 3.35Å; H285-R287 VanDerWaalsContact O-N 3.17Å; R287-H289 VanDerWaalsContact C-N 3.33Å; R287-G291 CarbonylContact O-C 3.52Å; R287-G291 VanDerWaalsContact O-CA 3.3Å; R287-G291 WeakPolarHBondContact O-CA 3.36Å; R287-G291 PolarHBondContact O-N 3.43Å; R287-E292 HydrophobicContact CB-CB 4.24Å; R287-E292 HydrophobicContact CG-CB 4.12Å; R287-E292 PolarHBondContact O-N 3.45Å; R287-S305 WeakPolarHBondContact CD-O 3.19Å; R287-S305 PolarHBondContact NH1-O 3.14Å
288	S	86.9	Confident	88.8	Confident	80 Å²	80	74 Å²	74	56%	0.559	37%	0.373	S	S	*	.	H	α-helix	trans	-75.1	-22.4	172.1	73.6	0	0	0	0	113.3	H285 R286	H285-S288 PolarHBondContact ND1-OG 3.13Å; H285-S288 WeakPolarHBondContact O-CA 3.48Å; H285-S288 VanDerWaalsContact O-CB 3.23Å; H285-S288 WeakPolarHBondContact O-CB 3.44Å; H285-S288 PolarHBondContact O-N 2.76Å; H285-S288 PolarHBondContact O-OG 3.43Å; R286-S288 PolarHBondContact O-N 2.87Å; R286-S288 VanDerWaalsContact O-N 3.14Å
289	H	84.8	Confident	89.2	Confident	80 Å²	80	74 Å²	74	37%	0.37	38%	0.378	S	S	.	.	H	α-helix	trans	-83.2	-43.9	172.3	-63.8	-61.4	0	0	0	111.5	E271 C272 H285 R286 R287 G291	E271-H289 WeakPolarHBondContact OE2-CB 3.36Å; E271-H289 IonicContact OE2-CD2 2.79Å; E271-H289 PolarHBondContact OE2-CD2 3.1Å; E271-H289 IonicContact OE2-CG 3.11Å; C272-H289 PolarHBondContact SG-NE2 3.16Å; C272-H289 VanDerWaalsContact SG-NE2 3.37Å; H285-H289 AromaticContact CE1-NE2 3.64Å; H285-H289 AromaticContact NE2-NE2 3.34Å; H285-H289 PolarHBondContact NE2-NE2 3.39Å; R286-H289 WeakPolarHBondContact O-CB 3.27Å; R286-H289 PolarHBondContact O-N 3.18Å; R287-H289 VanDerWaalsContact C-N 3.33Å; H289-G291 VanDerWaalsContact C-N 3.34Å
290	T	83.4	Confident	89.6	Confident	74 Å²	74	74.9 Å²	74.9	45%	0.454	39%	0.39	S	S	.	.	H	α-helix	trans	-80.8	-15.2	-179.6	64.3	0	0	0	0	113.7	R286 E292	R286-T290 PolarHBondContact O-N 3.46Å; T290-E292 PolarHBondContact O-N 3.44Å; T290-E292 WeakPolarHBondContact OG1-CG 3.3Å; T290-E292 PolarHBondContact OG1-N 3.45Å
291	G	85.4	Confident	89.9	Confident	46 Å²	46	73 Å²	73	47%	0.474	38%	0.383	S	S	.	.			trans	73.5	2.5	-174.2	0	0	0	0	0	114.6	R287 H289 K293	R287-G291 CarbonylContact O-C 3.52Å; R287-G291 VanDerWaalsContact O-CA 3.3Å; R287-G291 WeakPolarHBondContact O-CA 3.36Å; R287-G291 PolarHBondContact O-N 3.43Å; H289-G291 VanDerWaalsContact C-N 3.34Å; G291-K293 PolarHBondContact O-N 3.5Å
292	E	86.9	Confident	90.2	Very high	96 Å²	96	77 Å²	77	45%	0.449	40%	0.396	S	S	.	.			trans	-56.9	128.8	-179.4	-79.3	179.9	-167.3	0	0	112.3	R287 T290	R287-E292 HydrophobicContact CB-CB 4.24Å; R287-E292 HydrophobicContact CG-CB 4.12Å; R287-E292 PolarHBondContact O-N 3.45Å; T290-E292 PolarHBondContact O-N 3.44Å; T290-E292 WeakPolarHBondContact OG1-CG 3.3Å; T290-E292 PolarHBondContact OG1-N 3.45Å
293	K	91.6	Very high	90.3	Very high	126 Å²	126	78.3 Å²	78.3	55%	0.548	41%	0.408	S	S	.	.			trans	-130.5	76.4	178.3	-70.1	168.4	-173.6	169.5	0	110.9	G291 Y295 A303 F304	G291-K293 PolarHBondContact O-N 3.5Å; K293-Y295 PolarHBondContact O-N 3.42Å; K293-Y295 VanDerWaalsContact O-N 3.14Å; K293-A303 HydrophobicContact CB-CB 3.55Å; K293-A303 HydrophobicContact CD-CB 4.29Å; K293-F304 CarbonylContact C-O 3.54Å; K293-F304 VanDerWaalsContact C-O 3.25Å; K293-F304 VanDerWaalsContact CA-O 3.31Å; K293-F304 WeakPolarHBondContact CA-O 3.36Å
294	P	90.3	Very high	90.6	Very high	74 Å²	74	77.6 Å²	77.6	48%	0.481	40%	0.402	S	S	.	.			trans	-66.4	-18.3	-172.6	-21.5	34.2	0	0	0	114.4
295	Y	94.1	Very high	90.6	Very high	79 Å²	79	75.9 Å²	75.9	31%	0.31	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	97.6	-172.3	-54.7	-78.3	0	0	0	110.9	K293 A303 F304 S305 A306 S307	K293-Y295 PolarHBondContact O-N 3.42Å; K293-Y295 VanDerWaalsContact O-N 3.14Å; Y295-A303 CarbonylContact O-C 3.52Å; Y295-A303 WeakPolarHBondContact O-CA 2.98Å; Y295-F304 WeakPolarHBondContact CD2-O 3.35Å; Y295-F304 PolarHBondContact N-O 3.29Å; Y295-F304 VanDerWaalsContact N-O 3.07Å; Y295-F304 PolarHBondContact O-N 2.86Å; Y295-S305 WeakPolarHBondContact CE2-O 3.44Å; Y295-A306 VanDerWaalsContact CD2-CA 3.5Å; Y295-S307 VanDerWaalsContact CD2-N 3.33Å; Y295-S307 VanDerWaalsContact CE2-N 3.35Å
296	Q	96	Very high	90.7	Very high	126 Å²	126	74.8 Å²	74.8	59%	0.589	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.3	-179.7	-162.4	177.7	21.4	0	0	112.8	G301 A303	Q296-G301 VanDerWaalsContact CG-O 3.31Å; Q296-G301 WeakPolarHBondContact CG-O 3.26Å; Q296-G301 PolarHBondContact NE2-O 3.43Å; Q296-A303 HydrophobicContact CG-CB 4.46Å
297	C	95.6	Very high	91	Very high	2 Å²	2	74.8 Å²	74.8	1%	0.014	40%	0.404	C	S	.	.			trans	-76.2	119.1	168.9	-170.6	0	0	0	0	110	E299 G301 K302 F304 L310 H317	C297-E299 PolarHBondContact O-N 3.24Å; C297-G301 WeakPolarHBondContact O-CA 3.39Å; C297-G301 PolarHBondContact O-N 3.45Å; C297-K302 VanDerWaalsContact CB-O 3.32Å; C297-K302 WeakPolarHBondContact CB-O 3.44Å; C297-K302 PolarHBondContact N-O 3.27Å; C297-F304 HydrophobicContact CB-CE2 4.46Å; C297-L310 HydrophobicContact CB-CD1 3.63Å; C297-H317 PolarHBondContact SG-NE2 2.76Å; C297-H317 VanDerWaalsContact SG-NE2 3.41Å
298	K	93.8	Very high	91	Very high	211 Å²	211	76.4 Å²	76.4	92%	0.917	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.4	179.2	-64.3	-171.8	177.3	-173	0	113.4
299	E	93.6	Very high	91.3	Very high	106 Å²	106	72.9 Å²	72.9	50%	0.495	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-29.6	-173.4	-63.6	168.9	-140.8	0	0	113	C297 R314 H317	C297-E299 PolarHBondContact O-N 3.24Å; E299-R314 IonicContact OE1-NE 3.15Å; E299-H317 WeakPolarHBondContact OE2-CB 3.25Å; E299-H317 IonicContact OE2-CD2 2.69Å; E299-H317 PolarHBondContact OE2-CD2 3.49Å; E299-H317 IonicContact OE2-CG 3.87Å; E299-H317 IonicContact OE2-ND1 2.87Å
300	C	94.9	Very high	91.7	Very high	63 Å²	63	70.5 Å²	70.5	43%	0.426	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	8.3	179.8	68.5	0	0	0	0	114.9	K302 H313 H317	C300-K302 PolarHBondContact O-N 3.22Å; C300-K302 VanDerWaalsContact SG-CB 3.6Å; C300-H313 PolarHBondContact SG-NE2 3.26Å; C300-H317 PolarHBondContact SG-NE2 3.27Å; C300-H317 VanDerWaalsContact SG-NE2 3.4Å
301	G	92.9	Very high	92.2	Very high	39 Å²	39	71 Å²	71	40%	0.402	39%	0.387	S	S	.	.			trans	69.8	-5.2	179.7	0	0	0	0	0	115.2	Q296 C297 A303	Q296-G301 VanDerWaalsContact CG-O 3.31Å; Q296-G301 WeakPolarHBondContact CG-O 3.26Å; Q296-G301 PolarHBondContact NE2-O 3.43Å; C297-G301 WeakPolarHBondContact O-CA 3.39Å; C297-G301 PolarHBondContact O-N 3.45Å; G301-A303 PolarHBondContact O-N 3.48Å
302	K	94.8	Very high	92.5	Very high	123 Å²	123	75.2 Å²	75.2	54%	0.535	39%	0.389	S	S	.	.			trans	-67.6	126.6	-176.1	-169.4	168.8	-175.3	169.5	0	111.6	C297 C300 F304	C297-K302 VanDerWaalsContact CB-O 3.32Å; C297-K302 WeakPolarHBondContact CB-O 3.44Å; C297-K302 PolarHBondContact N-O 3.27Å; C300-K302 PolarHBondContact O-N 3.22Å; C300-K302 VanDerWaalsContact SG-CB 3.6Å; K302-F304 HydrophobicContact CB-CE2 4.23Å; K302-F304 HydrophobicContact CB-CZ 4.42Å; K302-F304 HydrophobicContact CD-CZ 3.9Å; K302-F304 HydrophobicContact CG-CE2 4.03Å; K302-F304 HydrophobicContact CG-CZ 3.86Å; K302-F304 WeakPolarHBondContact O-CE2 3.3Å
303	A	93.9	Very high	92.9	Very high	34 Å²	34	71.6 Å²	71.6	28%	0.281	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	148.1	-178.1	0	0	0	0	0	113.3	K293 Y295 Q296 G301	K293-A303 HydrophobicContact CB-CB 3.55Å; K293-A303 HydrophobicContact CD-CB 4.29Å; Y295-A303 CarbonylContact O-C 3.52Å; Y295-A303 WeakPolarHBondContact O-CA 2.98Å; Q296-A303 HydrophobicContact CG-CB 4.46Å; G301-A303 PolarHBondContact O-N 3.48Å
304	F	91.8	Very high	92.9	Very high	37 Å²	37	71.5 Å²	71.5	16%	0.162	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.4	-177.7	-59.8	-90.5	0	0	0	110.7	K293 Y295 C297 K302 A306 L310 H313	K293-F304 CarbonylContact C-O 3.54Å; K293-F304 VanDerWaalsContact C-O 3.25Å; K293-F304 VanDerWaalsContact CA-O 3.31Å; K293-F304 WeakPolarHBondContact CA-O 3.36Å; Y295-F304 WeakPolarHBondContact CD2-O 3.35Å; Y295-F304 PolarHBondContact N-O 3.29Å; Y295-F304 VanDerWaalsContact N-O 3.07Å; Y295-F304 PolarHBondContact O-N 2.86Å; C297-F304 HydrophobicContact CB-CE2 4.46Å; K302-F304 HydrophobicContact CB-CE2 4.23Å; K302-F304 HydrophobicContact CB-CZ 4.42Å; K302-F304 HydrophobicContact CD-CZ 3.9Å; K302-F304 HydrophobicContact CG-CE2 4.03Å; K302-F304 HydrophobicContact CG-CZ 3.86Å; K302-F304 WeakPolarHBondContact O-CE2 3.3Å; F304-A306 VanDerWaalsContact C-N 3.25Å; F304-A306 PolarHBondContact O-N 3.35Å; F304-L310 HydrophobicContact CB-CB 4.44Å; F304-L310 HydrophobicContact CD2-CB 3.88Å; F304-L310 HydrophobicContact CD2-CD1 3.96Å; F304-L310 HydrophobicContact CE2-CD1 4.07Å; F304-L310 HydrophobicContact CG-CB 4.32Å; F304-H313 HydrophobicContact CE1-CB 3.88Å; F304-H313 HydrophobicContact CE2-CB 3.76Å; F304-H313 AromaticContact CE2-CD2 3.41Å; F304-H313 VanDerWaalsContact CE2-CD2 3.41Å; F304-H313 WeakPolarHBondContact CE2-CD2 3.5Å; F304-H313 AromaticContact CE2-CG 3.6Å; F304-H313 HydrophobicContact CZ-CB 3.3Å; F304-H313 AromaticContact CZ-CD2 3.47Å; F304-H313 VanDerWaalsContact CZ-CD2 3.47Å; F304-H313 WeakPolarHBondContact CZ-CD2 3.28Å; F304-H313 AromaticContact CZ-CG 3.17Å; F304-H313 AromaticContact CZ-ND1 3.66Å
305	S	89.4	Confident	93.1	Very high	43 Å²	43	70.8 Å²	70.8	30%	0.301	36%	0.356	S	S	.	.	S	Bend	trans	-73.6	-17.2	175	54.6	0	0	0	0	113.1	R287 Y295	R287-S305 WeakPolarHBondContact CD-O 3.19Å; R287-S305 PolarHBondContact NH1-O 3.14Å; Y295-S305 WeakPolarHBondContact CE2-O 3.44Å
306	A	90.1	Very high	93	Very high	6 Å²	6	72.1 Å²	72.1	5%	0.05	37%	0.367	C	S	.	.	S	Bend	trans	-138.1	144	-176.8	0	0	0	0	0	112.9	E284 Y295 F304 N308 G309 L310	E284-A306 VanDerWaalsContact CD-CB 3.42Å; E284-A306 HydrophobicContact CG-CB 3.93Å; E284-A306 VanDerWaalsContact OE1-CB 3.31Å; E284-A306 WeakPolarHBondContact OE1-CB 3.31Å; Y295-A306 VanDerWaalsContact CD2-CA 3.5Å; F304-A306 VanDerWaalsContact C-N 3.25Å; F304-A306 PolarHBondContact O-N 3.35Å; A306-N308 WeakPolarHBondContact CB-OD1 3.49Å; A306-N308 PolarHBondContact O-N 3.17Å; A306-G309 PolarHBondContact O-N 3.42Å; A306-G309 VanDerWaalsContact O-N 3.11Å; A306-L310 PolarHBondContact O-N 2.99Å
307	S	91.8	Very high	92.9	Very high	62 Å²	62	69.4 Å²	69.4	43%	0.434	35%	0.354	S	S	.	.	H	α-helix	trans	-66.5	-34.9	-176.1	60.9	0	0	0	0	113.2	Y295 G309 L310 T311	Y295-S307 VanDerWaalsContact CD2-N 3.33Å; Y295-S307 VanDerWaalsContact CE2-N 3.35Å; S307-G309 VanDerWaalsContact C-N 3.26Å; S307-G309 PolarHBondContact O-N 3.1Å; S307-L310 PolarHBondContact O-N 3.42Å; S307-T311 PolarHBondContact O-N 3.08Å; S307-T311 PolarHBondContact O-OG1 3.03Å
308	N	89.4	Confident	92.7	Very high	97 Å²	97	72.8 Å²	72.8	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-62.8	-34.5	173.5	61.8	-4.2	0	0	0	111.5	A306 T311 R312	A306-N308 WeakPolarHBondContact CB-OD1 3.49Å; A306-N308 PolarHBondContact O-N 3.17Å; N308-T311 PolarHBondContact O-N 3.15Å; N308-R312 WeakPolarHBondContact O-CB 3.08Å; N308-R312 PolarHBondContact O-N 3.39Å
309	G	92.7	Very high	92.5	Very high	7 Å²	7	65 Å²	65	7%	0.072	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-47.1	174.9	0	0	0	0	0	111.3	A306 S307 R312 H313	A306-G309 PolarHBondContact O-N 3.42Å; A306-G309 VanDerWaalsContact O-N 3.11Å; S307-G309 VanDerWaalsContact C-N 3.26Å; S307-G309 PolarHBondContact O-N 3.1Å; G309-R312 PolarHBondContact O-N 3.02Å; G309-H313 VanDerWaalsContact O-CB 3.28Å; G309-H313 WeakPolarHBondContact O-CB 3.4Å; G309-H313 PolarHBondContact O-N 3.3Å
310	L	94.3	Very high	92.5	Very high	30 Å²	30	65.1 Å²	65.1	16%	0.157	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-48.3	173.8	173.9	59.8	0	0	0	111.7	C297 F304 A306 S307 R312 H313 R314	C297-L310 HydrophobicContact CB-CD1 3.63Å; F304-L310 HydrophobicContact CB-CB 4.44Å; F304-L310 HydrophobicContact CD2-CB 3.88Å; F304-L310 HydrophobicContact CD2-CD1 3.96Å; F304-L310 HydrophobicContact CE2-CD1 4.07Å; F304-L310 HydrophobicContact CG-CB 4.32Å; A306-L310 PolarHBondContact O-N 2.99Å; S307-L310 PolarHBondContact O-N 3.42Å; L310-R312 VanDerWaalsContact C-N 3.29Å; L310-R312 PolarHBondContact O-N 3.34Å; L310-H313 WeakPolarHBondContact O-CB 3.43Å; L310-H313 PolarHBondContact O-N 3.5Å; L310-R314 HydrophobicContact CD1-CG 4.24Å; L310-R314 WeakPolarHBondContact O-CG 3.31Å; L310-R314 PolarHBondContact O-N 3.21Å
311	T	92.6	Very high	92.4	Very high	85 Å²	85	68 Å²	68	52%	0.521	36%	0.36	S	S	.	.	H	α-helix	trans	-57.9	-44.5	179.5	-57.9	0	0	0	0	111.4	S307 N308 R314	S307-T311 PolarHBondContact O-N 3.08Å; S307-T311 PolarHBondContact O-OG1 3.03Å; N308-T311 PolarHBondContact O-N 3.15Å; T311-R314 PolarHBondContact O-N 3.2Å
312	R	92.7	Very high	92.4	Very high	134 Å²	134	69.8 Å²	69.8	51%	0.506	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-44	174.5	176.4	172.9	62.1	-171.7	3.2	111.7	N308 G309 L310 R314 R315 L333 L334	N308-R312 WeakPolarHBondContact O-CB 3.08Å; N308-R312 PolarHBondContact O-N 3.39Å; G309-R312 PolarHBondContact O-N 3.02Å; L310-R312 VanDerWaalsContact C-N 3.29Å; L310-R312 PolarHBondContact O-N 3.34Å; R312-R314 VanDerWaalsContact C-N 3.35Å; R312-R314 PolarHBondContact O-N 2.87Å; R312-R315 WeakPolarHBondContact O-CB 3.38Å; R312-R315 PolarHBondContact O-N 3.3Å; R312-L333 HydrophobicContact CG-CD2 4.13Å; R312-L334 HydrophobicContact CG-CD2 3.39Å
313	H	94.3	Very high	92.5	Very high	19 Å²	19	67.7 Å²	67.7	9%	0.088	35%	0.354	C	S	.	.	H	α-helix	trans	-63.5	-38.7	-179.7	169.7	69.1	0	0	0	112.6	C300 F304 G309 L310 R315 I316 H317	C300-H313 PolarHBondContact SG-NE2 3.26Å; F304-H313 HydrophobicContact CE1-CB 3.88Å; F304-H313 HydrophobicContact CE2-CB 3.76Å; F304-H313 AromaticContact CE2-CD2 3.41Å; F304-H313 VanDerWaalsContact CE2-CD2 3.41Å; F304-H313 WeakPolarHBondContact CE2-CD2 3.5Å; F304-H313 AromaticContact CE2-CG 3.6Å; F304-H313 HydrophobicContact CZ-CB 3.3Å; F304-H313 AromaticContact CZ-CD2 3.47Å; F304-H313 VanDerWaalsContact CZ-CD2 3.47Å; F304-H313 WeakPolarHBondContact CZ-CD2 3.28Å; F304-H313 AromaticContact CZ-CG 3.17Å; F304-H313 AromaticContact CZ-ND1 3.66Å; G309-H313 VanDerWaalsContact O-CB 3.28Å; G309-H313 WeakPolarHBondContact O-CB 3.4Å; G309-H313 PolarHBondContact O-N 3.3Å; L310-H313 WeakPolarHBondContact O-CB 3.43Å; L310-H313 PolarHBondContact O-N 3.5Å; H313-R315 PolarHBondContact O-N 3.03Å; H313-R315 VanDerWaalsContact O-N 3.09Å; H313-I316 VanDerWaalsContact O-CB 3.24Å; H313-I316 WeakPolarHBondContact O-CB 3.49Å; H313-I316 WeakPolarHBondContact O-CG1 3.32Å; H313-I316 PolarHBondContact O-N 3.41Å; H313-H317 AromaticContact CE1-NE2 3.89Å; H313-H317 AromaticContact NE2-NE2 3.35Å; H313-H317 PolarHBondContact NE2-NE2 3.31Å
314	R	92.9	Very high	92.7	Very high	124 Å²	124	70.2 Å²	70.2	47%	0.468	36%	0.36	S	S	.	.	H	α-helix	trans	-55.7	-28.5	177.7	-74.9	-173.2	67.4	-132.7	-4.2	113.7	E299 L310 T311 R312 I316 H317 T318	E299-R314 IonicContact OE1-NE 3.15Å; L310-R314 HydrophobicContact CD1-CG 4.24Å; L310-R314 WeakPolarHBondContact O-CG 3.31Å; L310-R314 PolarHBondContact O-N 3.21Å; T311-R314 PolarHBondContact O-N 3.2Å; R312-R314 VanDerWaalsContact C-N 3.35Å; R312-R314 PolarHBondContact O-N 2.87Å; R314-I316 PolarHBondContact O-N 2.71Å; R314-I316 VanDerWaalsContact O-N 3.15Å; R314-H317 WeakPolarHBondContact O-CB 3.49Å; R314-H317 PolarHBondContact O-N 3.49Å; R314-T318 PolarHBondContact O-N 3.36Å
315	R	93.4	Very high	92.9	Very high	60 Å²	60	68.5 Å²	68.5	23%	0.226	35%	0.352	C	S	.	.	H	α-helix	trans	-62.2	-20.4	174.8	-59.2	178.6	-175.9	-170.6	-5.5	113.6	R312 H313 H317 T318 G319 E320 L333	R312-R315 WeakPolarHBondContact O-CB 3.38Å; R312-R315 PolarHBondContact O-N 3.3Å; H313-R315 PolarHBondContact O-N 3.03Å; H313-R315 VanDerWaalsContact O-N 3.09Å; R315-H317 VanDerWaalsContact C-N 3.31Å; R315-T318 WeakPolarHBondContact CA-OG1 3.22Å; R315-G319 WeakPolarHBondContact O-CA 3.48Å; R315-G319 PolarHBondContact O-N 3.24Å; R315-E320 HydrophobicContact CB-CB 4.48Å; R315-E320 PolarHBondContact O-N 3.04Å; R315-L333 HydrophobicContact CB-CD1 3.81Å; R315-L333 HydrophobicContact CB-CD2 3.83Å; R315-L333 HydrophobicContact CB-CG 3.66Å; R315-L333 PolarHBondContact NH1-O 2.97Å
316	I	92.6	Very high	93.2	Very high	106 Å²	106	74.6 Å²	74.6	54%	0.544	37%	0.373	S	S	.	.	H	α-helix	trans	-68.4	-37.6	174.7	-61.2	177	0	0	0	109.8	H313 R314 L333	H313-I316 VanDerWaalsContact O-CB 3.24Å; H313-I316 WeakPolarHBondContact O-CB 3.49Å; H313-I316 WeakPolarHBondContact O-CG1 3.32Å; H313-I316 PolarHBondContact O-N 3.41Å; R314-I316 PolarHBondContact O-N 2.71Å; R314-I316 VanDerWaalsContact O-N 3.15Å; I316-L333 HydrophobicContact CB-CD1 4.4Å; I316-L333 HydrophobicContact CG1-CD1 3.59Å
317	H	92.8	Very high	93.4	Very high	70 Å²	70	79.3 Å²	79.3	32%	0.324	40%	0.402	S	S	.	.	H	α-helix	trans	-77.2	-41.1	179.4	-59.4	-60.5	0	0	0	112.3	C297 E299 C300 H313 R314 R315 G319	C297-H317 PolarHBondContact SG-NE2 2.76Å; C297-H317 VanDerWaalsContact SG-NE2 3.41Å; E299-H317 WeakPolarHBondContact OE2-CB 3.25Å; E299-H317 IonicContact OE2-CD2 2.69Å; E299-H317 PolarHBondContact OE2-CD2 3.49Å; E299-H317 IonicContact OE2-CG 3.87Å; E299-H317 IonicContact OE2-ND1 2.87Å; C300-H317 PolarHBondContact SG-NE2 3.27Å; C300-H317 VanDerWaalsContact SG-NE2 3.4Å; H313-H317 AromaticContact CE1-NE2 3.89Å; H313-H317 AromaticContact NE2-NE2 3.35Å; H313-H317 PolarHBondContact NE2-NE2 3.31Å; R314-H317 WeakPolarHBondContact O-CB 3.49Å; R314-H317 PolarHBondContact O-N 3.49Å; R315-H317 VanDerWaalsContact C-N 3.31Å; H317-G319 VanDerWaalsContact C-N 3.25Å; H317-G319 PolarHBondContact O-N 2.85Å
318	T	91.2	Very high	93.6	Very high	72 Å²	72	79 Å²	79	44%	0.442	40%	0.399	S	S	.	.	H	α-helix	trans	-74.9	-16.8	177.2	64.6	0	0	0	0	113	R314 R315 E320	R314-T318 PolarHBondContact O-N 3.36Å; R315-T318 WeakPolarHBondContact CA-OG1 3.22Å; T318-E320 PolarHBondContact O-N 3.32Å; T318-E320 WeakPolarHBondContact OG1-CB 3.27Å; T318-E320 WeakPolarHBondContact OG1-CG 3.22Å; T318-E320 PolarHBondContact OG1-N 3.22Å
319	G	91.2	Very high	93.9	Very high	47 Å²	47	76.4 Å²	76.4	49%	0.485	40%	0.395	S	S	.	.			trans	71.2	5.4	-173.9	0	0	0	0	0	114.1	R315 H317 K321	R315-G319 WeakPolarHBondContact O-CA 3.48Å; R315-G319 PolarHBondContact O-N 3.24Å; H317-G319 VanDerWaalsContact C-N 3.25Å; H317-G319 PolarHBondContact O-N 2.85Å; G319-K321 PolarHBondContact O-N 3.36Å
320	E	92.3	Very high	94	Very high	110 Å²	110	82.1 Å²	82.1	51%	0.514	42%	0.418	S	S	.	.			trans	-60.1	125.3	179.8	-77.5	177.7	-167.5	0	0	111.6	R315 T318	R315-E320 HydrophobicContact CB-CB 4.48Å; R315-E320 PolarHBondContact O-N 3.04Å; T318-E320 PolarHBondContact O-N 3.32Å; T318-E320 WeakPolarHBondContact OG1-CB 3.27Å; T318-E320 WeakPolarHBondContact OG1-CG 3.22Å; T318-E320 PolarHBondContact OG1-N 3.22Å
321	K	93.8	Very high	94.1	Very high	124 Å²	124	82.7 Å²	82.7	54%	0.539	43%	0.426	S	S	.	.			trans	-126.4	78.4	177.1	-69.5	171.4	-178.9	178.3	0	110.3	G319 Y323 A331 F332	G319-K321 PolarHBondContact O-N 3.36Å; K321-Y323 PolarHBondContact O-N 3.01Å; K321-Y323 VanDerWaalsContact O-N 3.1Å; K321-A331 HydrophobicContact CB-CB 3.64Å; K321-A331 HydrophobicContact CD-CB 4.27Å; K321-F332 CarbonylContact C-O 3.51Å; K321-F332 VanDerWaalsContact C-O 3.3Å; K321-F332 WeakPolarHBondContact CA-O 3.3Å
322	P	93.3	Very high	94.2	Very high	76 Å²	76	80.6 Å²	80.6	49%	0.494	41%	0.41	S	S	.	.			trans	-66.9	-15.1	-171.7	-21.8	34.5	0	0	0	114.5
323	Y	96.3	Very high	94.2	Very high	79 Å²	79	76 Å²	76	31%	0.31	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	97.8	-169.9	-55.5	-74.9	0	0	0	110.9	K321 A331 F332 L333 S335	K321-Y323 PolarHBondContact O-N 3.01Å; K321-Y323 VanDerWaalsContact O-N 3.1Å; Y323-A331 CarbonylContact O-C 3.52Å; Y323-A331 WeakPolarHBondContact O-CA 3.47Å; Y323-F332 PolarHBondContact N-O 3.13Å; Y323-F332 PolarHBondContact O-N 3.42Å; Y323-L333 WeakPolarHBondContact CD2-O 3.48Å; Y323-L333 WeakPolarHBondContact CE2-O 3.25Å; Y323-S335 VanDerWaalsContact CE2-N 3.3Å
324	E	97.1	Very high	94.1	Very high	87 Å²	87	77.1 Å²	77.1	41%	0.407	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.1	-177.2	-167.5	-161.9	-179.1	0	0	112.6	K326	E324-K326 PolarHBondContact O-N 3.3Å; E324-K326 IonicContact OE2-NZ 2.8Å; E324-K326 PolarHBondContact OE2-NZ 3.09Å
325	C	96.8	Very high	94.1	Very high	0 Å²	0	74 Å²	74	0%	0	40%	0.399	C	S	.	.			trans	-76.6	113.2	170.5	-174.8	0	0	0	0	110.6	V327 C328 G329 K330 F332 L338 H345	C325-V327 PolarHBondContact O-N 3.38Å; C325-V327 VanDerWaalsContact O-N 3.17Å; C325-C328 PolarHBondContact O-N 2.91Å; C325-G329 VanDerWaalsContact O-CA 3.28Å; C325-G329 WeakPolarHBondContact O-CA 3.34Å; C325-G329 PolarHBondContact O-N 3.29Å; C325-K330 WeakPolarHBondContact CB-O 3.49Å; C325-K330 PolarHBondContact N-O 3.08Å; C325-F332 HydrophobicContact CB-CE2 4.31Å; C325-L338 VanDerWaalsContact CA-CD1 3.5Å; C325-L338 HydrophobicContact CB-CD1 3.59Å; C325-H345 PolarHBondContact SG-NE2 2.95Å
326	K	95.6	Very high	94.1	Very high	171 Å²	171	74.7 Å²	74.7	74%	0.743	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.6	178.9	-58.9	-56.4	179.1	-170.9	0	114.7	E324	E324-K326 PolarHBondContact O-N 3.3Å; E324-K326 IonicContact OE2-NZ 2.8Å; E324-K326 PolarHBondContact OE2-NZ 3.09Å
327	V	95.4	Very high	94.1	Very high	106 Å²	106	71.9 Å²	71.9	64%	0.642	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-36.8	178.7	-177.3	0	0	0	0	112.2	C325 H345	C325-V327 PolarHBondContact O-N 3.38Å; C325-V327 VanDerWaalsContact O-N 3.17Å; V327-H345 HydrophobicContact CG1-CB 4.34Å
328	C	95.6	Very high	94.2	Very high	55 Å²	55	69.5 Å²	69.5	37%	0.372	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	7.7	-174.8	70.3	0	0	0	0	115.2	C325 K330 H341 H345	C325-C328 PolarHBondContact O-N 2.91Å; C328-K330 PolarHBondContact O-N 3.4Å; C328-H341 PolarHBondContact SG-NE2 3.24Å; C328-H345 PolarHBondContact SG-NE2 3.47Å
329	G	94.5	Very high	94.3	Very high	42 Å²	42	69.7 Å²	69.7	43%	0.433	39%	0.393	S	S	.	.			trans	69.2	-1	179.7	0	0	0	0	0	115.2	C325 A331	C325-G329 VanDerWaalsContact O-CA 3.28Å; C325-G329 WeakPolarHBondContact O-CA 3.34Å; C325-G329 PolarHBondContact O-N 3.29Å; G329-A331 PolarHBondContact O-N 3.47Å
330	K	95.9	Very high	94.4	Very high	128 Å²	128	71 Å²	71	56%	0.557	39%	0.386	S	S	*	.			trans	-68.8	125	-179.3	-73.1	-177.6	179.6	177.3	0	111	C325 C328 F332	C325-K330 WeakPolarHBondContact CB-O 3.49Å; C325-K330 PolarHBondContact N-O 3.08Å; C328-K330 PolarHBondContact O-N 3.4Å; K330-F332 HydrophobicContact CB-CE2 3.99Å; K330-F332 HydrophobicContact CB-CZ 4.05Å; K330-F332 WeakPolarHBondContact O-CD2 3.44Å; K330-F332 VanDerWaalsContact O-CE2 3.25Å; K330-F332 WeakPolarHBondContact O-CE2 3.25Å
331	A	95.4	Very high	94.5	Very high	41 Å²	41	66.7 Å²	66.7	34%	0.339	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	144.3	178.1	0	0	0	0	0	112.8	K321 Y323 G329	K321-A331 HydrophobicContact CB-CB 3.64Å; K321-A331 HydrophobicContact CD-CB 4.27Å; Y323-A331 CarbonylContact O-C 3.52Å; Y323-A331 WeakPolarHBondContact O-CA 3.47Å; G329-A331 PolarHBondContact O-N 3.47Å
332	F	94.4	Very high	94.5	Very high	42 Å²	42	64.5 Å²	64.5	18%	0.184	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.9	-177.2	-59	-87.2	0	0	0	111.1	K321 Y323 C325 K330 L334 C337 L338 H341	K321-F332 CarbonylContact C-O 3.51Å; K321-F332 VanDerWaalsContact C-O 3.3Å; K321-F332 WeakPolarHBondContact CA-O 3.3Å; Y323-F332 PolarHBondContact N-O 3.13Å; Y323-F332 PolarHBondContact O-N 3.42Å; C325-F332 HydrophobicContact CB-CE2 4.31Å; K330-F332 HydrophobicContact CB-CE2 3.99Å; K330-F332 HydrophobicContact CB-CZ 4.05Å; K330-F332 WeakPolarHBondContact O-CD2 3.44Å; K330-F332 VanDerWaalsContact O-CE2 3.25Å; K330-F332 WeakPolarHBondContact O-CE2 3.25Å; F332-L334 VanDerWaalsContact C-N 3.33Å; F332-C337 HydrophobicContact CB-CB 4.07Å; F332-C337 HydrophobicContact CD1-CB 3.86Å; F332-C337 HydrophobicContact CG-CB 4.18Å; F332-L338 HydrophobicContact CB-CB 4.39Å; F332-L338 HydrophobicContact CD2-CB 3.84Å; F332-L338 HydrophobicContact CD2-CD1 3.83Å; F332-L338 HydrophobicContact CD2-CG 4.45Å; F332-L338 HydrophobicContact CE2-CD1 3.95Å; F332-L338 HydrophobicContact CG-CB 4.31Å; F332-H341 HydrophobicContact CE1-CB 3.94Å; F332-H341 HydrophobicContact CE2-CB 3.84Å; F332-H341 AromaticContact CE2-CD2 3.44Å; F332-H341 VanDerWaalsContact CE2-CD2 3.44Å; F332-H341 WeakPolarHBondContact CE2-CD2 3.38Å; F332-H341 AromaticContact CE2-CG 3.63Å; F332-H341 HydrophobicContact CZ-CB 3.4Å; F332-H341 VanDerWaalsContact CZ-CB 3.4Å; F332-H341 AromaticContact CZ-CD2 3.46Å; F332-H341 VanDerWaalsContact CZ-CD2 3.46Å; F332-H341 WeakPolarHBondContact CZ-CD2 3.1Å; F332-H341 AromaticContact CZ-CG 3.18Å; F332-H341 AromaticContact CZ-ND1 3.64Å
333	L	93.1	Very high	94.5	Very high	38 Å²	38	62.7 Å²	62.7	20%	0.199	34%	0.341	C	S	.	.	S	Bend	trans	-73.3	-29.4	178.2	-164.9	153.7	0	0	0	111.7	R312 R315 I316 Y323	R312-L333 HydrophobicContact CG-CD2 4.13Å; R315-L333 HydrophobicContact CB-CD1 3.81Å; R315-L333 HydrophobicContact CB-CD2 3.83Å; R315-L333 HydrophobicContact CB-CG 3.66Å; R315-L333 PolarHBondContact NH1-O 2.97Å; I316-L333 HydrophobicContact CB-CD1 4.4Å; I316-L333 HydrophobicContact CG1-CD1 3.59Å; Y323-L333 WeakPolarHBondContact CD2-O 3.48Å; Y323-L333 WeakPolarHBondContact CE2-O 3.25Å
334	L	92.4	Very high	94.4	Very high	41 Å²	41	63.7 Å²	63.7	22%	0.215	35%	0.351	C	S	.	.	S	Bend	trans	-124.2	142.8	-178.2	-51.2	-178.6	0	0	0	112.5	R312 F332 S336 C337 L338	R312-L334 HydrophobicContact CG-CD2 3.39Å; F332-L334 VanDerWaalsContact C-N 3.33Å; L334-S336 VanDerWaalsContact C-N 3.3Å; L334-S336 PolarHBondContact O-N 3.4Å; L334-C337 HydrophobicContact CB-CB 4.36Å; L334-C337 WeakPolarHBondContact O-CB 3.38Å; L334-C337 PolarHBondContact O-N 3.11Å; L334-L338 PolarHBondContact O-N 3.12Å
335	S	94	Very high	94.2	Very high	60 Å²	60	63.3 Å²	63.3	42%	0.42	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-37.4	174.6	56.4	0	0	0	0	112.2	Y323 C337 L338 V339	Y323-S335 VanDerWaalsContact CE2-N 3.3Å; S335-C337 VanDerWaalsContact C-N 3.3Å; S335-C337 PolarHBondContact O-N 3.39Å; S335-L338 WeakPolarHBondContact O-CB 3.09Å; S335-L338 PolarHBondContact O-N 3.14Å; S335-L338 VanDerWaalsContact O-N 3.13Å; S335-V339 WeakPolarHBondContact O-CG2 3.24Å; S335-V339 PolarHBondContact O-N 2.97Å
336	S	91.5	Very high	93.9	Very high	74 Å²	74	68 Å²	68	52%	0.517	38%	0.378	S	S	.	.	H	α-helix	trans	-61.5	-37.4	176.8	55.3	0	0	0	0	112.6	L334 Q340	L334-S336 VanDerWaalsContact C-N 3.3Å; L334-S336 PolarHBondContact O-N 3.4Å; S336-Q340 VanDerWaalsContact O-CB 3.32Å; S336-Q340 WeakPolarHBondContact O-CB 2.88Å; S336-Q340 PolarHBondContact O-N 2.94Å
337	C	93.6	Very high	93.6	Very high	46 Å²	46	62 Å²	62	31%	0.311	36%	0.363	S	S	.	.	H	α-helix	trans	-66.7	-40.4	174.1	-64.9	0	0	0	0	111.4	F332 L334 S335 Q340 H341	F332-C337 HydrophobicContact CB-CB 4.07Å; F332-C337 HydrophobicContact CD1-CB 3.86Å; F332-C337 HydrophobicContact CG-CB 4.18Å; L334-C337 HydrophobicContact CB-CB 4.36Å; L334-C337 WeakPolarHBondContact O-CB 3.38Å; L334-C337 PolarHBondContact O-N 3.11Å; S335-C337 VanDerWaalsContact C-N 3.3Å; S335-C337 PolarHBondContact O-N 3.39Å; C337-Q340 PolarHBondContact O-N 3.24Å; C337-H341 VanDerWaalsContact O-CB 3.24Å; C337-H341 WeakPolarHBondContact O-CB 2.86Å; C337-H341 PolarHBondContact O-N 3Å
338	L	95.6	Very high	93.4	Very high	21 Å²	21	60.7 Å²	60.7	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-49.5	174.2	171.7	60.8	0	0	0	111.5	C325 F332 L334 S335 Q340 H341 Q342	C325-L338 VanDerWaalsContact CA-CD1 3.5Å; C325-L338 HydrophobicContact CB-CD1 3.59Å; F332-L338 HydrophobicContact CB-CB 4.39Å; F332-L338 HydrophobicContact CD2-CB 3.84Å; F332-L338 HydrophobicContact CD2-CD1 3.83Å; F332-L338 HydrophobicContact CD2-CG 4.45Å; F332-L338 HydrophobicContact CE2-CD1 3.95Å; F332-L338 HydrophobicContact CG-CB 4.31Å; L334-L338 PolarHBondContact O-N 3.12Å; S335-L338 WeakPolarHBondContact O-CB 3.09Å; S335-L338 PolarHBondContact O-N 3.14Å; S335-L338 VanDerWaalsContact O-N 3.13Å; L338-Q340 VanDerWaalsContact C-N 3.3Å; L338-Q340 PolarHBondContact O-N 2.98Å; L338-H341 CarbonylContact O-C 3.54Å; L338-H341 WeakPolarHBondContact O-CB 3.48Å; L338-H341 PolarHBondContact O-N 3.27Å; L338-H341 VanDerWaalsContact O-N 3.1Å; L338-Q342 HydrophobicContact CD1-CG 4.09Å; L338-Q342 HydrophobicContact CG-CG 4.48Å; L338-Q342 WeakPolarHBondContact O-CG 3.33Å; L338-Q342 PolarHBondContact O-N 2.88Å
339	V	93.4	Very high	93.2	Very high	75 Å²	75	63.9 Å²	63.9	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-42.6	178.5	171.9	0	0	0	0	111	S335 H341 Q342	S335-V339 WeakPolarHBondContact O-CG2 3.24Å; S335-V339 PolarHBondContact O-N 2.97Å; V339-H341 VanDerWaalsContact C-N 3.34Å; V339-Q342 PolarHBondContact O-N 3.28Å
340	Q	92.7	Very high	93.1	Very high	74 Å²	74	68.5 Å²	68.5	35%	0.346	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-41.4	175.2	-176.4	-178.2	46.9	0	0	111.8	S336 C337 L338 R343 Q362	S336-Q340 VanDerWaalsContact O-CB 3.32Å; S336-Q340 WeakPolarHBondContact O-CB 2.88Å; S336-Q340 PolarHBondContact O-N 2.94Å; C337-Q340 PolarHBondContact O-N 3.24Å; L338-Q340 VanDerWaalsContact C-N 3.3Å; L338-Q340 PolarHBondContact O-N 2.98Å; Q340-R343 WeakPolarHBondContact O-CB 3.46Å; Q340-R343 PolarHBondContact O-N 3.48Å; Q340-Q362 VanDerWaalsContact CD-NE2 3.32Å; Q340-Q362 HydrophobicContact CG-CG 4.29Å
341	H	94.2	Very high	93	Very high	21 Å²	21	66 Å²	66	10%	0.097	35%	0.35	C	S	.	.	H	α-helix	trans	-65.8	-39.7	177.7	168.2	73	0	0	0	112.5	C328 F332 C337 L338 V339 R343 I344 H345	C328-H341 PolarHBondContact SG-NE2 3.24Å; F332-H341 HydrophobicContact CE1-CB 3.94Å; F332-H341 HydrophobicContact CE2-CB 3.84Å; F332-H341 AromaticContact CE2-CD2 3.44Å; F332-H341 VanDerWaalsContact CE2-CD2 3.44Å; F332-H341 WeakPolarHBondContact CE2-CD2 3.38Å; F332-H341 AromaticContact CE2-CG 3.63Å; F332-H341 HydrophobicContact CZ-CB 3.4Å; F332-H341 VanDerWaalsContact CZ-CB 3.4Å; F332-H341 AromaticContact CZ-CD2 3.46Å; F332-H341 VanDerWaalsContact CZ-CD2 3.46Å; F332-H341 WeakPolarHBondContact CZ-CD2 3.1Å; F332-H341 AromaticContact CZ-CG 3.18Å; F332-H341 AromaticContact CZ-ND1 3.64Å; C337-H341 VanDerWaalsContact O-CB 3.24Å; C337-H341 WeakPolarHBondContact O-CB 2.86Å; C337-H341 PolarHBondContact O-N 3Å; L338-H341 CarbonylContact O-C 3.54Å; L338-H341 WeakPolarHBondContact O-CB 3.48Å; L338-H341 PolarHBondContact O-N 3.27Å; L338-H341 VanDerWaalsContact O-N 3.1Å; V339-H341 VanDerWaalsContact C-N 3.34Å; H341-R343 PolarHBondContact O-N 2.63Å; H341-R343 VanDerWaalsContact O-N 3.11Å; H341-I344 VanDerWaalsContact O-CB 3.23Å; H341-I344 WeakPolarHBondContact O-CB 3.34Å; H341-I344 WeakPolarHBondContact O-CG1 3.47Å; H341-I344 PolarHBondContact O-N 2.69Å; H341-H345 AromaticContact CE1-NE2 3.82Å; H341-H345 AromaticContact NE2-CD2 3.97Å; H341-H345 AromaticContact NE2-NE2 3.25Å; H341-H345 PolarHBondContact NE2-NE2 3.37Å
342	Q	94.2	Very high	93	Very high	77 Å²	77	70 Å²	70	36%	0.36	36%	0.362	S	S	.	.	H	α-helix	trans	-57.1	-28.3	178.1	-77.2	173.9	-33.1	0	0	112.8	L338 V339 I344 H345 T346	L338-Q342 HydrophobicContact CD1-CG 4.09Å; L338-Q342 HydrophobicContact CG-CG 4.48Å; L338-Q342 WeakPolarHBondContact O-CG 3.33Å; L338-Q342 PolarHBondContact O-N 2.88Å; V339-Q342 PolarHBondContact O-N 3.28Å; Q342-I344 PolarHBondContact O-N 2.7Å; Q342-I344 VanDerWaalsContact O-N 3.17Å; Q342-H345 WeakPolarHBondContact O-CB 3.45Å; Q342-H345 PolarHBondContact O-N 3.24Å; Q342-T346 PolarHBondContact O-N 3.01Å; Q342-T346 VanDerWaalsContact O-N 3.16Å
343	R	93.9	Very high	93	Very high	38 Å²	38	68 Å²	68	14%	0.143	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-20.9	174.6	-60.9	-178.5	-174.5	170.6	2.6	114	Q340 H341 H345 T346 G347 E348 I361	Q340-R343 WeakPolarHBondContact O-CB 3.46Å; Q340-R343 PolarHBondContact O-N 3.48Å; H341-R343 PolarHBondContact O-N 2.63Å; H341-R343 VanDerWaalsContact O-N 3.11Å; R343-H345 VanDerWaalsContact C-N 3.32Å; R343-T346 WeakPolarHBondContact CA-OG1 3.47Å; R343-T346 PolarHBondContact O-OG1 3.09Å; R343-G347 WeakPolarHBondContact O-CA 3.48Å; R343-G347 PolarHBondContact O-N 3.44Å; R343-E348 PolarHBondContact O-N 3.15Å; R343-I361 HydrophobicContact CB-CG2 3.58Å
344	I	92.6	Very high	93	Very high	100 Å²	100	78.1 Å²	78.1	51%	0.513	39%	0.389	S	S	.	.	H	α-helix	trans	-68.4	-37	173.3	-58.4	173.2	0	0	0	110.1	H341 Q342 I361	H341-I344 VanDerWaalsContact O-CB 3.23Å; H341-I344 WeakPolarHBondContact O-CB 3.34Å; H341-I344 WeakPolarHBondContact O-CG1 3.47Å; H341-I344 PolarHBondContact O-N 2.69Å; Q342-I344 PolarHBondContact O-N 2.7Å; Q342-I344 VanDerWaalsContact O-N 3.17Å; I344-I361 HydrophobicContact CG1-CD1 4.1Å
345	H	92.8	Very high	93	Very high	80 Å²	80	82.1 Å²	82.1	37%	0.37	41%	0.406	S	S	.	.	H	α-helix	trans	-75.7	-39	178.2	-62.4	-57.4	0	0	0	112.2	C325 V327 C328 H341 Q342 R343 G347	C325-H345 PolarHBondContact SG-NE2 2.95Å; V327-H345 HydrophobicContact CG1-CB 4.34Å; C328-H345 PolarHBondContact SG-NE2 3.47Å; H341-H345 AromaticContact CE1-NE2 3.82Å; H341-H345 AromaticContact NE2-CD2 3.97Å; H341-H345 AromaticContact NE2-NE2 3.25Å; H341-H345 PolarHBondContact NE2-NE2 3.37Å; Q342-H345 WeakPolarHBondContact O-CB 3.45Å; Q342-H345 PolarHBondContact O-N 3.24Å; R343-H345 VanDerWaalsContact C-N 3.32Å; H345-G347 VanDerWaalsContact C-N 3.3Å
346	T	91.8	Very high	93	Very high	99 Å²	99	81.9 Å²	81.9	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-79.3	-15.5	178.6	64.3	0	0	0	0	113	Q342 R343 E348	Q342-T346 PolarHBondContact O-N 3.01Å; Q342-T346 VanDerWaalsContact O-N 3.16Å; R343-T346 WeakPolarHBondContact CA-OG1 3.47Å; R343-T346 PolarHBondContact O-OG1 3.09Å; T346-E348 PolarHBondContact O-N 3.29Å; T346-E348 WeakPolarHBondContact OG1-CB 3.48Å; T346-E348 PolarHBondContact OG1-N 2.84Å
347	G	89.6	Confident	93	Very high	43 Å²	43	80.1 Å²	80.1	44%	0.443	40%	0.398	S	S	.	.			trans	68.8	10.3	-172.9	0	0	0	0	0	113.9	R343 H345 K349	R343-G347 WeakPolarHBondContact O-CA 3.48Å; R343-G347 PolarHBondContact O-N 3.44Å; H345-G347 VanDerWaalsContact C-N 3.3Å; G347-K349 PolarHBondContact O-N 2.91Å; G347-K349 VanDerWaalsContact O-N 3.13Å
348	E	91.3	Very high	93	Very high	79 Å²	79	84 Å²	84	37%	0.369	41%	0.409	S	S	.	.			trans	-66.4	111.7	-175.4	-168.6	-169.3	179.2	0	0	111.3	R343 T346 R350	R343-E348 PolarHBondContact O-N 3.15Å; T346-E348 PolarHBondContact O-N 3.29Å; T346-E348 WeakPolarHBondContact OG1-CB 3.48Å; T346-E348 PolarHBondContact OG1-N 2.84Å; E348-R350 VanDerWaalsContact CD-NH2 3.3Å; E348-R350 HydrophobicContact CG-CG 4.17Å; E348-R350 IonicContact OE1-CZ 3.47Å; E348-R350 IonicContact OE1-NE 3.87Å; E348-R350 PolarHBondContact OE1-NE 3.34Å; E348-R350 IonicContact OE1-NH2 2.67Å; E348-R350 PolarHBondContact OE1-NH2 2.98Å; E348-R350 IonicContact OE2-CZ 3.37Å; E348-R350 IonicContact OE2-NE 3.4Å; E348-R350 PolarHBondContact OE2-NE 3.33Å; E348-R350 IonicContact OE2-NH2 3.31Å; E348-R350 PolarHBondContact OE2-NH2 3.32Å
349	K	91.3	Very high	93	Very high	123 Å²	123	84.5 Å²	84.5	54%	0.535	42%	0.417	S	S	.	.			trans	-112	93.6	-178.7	-71.2	165.5	172.9	-173.8	0	110.7	G347 A359 F360 I361	G347-K349 PolarHBondContact O-N 2.91Å; G347-K349 VanDerWaalsContact O-N 3.13Å; K349-A359 HydrophobicContact CB-CB 3.63Å; K349-A359 HydrophobicContact CD-CB 4.13Å; K349-A359 WeakPolarHBondContact CD-O 3.26Å; K349-A359 HydrophobicContact CG-CB 4.44Å; K349-F360 CarbonylContact C-O 3.57Å; K349-F360 WeakPolarHBondContact CA-O 3.48Å; K349-I361 HydrophobicContact CG-CG1 3.88Å
350	R	91.1	Very high	92.9	Very high	139 Å²	139	83.3 Å²	83.3	53%	0.525	41%	0.405	S	S	.	.			trans	-80.3	-17.4	-175.4	-60.3	-173.6	-173.9	-167.9	-1.4	114.5	E348 F360	E348-R350 VanDerWaalsContact CD-NH2 3.3Å; E348-R350 HydrophobicContact CG-CG 4.17Å; E348-R350 IonicContact OE1-CZ 3.47Å; E348-R350 IonicContact OE1-NE 3.87Å; E348-R350 PolarHBondContact OE1-NE 3.34Å; E348-R350 IonicContact OE1-NH2 2.67Å; E348-R350 PolarHBondContact OE1-NH2 2.98Å; E348-R350 IonicContact OE2-CZ 3.37Å; E348-R350 IonicContact OE2-NE 3.4Å; E348-R350 PolarHBondContact OE2-NE 3.33Å; E348-R350 IonicContact OE2-NH2 3.31Å; E348-R350 PolarHBondContact OE2-NH2 3.32Å; R350-F360 PolarHBondContact N-O 3.38Å
351	Y	93.4	Very high	92.8	Very high	75 Å²	75	81.7 Å²	81.7	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	101.9	-170.7	-57	-79.1	0	0	0	109.9	A359 F360 I361 N363	Y351-A359 CarbonylContact O-C 3.57Å; Y351-A359 WeakPolarHBondContact O-CA 3.46Å; Y351-F360 PolarHBondContact N-O 3.39Å; Y351-F360 VanDerWaalsContact N-O 3.1Å; Y351-F360 PolarHBondContact O-N 3.5Å; Y351-I361 WeakPolarHBondContact CD2-O 3.37Å; Y351-I361 WeakPolarHBondContact CE2-O 3.26Å; Y351-N363 HydrophobicContact CD1-CB 3.81Å; Y351-N363 VanDerWaalsContact CD2-N 3.32Å; Y351-N363 HydrophobicContact CE1-CB 3.65Å; Y351-N363 HydrophobicContact CE2-CB 4.35Å; Y351-N363 HydrophobicContact CG-CB 4.24Å
352	Q	95.4	Very high	92.6	Very high	125 Å²	125	84.6 Å²	84.6	58%	0.584	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.5	-177.7	-166.8	177.2	26.4	0	0	111.8	G357 A359	Q352-G357 WeakPolarHBondContact CG-O 3.49Å; Q352-G357 PolarHBondContact NE2-O 3.13Å; Q352-G357 VanDerWaalsContact NE2-O 3.09Å; Q352-A359 HydrophobicContact CG-CB 4.46Å
353	C	94.8	Very high	92.5	Very high	1 Å²	1	84.1 Å²	84.1	1%	0.007	41%	0.412	C	S	.	.			trans	-73	122.9	167.8	-177	0	0	0	0	109.4	E355 G357 K358 F360 L366 H369	C353-E355 VanDerWaalsContact C-N 3.29Å; C353-E355 PolarHBondContact O-N 3.48Å; C353-G357 WeakPolarHBondContact O-CA 3.47Å; C353-G357 PolarHBondContact O-N 2.8Å; C353-K358 WeakPolarHBondContact CB-O 3.29Å; C353-K358 PolarHBondContact N-O 3.28Å; C353-F360 HydrophobicContact CB-CE2 4.5Å; C353-L366 HydrophobicContact CB-CD1 3.73Å; C353-H369 PolarHBondContact SG-NE2 3.41Å
354	R	93.8	Very high	92.4	Very high	250 Å²	250	85.7 Å²	85.7	94%	0.943	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-26.2	179.2	-66.6	-173.9	178	-172.8	-0.7	112.7
355	E	92.3	Very high	92.3	Very high	125 Å²	125	82 Å²	82	58%	0.584	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-39.7	-176.3	-63.8	-179.7	-141	0	0	113.3	C353 H373	C353-E355 VanDerWaalsContact C-N 3.29Å; C353-E355 PolarHBondContact O-N 3.48Å; E355-H373 WeakPolarHBondContact OE2-CB 3.18Å; E355-H373 IonicContact OE2-CD2 3.4Å; E355-H373 IonicContact OE2-CE1 3.6Å; E355-H373 IonicContact OE2-CG 3.12Å; E355-H373 IonicContact OE2-ND1 2.91Å; E355-H373 PolarHBondContact OE2-ND1 2.71Å; E355-H373 VanDerWaalsContact OE2-ND1 3.15Å
356	C	93.9	Very high	92.4	Very high	54 Å²	54	79.2 Å²	79.2	37%	0.365	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	7.7	-178	70.6	0	0	0	0	114.9	K358 H369 H373	C356-K358 PolarHBondContact O-N 3.36Å; C356-H369 VanDerWaalsContact SG-CE1 3.56Å; C356-H369 PolarHBondContact SG-NE2 2.87Å; C356-H373 PolarHBondContact SG-NE2 2.83Å; C356-H373 VanDerWaalsContact SG-NE2 3.38Å
357	G	92.3	Very high	92.4	Very high	38 Å²	38	80.4 Å²	80.4	39%	0.392	41%	0.405	S	S	.	.			trans	70.5	-4	176.9	0	0	0	0	0	115.5	Q352 C353 A359	Q352-G357 WeakPolarHBondContact CG-O 3.49Å; Q352-G357 PolarHBondContact NE2-O 3.13Å; Q352-G357 VanDerWaalsContact NE2-O 3.09Å; C353-G357 WeakPolarHBondContact O-CA 3.47Å; C353-G357 PolarHBondContact O-N 2.8Å; G357-A359 PolarHBondContact O-N 2.99Å
358	K	93.6	Very high	92.5	Very high	127 Å²	127	81.8 Å²	81.8	55%	0.552	40%	0.4	S	S	*	.			trans	-63.9	130.7	-179.8	-73.4	-179.6	-176.8	172.8	0	111.2	C353 C356 F360	C353-K358 WeakPolarHBondContact CB-O 3.29Å; C353-K358 PolarHBondContact N-O 3.28Å; C356-K358 PolarHBondContact O-N 3.36Å; K358-F360 HydrophobicContact CB-CE2 3.98Å; K358-F360 HydrophobicContact CB-CZ 4.11Å; K358-F360 WeakPolarHBondContact O-CE2 3.5Å
359	A	94	Very high	92.5	Very high	32 Å²	32	79 Å²	79	26%	0.264	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.1	-178.4	0	0	0	0	0	112.9	K349 Y351 Q352 G357	K349-A359 HydrophobicContact CB-CB 3.63Å; K349-A359 HydrophobicContact CD-CB 4.13Å; K349-A359 WeakPolarHBondContact CD-O 3.26Å; K349-A359 HydrophobicContact CG-CB 4.44Å; Y351-A359 CarbonylContact O-C 3.57Å; Y351-A359 WeakPolarHBondContact O-CA 3.46Å; Q352-A359 HydrophobicContact CG-CB 4.46Å; G357-A359 PolarHBondContact O-N 2.99Å
360	F	92.6	Very high	92.6	Very high	49 Å²	49	75.6 Å²	75.6	22%	0.215	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.4	-174.6	-57.8	-90.5	0	0	0	110.9	K349 R350 Y351 C353 K358 Q362 L366 H369	K349-F360 CarbonylContact C-O 3.57Å; K349-F360 WeakPolarHBondContact CA-O 3.48Å; R350-F360 PolarHBondContact N-O 3.38Å; Y351-F360 PolarHBondContact N-O 3.39Å; Y351-F360 VanDerWaalsContact N-O 3.1Å; Y351-F360 PolarHBondContact O-N 3.5Å; C353-F360 HydrophobicContact CB-CE2 4.5Å; K358-F360 HydrophobicContact CB-CE2 3.98Å; K358-F360 HydrophobicContact CB-CZ 4.11Å; K358-F360 WeakPolarHBondContact O-CE2 3.5Å; F360-Q362 VanDerWaalsContact C-N 3.34Å; F360-L366 HydrophobicContact CB-CB 4.47Å; F360-L366 HydrophobicContact CD2-CB 3.92Å; F360-L366 HydrophobicContact CD2-CD1 3.95Å; F360-L366 HydrophobicContact CE2-CD1 4.05Å; F360-L366 HydrophobicContact CG-CB 4.36Å; F360-H369 HydrophobicContact CE1-CB 3.86Å; F360-H369 HydrophobicContact CE2-CB 3.81Å; F360-H369 AromaticContact CE2-CD2 3.39Å; F360-H369 WeakPolarHBondContact CE2-CD2 3.24Å; F360-H369 AromaticContact CE2-CG 3.68Å; F360-H369 HydrophobicContact CZ-CB 3.29Å; F360-H369 AromaticContact CZ-CD2 3.44Å; F360-H369 VanDerWaalsContact CZ-CD2 3.44Å; F360-H369 WeakPolarHBondContact CZ-CD2 3.37Å; F360-H369 AromaticContact CZ-CG 3.24Å; F360-H369 AromaticContact CZ-ND1 3.96Å
361	I	90.3	Very high	92.6	Very high	40 Å²	40	71.6 Å²	71.6	21%	0.205	36%	0.359	C	S	.	.	S	Bend	trans	-73.3	-29.7	177.4	-62.6	174.9	0	0	0	111.3	R343 I344 K349 Y351	R343-I361 HydrophobicContact CB-CG2 3.58Å; I344-I361 HydrophobicContact CG1-CD1 4.1Å; K349-I361 HydrophobicContact CG-CG1 3.88Å; Y351-I361 WeakPolarHBondContact CD2-O 3.37Å; Y351-I361 WeakPolarHBondContact CE2-O 3.26Å
362	Q	90.6	Very high	92.5	Very high	82 Å²	82	73.3 Å²	73.3	38%	0.383	38%	0.377	S	S	.	.	S	Bend	trans	-128.6	144.1	-175.5	-55.3	-174.2	5.6	0	0	111.5	Q340 F360 A364 G365 L366	Q340-Q362 VanDerWaalsContact CD-NE2 3.32Å; Q340-Q362 HydrophobicContact CG-CG 4.29Å; F360-Q362 VanDerWaalsContact C-N 3.34Å; Q362-A364 VanDerWaalsContact C-N 3.31Å; Q362-A364 PolarHBondContact O-N 3.3Å; Q362-G365 PolarHBondContact O-N 2.66Å; Q362-L366 PolarHBondContact O-N 3.12Å
363	N	92.3	Very high	92.3	Very high	67 Å²	67	70.6 Å²	70.6	36%	0.358	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-39.3	178.7	-163.3	9	0	0	0	112.5	Y351 G365 L366 F367	Y351-N363 HydrophobicContact CD1-CB 3.81Å; Y351-N363 VanDerWaalsContact CD2-N 3.32Å; Y351-N363 HydrophobicContact CE1-CB 3.65Å; Y351-N363 HydrophobicContact CE2-CB 4.35Å; Y351-N363 HydrophobicContact CG-CB 4.24Å; N363-G365 PolarHBondContact O-N 3.14Å; N363-L366 WeakPolarHBondContact O-CA 3.35Å; N363-L366 WeakPolarHBondContact O-CB 3.27Å; N363-L366 PolarHBondContact O-N 2.97Å; N363-F367 PolarHBondContact O-N 3.45Å; N363-F367 VanDerWaalsContact OD1-CD2 3.31Å; N363-F367 WeakPolarHBondContact OD1-CD2 3.34Å; N363-F367 WeakPolarHBondContact OD1-CE2 3.35Å
364	A	90.6	Very high	92.1	Very high	71 Å²	71	74.4 Å²	74.4	59%	0.587	39%	0.387	S	S	*	.	H	α-helix	trans	-59.2	-32.3	175.6	0	0	0	0	0	112.8	Q362 Q368	Q362-A364 VanDerWaalsContact C-N 3.31Å; Q362-A364 PolarHBondContact O-N 3.3Å; A364-Q368 VanDerWaalsContact O-CB 3.26Å; A364-Q368 WeakPolarHBondContact O-CB 3.21Å; A364-Q368 PolarHBondContact O-N 3.31Å
365	G	91.4	Very high	91.8	Very high	23 Å²	23	64.8 Å²	64.8	24%	0.237	37%	0.366	C	S	.	.	H	α-helix	trans	-68.1	-41	173.7	0	0	0	0	0	112.1	Q362 N363 H369	Q362-G365 PolarHBondContact O-N 2.66Å; N363-G365 PolarHBondContact O-N 3.14Å; G365-H369 WeakPolarHBondContact O-CB 3.37Å; G365-H369 PolarHBondContact O-N 3.4Å
366	L	94.1	Very high	91.8	Very high	22 Å²	22	64 Å²	64	12%	0.115	36%	0.362	C	S	.	.	H	α-helix	trans	-62.9	-52.9	173.3	173.9	61	0	0	0	111.2	C353 F360 Q362 N363 Q368 H369 L370	C353-L366 HydrophobicContact CB-CD1 3.73Å; F360-L366 HydrophobicContact CB-CB 4.47Å; F360-L366 HydrophobicContact CD2-CB 3.92Å; F360-L366 HydrophobicContact CD2-CD1 3.95Å; F360-L366 HydrophobicContact CE2-CD1 4.05Å; F360-L366 HydrophobicContact CG-CB 4.36Å; Q362-L366 PolarHBondContact O-N 3.12Å; N363-L366 WeakPolarHBondContact O-CA 3.35Å; N363-L366 WeakPolarHBondContact O-CB 3.27Å; N363-L366 PolarHBondContact O-N 2.97Å; L366-Q368 VanDerWaalsContact C-N 3.3Å; L366-Q368 PolarHBondContact O-N 3.4Å; L366-H369 CarbonylContact O-C 3.57Å; L366-H369 WeakPolarHBondContact O-CA 3.42Å; L366-H369 WeakPolarHBondContact O-CB 3.37Å; L366-H369 PolarHBondContact O-N 2.9Å; L366-L370 HydrophobicContact CD1-CD2 4.35Å; L366-L370 HydrophobicContact CD1-CG 4.26Å; L366-L370 HydrophobicContact CG-CD1 4.48Å; L366-L370 HydrophobicContact CG-CG 4.49Å; L366-L370 WeakPolarHBondContact O-CG 3.33Å; L366-L370 PolarHBondContact O-N 2.9Å
367	F	91.8	Very high	91.6	Very high	124 Å²	124	66.9 Å²	66.9	54%	0.544	37%	0.368	S	S	.	.	H	α-helix	trans	-57.6	-40.8	177.7	-88.4	-73.6	0	0	0	113	N363 H369 L370	N363-F367 PolarHBondContact O-N 3.45Å; N363-F367 VanDerWaalsContact OD1-CD2 3.31Å; N363-F367 WeakPolarHBondContact OD1-CD2 3.34Å; N363-F367 WeakPolarHBondContact OD1-CE2 3.35Å; F367-H369 VanDerWaalsContact C-N 3.28Å; F367-H369 PolarHBondContact O-N 3.39Å; F367-L370 HydrophobicContact CD1-CD1 4.39Å; F367-L370 PolarHBondContact O-N 3.46Å
368	Q	91.3	Very high	91.5	Very high	71 Å²	71	68.6 Å²	68.6	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-64.1	-36.6	174.1	176.1	173.5	88.7	0	0	112	A364 L366 R371 K390	A364-Q368 VanDerWaalsContact O-CB 3.26Å; A364-Q368 WeakPolarHBondContact O-CB 3.21Å; A364-Q368 PolarHBondContact O-N 3.31Å; L366-Q368 VanDerWaalsContact C-N 3.3Å; L366-Q368 PolarHBondContact O-N 3.4Å; Q368-R371 WeakPolarHBondContact O-CB 3.38Å; Q368-K390 HydrophobicContact CG-CD 4.27Å; Q368-K390 HydrophobicContact CG-CG 4.23Å; Q368-K390 VanDerWaalsContact NE2-CD 3.33Å; Q368-K390 VanDerWaalsContact OE1-CE 3.23Å
369	H	92.7	Very high	91.5	Very high	22 Å²	22	66 Å²	66	10%	0.102	36%	0.36	C	S	.	.	H	α-helix	trans	-71.4	-35.6	177.3	166	61.5	0	0	0	112.6	C353 C356 F360 G365 L366 F367 R371 V372 H373	C353-H369 PolarHBondContact SG-NE2 3.41Å; C356-H369 VanDerWaalsContact SG-CE1 3.56Å; C356-H369 PolarHBondContact SG-NE2 2.87Å; F360-H369 HydrophobicContact CE1-CB 3.86Å; F360-H369 HydrophobicContact CE2-CB 3.81Å; F360-H369 AromaticContact CE2-CD2 3.39Å; F360-H369 WeakPolarHBondContact CE2-CD2 3.24Å; F360-H369 AromaticContact CE2-CG 3.68Å; F360-H369 HydrophobicContact CZ-CB 3.29Å; F360-H369 AromaticContact CZ-CD2 3.44Å; F360-H369 VanDerWaalsContact CZ-CD2 3.44Å; F360-H369 WeakPolarHBondContact CZ-CD2 3.37Å; F360-H369 AromaticContact CZ-CG 3.24Å; F360-H369 AromaticContact CZ-ND1 3.96Å; G365-H369 WeakPolarHBondContact O-CB 3.37Å; G365-H369 PolarHBondContact O-N 3.4Å; L366-H369 CarbonylContact O-C 3.57Å; L366-H369 WeakPolarHBondContact O-CA 3.42Å; L366-H369 WeakPolarHBondContact O-CB 3.37Å; L366-H369 PolarHBondContact O-N 2.9Å; F367-H369 VanDerWaalsContact C-N 3.28Å; F367-H369 PolarHBondContact O-N 3.39Å; H369-R371 PolarHBondContact O-N 3.4Å; H369-R371 VanDerWaalsContact O-N 3.12Å; H369-V372 WeakPolarHBondContact O-CB 3.49Å; H369-V372 WeakPolarHBondContact O-CG2 3.34Å; H369-V372 PolarHBondContact O-N 2.93Å; H369-H373 AromaticContact CE1-NE2 3.53Å; H369-H373 AromaticContact NE2-CD2 3.87Å; H369-H373 AromaticContact NE2-NE2 3.34Å; H369-H373 PolarHBondContact NE2-NE2 2.94Å
370	L	92.3	Very high	91.5	Very high	50 Å²	50	69.7 Å²	69.7	26%	0.262	37%	0.372	S	S	.	.	H	α-helix	trans	-56.7	-28.6	176.2	-69.3	176.3	0	0	0	112.4	L366 F367 V372 H373 T374	L366-L370 HydrophobicContact CD1-CD2 4.35Å; L366-L370 HydrophobicContact CD1-CG 4.26Å; L366-L370 HydrophobicContact CG-CD1 4.48Å; L366-L370 HydrophobicContact CG-CG 4.49Å; L366-L370 WeakPolarHBondContact O-CG 3.33Å; L366-L370 PolarHBondContact O-N 2.9Å; F367-L370 HydrophobicContact CD1-CD1 4.39Å; F367-L370 PolarHBondContact O-N 3.46Å; L370-V372 PolarHBondContact O-N 2.91Å; L370-V372 VanDerWaalsContact O-N 3.14Å; L370-H373 WeakPolarHBondContact O-CB 3.24Å; L370-H373 PolarHBondContact O-N 3.06Å; L370-T374 PolarHBondContact O-N 3.17Å
371	R	92.3	Very high	91.6	Very high	56 Å²	56	67.3 Å²	67.3	21%	0.211	36%	0.362	C	S	.	.	H	α-helix	trans	-62.2	-19.5	172.8	-60.4	180	-175.6	173.3	-2.2	114.6	Q368 H369 H373 T374 G375 E376 Y379 S389	Q368-R371 WeakPolarHBondContact O-CB 3.38Å; H369-R371 PolarHBondContact O-N 3.4Å; H369-R371 VanDerWaalsContact O-N 3.12Å; R371-H373 VanDerWaalsContact C-N 3.29Å; R371-T374 WeakPolarHBondContact CA-OG1 3.45Å; R371-G375 CarbonylContact O-C 3.45Å; R371-G375 WeakPolarHBondContact O-CA 3.46Å; R371-G375 PolarHBondContact O-N 3.2Å; R371-E376 HydrophobicContact CB-CB 4.41Å; R371-E376 HydrophobicContact CG-CB 4.24Å; R371-E376 PolarHBondContact O-N 2.9Å; R371-Y379 PolarHBondContact NH1-OH 3.12Å; R371-S389 PolarHBondContact NH1-O 3.27Å
372	V	91.2	Very high	91.6	Very high	110 Å²	110	69.3 Å²	69.3	67%	0.667	38%	0.379	S	S	*	.	H	α-helix	trans	-70.5	-33.5	173.1	-179.9	0	0	0	0	110.4	H369 L370	H369-V372 WeakPolarHBondContact O-CB 3.49Å; H369-V372 WeakPolarHBondContact O-CG2 3.34Å; H369-V372 PolarHBondContact O-N 2.93Å; L370-V372 PolarHBondContact O-N 2.91Å; L370-V372 VanDerWaalsContact O-N 3.14Å
373	H	90.5	Very high	91.6	Very high	69 Å²	69	69.2 Å²	69.2	32%	0.319	38%	0.379	S	S	.	.	H	α-helix	trans	-80.5	-45.8	178.3	-66.7	-69.7	0	0	0	111.7	E355 C356 H369 L370 R371 G375	E355-H373 WeakPolarHBondContact OE2-CB 3.18Å; E355-H373 IonicContact OE2-CD2 3.4Å; E355-H373 IonicContact OE2-CE1 3.6Å; E355-H373 IonicContact OE2-CG 3.12Å; E355-H373 IonicContact OE2-ND1 2.91Å; E355-H373 PolarHBondContact OE2-ND1 2.71Å; E355-H373 VanDerWaalsContact OE2-ND1 3.15Å; C356-H373 PolarHBondContact SG-NE2 2.83Å; C356-H373 VanDerWaalsContact SG-NE2 3.38Å; H369-H373 AromaticContact CE1-NE2 3.53Å; H369-H373 AromaticContact NE2-CD2 3.87Å; H369-H373 AromaticContact NE2-NE2 3.34Å; H369-H373 PolarHBondContact NE2-NE2 2.94Å; L370-H373 WeakPolarHBondContact O-CB 3.24Å; L370-H373 PolarHBondContact O-N 3.06Å; R371-H373 VanDerWaalsContact C-N 3.29Å; H373-G375 VanDerWaalsContact C-N 3.28Å; H373-G375 PolarHBondContact O-N 3.41Å
374	T	89.9	Confident	91.6	Very high	81 Å²	81	68.3 Å²	68.3	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-77.2	-15.4	-179.9	64.4	0	0	0	0	113.4	L370 R371 E376	L370-T374 PolarHBondContact O-N 3.17Å; R371-T374 WeakPolarHBondContact CA-OG1 3.45Å; T374-E376 PolarHBondContact O-N 2.81Å; T374-E376 WeakPolarHBondContact OG1-CB 3.43Å; T374-E376 WeakPolarHBondContact OG1-CG 3.03Å; T374-E376 PolarHBondContact OG1-N 3.42Å
375	G	88.6	Confident	91.4	Very high	48 Å²	48	68.4 Å²	68.4	50%	0.495	37%	0.373	S	S	.	.			trans	71.3	3.4	-174.2	0	0	0	0	0	114.2	R371 H373 K377	R371-G375 CarbonylContact O-C 3.45Å; R371-G375 WeakPolarHBondContact O-CA 3.46Å; R371-G375 PolarHBondContact O-N 3.2Å; H373-G375 VanDerWaalsContact C-N 3.28Å; H373-G375 PolarHBondContact O-N 3.41Å; G375-K377 PolarHBondContact O-N 2.85Å
376	E	90.9	Very high	91.4	Very high	107 Å²	107	73.2 Å²	73.2	50%	0.5	39%	0.388	S	S	.	.			trans	-58.3	128.9	-177.8	-79.3	175.6	-158.5	0	0	112.5	R371 T374	R371-E376 HydrophobicContact CB-CB 4.41Å; R371-E376 HydrophobicContact CG-CB 4.24Å; R371-E376 PolarHBondContact O-N 2.9Å; T374-E376 PolarHBondContact O-N 2.81Å; T374-E376 WeakPolarHBondContact OG1-CB 3.43Å; T374-E376 WeakPolarHBondContact OG1-CG 3.03Å; T374-E376 PolarHBondContact OG1-N 3.42Å
377	K	91	Very high	91.3	Very high	115 Å²	115	76.6 Å²	76.6	50%	0.5	41%	0.405	S	S	.	.			trans	-127.7	76.3	174.8	-66.4	178.1	-173.1	174.3	0	110.6	G375 Y379 L387 F388	G375-K377 PolarHBondContact O-N 2.85Å; K377-Y379 PolarHBondContact O-N 3.42Å; K377-L387 HydrophobicContact CB-CB 3.58Å; K377-L387 HydrophobicContact CD-CB 4.04Å; K377-L387 HydrophobicContact CG-CB 4.48Å; K377-F388 CarbonylContact C-O 3.53Å; K377-F388 VanDerWaalsContact C-O 3.32Å; K377-F388 WeakPolarHBondContact CA-O 3.3Å
378	P	90.7	Very high	91.3	Very high	75 Å²	75	72.4 Å²	72.4	49%	0.487	39%	0.387	S	S	.	.			trans	-69.3	-8.6	-170.4	-19.1	32.7	0	0	0	114.7
379	Y	93.1	Very high	91.1	Very high	71 Å²	71	70.8 Å²	70.8	28%	0.278	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	103.7	-173.2	-52.6	-67.8	0	0	0	110.3	R371 K377 L387 F388 S389 R391	R371-Y379 PolarHBondContact NH1-OH 3.12Å; K377-Y379 PolarHBondContact O-N 3.42Å; Y379-L387 CarbonylContact O-C 3.55Å; Y379-L387 WeakPolarHBondContact O-CA 3.48Å; Y379-F388 WeakPolarHBondContact CD2-O 3.34Å; Y379-F388 PolarHBondContact N-O 3.26Å; Y379-F388 PolarHBondContact O-N 3.47Å; Y379-S389 WeakPolarHBondContact CE2-O 3.15Å; Y379-R391 HydrophobicContact CD1-CB 4.23Å; Y379-R391 HydrophobicContact CD2-CB 4.49Å; Y379-R391 VanDerWaalsContact CD2-N 3.32Å; Y379-R391 HydrophobicContact CE1-CB 4.08Å; Y379-R391 HydrophobicContact CE2-CB 4.31Å; Y379-R391 VanDerWaalsContact CE2-N 3.3Å; Y379-R391 HydrophobicContact CG-CB 4.44Å
380	Q	93.7	Very high	91	Very high	110 Å²	110	73.2 Å²	73.2	51%	0.514	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	140.7	175.8	-172.7	171.5	-2.3	0	0	111.6	S385 L387	Q380-S385 PolarHBondContact NE2-OG 3.22Å; Q380-L387 HydrophobicContact CB-CD2 3.57Å; Q380-L387 HydrophobicContact CG-CD2 3.76Å
381	C	93.8	Very high	90.9	Very high	0 Å²	0	78.5 Å²	78.5	0%	0	41%	0.41	C	S	.	.			trans	-79	122.4	166.3	-179.1	0	0	0	0	110.1	Q383 S385 K386 F388 L394 H397	C381-Q383 PolarHBondContact O-N 2.82Å; C381-Q383 PolarHBondContact SG-N 3.33Å; C381-S385 WeakPolarHBondContact O-CA 3.4Å; C381-S385 PolarHBondContact O-N 2.8Å; C381-K386 PolarHBondContact N-O 2.8Å; C381-F388 HydrophobicContact CB-CE2 4.2Å; C381-L394 HydrophobicContact CB-CD1 3.72Å; C381-H397 VanDerWaalsContact SG-CD2 3.56Å; C381-H397 PolarHBondContact SG-NE2 3.17Å
382	S	91.2	Very high	90.9	Very high	81 Å²	81	80 Å²	80	57%	0.566	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-22.3	177	52.1	0	0	0	0	114.2
383	Q	89.8	Confident	90.9	Very high	81 Å²	81	78.2 Å²	78.2	38%	0.379	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.3	-175.6	-59.8	-64.8	10.9	0	0	114.4	C381 H401	C381-Q383 PolarHBondContact O-N 2.82Å; C381-Q383 PolarHBondContact SG-N 3.33Å; Q383-H401 HydrophobicContact CG-CB 4.36Å
384	C	91.9	Very high	91.1	Very high	47 Å²	47	75.7 Å²	75.7	32%	0.318	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142	13.3	-176.4	69.8	0	0	0	0	113.6	K386 H397 H401	C384-K386 PolarHBondContact O-N 3.28Å; C384-H397 PolarHBondContact SG-NE2 2.99Å; C384-H401 PolarHBondContact SG-NE2 2.77Å
385	S	88.3	Confident	91.2	Very high	74 Å²	74	77.6 Å²	77.6	52%	0.517	40%	0.402	S	S	.	.			trans	54.1	11.5	178.8	-65.2	0	0	0	0	116.3	Q380 C381 L387	Q380-S385 PolarHBondContact NE2-OG 3.22Å; C381-S385 WeakPolarHBondContact O-CA 3.4Å; C381-S385 PolarHBondContact O-N 2.8Å; S385-L387 PolarHBondContact O-N 2.81Å
386	K	90.6	Very high	91.3	Very high	124 Å²	124	82.5 Å²	82.5	54%	0.539	41%	0.41	S	S	.	.			trans	-65.3	130.6	175.4	-72.4	-178.6	-176.6	178.1	0	110.5	C381 C384 F388	C381-K386 PolarHBondContact N-O 2.8Å; C384-K386 PolarHBondContact O-N 3.28Å; K386-F388 HydrophobicContact CB-CE2 3.76Å; K386-F388 HydrophobicContact CB-CZ 3.98Å; K386-F388 WeakPolarHBondContact O-CD2 3.44Å; K386-F388 VanDerWaalsContact O-CE2 3.25Å; K386-F388 WeakPolarHBondContact O-CE2 3.42Å
387	L	92.6	Very high	91.4	Very high	92 Å²	92	78.4 Å²	78.4	48%	0.482	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.9	179.3	-57.7	178.4	0	0	0	111.6	K377 Y379 Q380 S385	K377-L387 HydrophobicContact CB-CB 3.58Å; K377-L387 HydrophobicContact CD-CB 4.04Å; K377-L387 HydrophobicContact CG-CB 4.48Å; Y379-L387 CarbonylContact O-C 3.55Å; Y379-L387 WeakPolarHBondContact O-CA 3.48Å; Q380-L387 HydrophobicContact CB-CD2 3.57Å; Q380-L387 HydrophobicContact CG-CD2 3.76Å; S385-L387 PolarHBondContact O-N 2.81Å
388	F	90.6	Very high	91.4	Very high	37 Å²	37	76.3 Å²	76.3	16%	0.162	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.2	-179.9	-61.3	-89.4	0	0	0	111.3	K377 Y379 C381 K386 K390 L393 L394 H397	K377-F388 CarbonylContact C-O 3.53Å; K377-F388 VanDerWaalsContact C-O 3.32Å; K377-F388 WeakPolarHBondContact CA-O 3.3Å; Y379-F388 WeakPolarHBondContact CD2-O 3.34Å; Y379-F388 PolarHBondContact N-O 3.26Å; Y379-F388 PolarHBondContact O-N 3.47Å; C381-F388 HydrophobicContact CB-CE2 4.2Å; K386-F388 HydrophobicContact CB-CE2 3.76Å; K386-F388 HydrophobicContact CB-CZ 3.98Å; K386-F388 WeakPolarHBondContact O-CD2 3.44Å; K386-F388 VanDerWaalsContact O-CE2 3.25Å; K386-F388 WeakPolarHBondContact O-CE2 3.42Å; F388-K390 VanDerWaalsContact C-N 3.35Å; F388-L393 HydrophobicContact CB-CB 4.35Å; F388-L393 HydrophobicContact CD1-CB 3.81Å; F388-L393 HydrophobicContact CG-CB 4.39Å; F388-L394 HydrophobicContact CB-CB 4.28Å; F388-L394 HydrophobicContact CD2-CB 3.99Å; F388-L394 HydrophobicContact CD2-CD1 3.88Å; F388-L394 HydrophobicContact CE2-CD1 4.06Å; F388-L394 HydrophobicContact CG-CB 4.22Å; F388-H397 HydrophobicContact CE1-CB 3.86Å; F388-H397 HydrophobicContact CE2-CB 4.03Å; F388-H397 AromaticContact CE2-CD2 3.5Å; F388-H397 AromaticContact CE2-CG 3.76Å; F388-H397 HydrophobicContact CZ-CB 3.43Å; F388-H397 VanDerWaalsContact CZ-CB 3.43Å; F388-H397 AromaticContact CZ-CD2 3.45Å; F388-H397 VanDerWaalsContact CZ-CD2 3.45Å; F388-H397 WeakPolarHBondContact CZ-CD2 3.44Å; F388-H397 AromaticContact CZ-CG 3.22Å; F388-H397 AromaticContact CZ-ND1 3.79Å
389	S	88.6	Confident	91.3	Very high	36 Å²	36	76.6 Å²	76.6	25%	0.252	38%	0.376	S	S	.	.	S	Bend	trans	-79.6	-17.3	176.7	57.6	0	0	0	0	113.5	R371 Y379	R371-S389 PolarHBondContact NH1-O 3.27Å; Y379-S389 WeakPolarHBondContact CE2-O 3.15Å
390	K	89.3	Confident	91.1	Very high	74 Å²	74	79.1 Å²	79.1	32%	0.322	39%	0.393	S	S	.	.	S	Bend	trans	-134.3	137.2	-179	-50.5	-172.5	-176.9	-161.1	0	111.6	Q368 F388 T392 L393 L394	Q368-K390 HydrophobicContact CG-CD 4.27Å; Q368-K390 HydrophobicContact CG-CG 4.23Å; Q368-K390 VanDerWaalsContact NE2-CD 3.33Å; Q368-K390 VanDerWaalsContact OE1-CE 3.23Å; F388-K390 VanDerWaalsContact C-N 3.35Å; K390-T392 PolarHBondContact O-N 2.81Å; K390-L393 HydrophobicContact CB-CB 4.5Å; K390-L393 HydrophobicContact CB-CD1 4.12Å; K390-L393 HydrophobicContact CB-CG 4.1Å; K390-L393 HydrophobicContact CD-CD1 4.41Å; K390-L393 HydrophobicContact CG-CD1 4.22Å; K390-L393 WeakPolarHBondContact O-CB 3.37Å; K390-L393 PolarHBondContact O-N 3.47Å; K390-L393 VanDerWaalsContact O-N 3.08Å; K390-L394 PolarHBondContact O-N 2.97Å
391	R	90.6	Very high	90.8	Very high	161 Å²	161	77.8 Å²	77.8	61%	0.608	39%	0.387	S	S	*	.	H	α-helix	trans	-59.9	-31.9	176.1	-170.5	175	-174.7	-179	3.6	113.1	Y379 L393 L394 K395	Y379-R391 HydrophobicContact CD1-CB 4.23Å; Y379-R391 HydrophobicContact CD2-CB 4.49Å; Y379-R391 VanDerWaalsContact CD2-N 3.32Å; Y379-R391 HydrophobicContact CE1-CB 4.08Å; Y379-R391 HydrophobicContact CE2-CB 4.31Å; Y379-R391 VanDerWaalsContact CE2-N 3.3Å; Y379-R391 HydrophobicContact CG-CB 4.44Å; R391-L393 VanDerWaalsContact C-N 3.34Å; R391-L394 PolarHBondContact O-N 3.38Å; R391-K395 WeakPolarHBondContact O-CG 3.47Å; R391-K395 PolarHBondContact O-N 2.94Å
392	T	91.8	Very high	90.2	Very high	87 Å²	87	82.2 Å²	82.2	53%	0.534	41%	0.414	S	S	.	.	H	α-helix	trans	-67.1	-34.7	176.8	50.8	0	0	0	0	112.4	K390 K395 K396	K390-T392 PolarHBondContact O-N 2.81Å; T392-K395 PolarHBondContact O-N 2.95Å; T392-K396 WeakPolarHBondContact O-CG 3.3Å; T392-K396 PolarHBondContact O-N 3.09Å
393	L	91.9	Very high	89.2	Confident	73 Å²	73	81.3 Å²	81.3	38%	0.382	42%	0.417	S	S	.	.	H	α-helix	trans	-70	-42.7	174.5	-64.4	175.7	0	0	0	110.6	F388 K390 R391 K395 K396 H397	F388-L393 HydrophobicContact CB-CB 4.35Å; F388-L393 HydrophobicContact CD1-CB 3.81Å; F388-L393 HydrophobicContact CG-CB 4.39Å; K390-L393 HydrophobicContact CB-CB 4.5Å; K390-L393 HydrophobicContact CB-CD1 4.12Å; K390-L393 HydrophobicContact CB-CG 4.1Å; K390-L393 HydrophobicContact CD-CD1 4.41Å; K390-L393 HydrophobicContact CG-CD1 4.22Å; K390-L393 WeakPolarHBondContact O-CB 3.37Å; K390-L393 PolarHBondContact O-N 3.47Å; K390-L393 VanDerWaalsContact O-N 3.08Å; R391-L393 VanDerWaalsContact C-N 3.34Å; L393-K395 PolarHBondContact O-N 2.95Å; L393-K396 PolarHBondContact O-N 3.24Å; L393-H397 WeakPolarHBondContact O-CB 3.27Å; L393-H397 PolarHBondContact O-N 3.35Å
394	L	93.5	Very high	88.1	Confident	16 Å²	16	83.2 Å²	83.2	8%	0.084	43%	0.426	C	S	.	.	H	α-helix	trans	-56.7	-49	171.6	172.2	61.7	0	0	0	111.2	C381 F388 K390 R391 K396 H397 Q398	C381-L394 HydrophobicContact CB-CD1 3.72Å; F388-L394 HydrophobicContact CB-CB 4.28Å; F388-L394 HydrophobicContact CD2-CB 3.99Å; F388-L394 HydrophobicContact CD2-CD1 3.88Å; F388-L394 HydrophobicContact CE2-CD1 4.06Å; F388-L394 HydrophobicContact CG-CB 4.22Å; K390-L394 PolarHBondContact O-N 2.97Å; R391-L394 PolarHBondContact O-N 3.38Å; L394-K396 PolarHBondContact O-N 2.85Å; L394-H397 CarbonylContact O-C 3.6Å; L394-H397 WeakPolarHBondContact O-CB 3.39Å; L394-H397 PolarHBondContact O-N 3.39Å; L394-H397 VanDerWaalsContact O-N 3.13Å; L394-Q398 HydrophobicContact CD1-CG 3.93Å; L394-Q398 HydrophobicContact CG-CG 4.31Å; L394-Q398 WeakPolarHBondContact O-CG 3.37Å; L394-Q398 PolarHBondContact O-N 3.19Å
395	K	91.9	Very high	86.2	Confident	121 Å²	121	92.6 Å²	92.6	53%	0.526	46%	0.455	S	S	.	.	H	α-helix	trans	-58.7	-43.9	177.8	-77.3	-170.9	175	-166.5	0	112.7	R391 T392 L393 H397 Q398 K399	R391-K395 WeakPolarHBondContact O-CG 3.47Å; R391-K395 PolarHBondContact O-N 2.94Å; T392-K395 PolarHBondContact O-N 2.95Å; L393-K395 PolarHBondContact O-N 2.95Å; K395-H397 VanDerWaalsContact C-N 3.31Å; K395-Q398 PolarHBondContact O-N 3Å; K395-K399 PolarHBondContact O-N 3.4Å
396	K	91.9	Very high	84.2	Confident	151 Å²	151	98 Å²	98	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-62.5	-40.8	175.5	-75.4	-176.3	178.4	-166.6	0	111.6	T392 L393 L394 K399	T392-K396 WeakPolarHBondContact O-CG 3.3Å; T392-K396 PolarHBondContact O-N 3.09Å; L393-K396 PolarHBondContact O-N 3.24Å; L394-K396 PolarHBondContact O-N 2.85Å; K396-K399 WeakPolarHBondContact O-CB 3.46Å; K396-K399 PolarHBondContact O-N 3.49Å
397	H	91.8	Very high	83.9	Confident	21 Å²	21	96.7 Å²	96.7	10%	0.097	48%	0.482	C	S	.	.	H	α-helix	trans	-66.6	-39.7	176.6	171.1	69.8	0	0	0	112.3	C381 C384 F388 L393 L394 K395 K399 I400 H401	C381-H397 VanDerWaalsContact SG-CD2 3.56Å; C381-H397 PolarHBondContact SG-NE2 3.17Å; C384-H397 PolarHBondContact SG-NE2 2.99Å; F388-H397 HydrophobicContact CE1-CB 3.86Å; F388-H397 HydrophobicContact CE2-CB 4.03Å; F388-H397 AromaticContact CE2-CD2 3.5Å; F388-H397 AromaticContact CE2-CG 3.76Å; F388-H397 HydrophobicContact CZ-CB 3.43Å; F388-H397 VanDerWaalsContact CZ-CB 3.43Å; F388-H397 AromaticContact CZ-CD2 3.45Å; F388-H397 VanDerWaalsContact CZ-CD2 3.45Å; F388-H397 WeakPolarHBondContact CZ-CD2 3.44Å; F388-H397 AromaticContact CZ-CG 3.22Å; F388-H397 AromaticContact CZ-ND1 3.79Å; L393-H397 WeakPolarHBondContact O-CB 3.27Å; L393-H397 PolarHBondContact O-N 3.35Å; L394-H397 CarbonylContact O-C 3.6Å; L394-H397 WeakPolarHBondContact O-CB 3.39Å; L394-H397 PolarHBondContact O-N 3.39Å; L394-H397 VanDerWaalsContact O-N 3.13Å; K395-H397 VanDerWaalsContact C-N 3.31Å; H397-K399 PolarHBondContact O-N 3.3Å; H397-I400 VanDerWaalsContact O-CB 3.22Å; H397-I400 WeakPolarHBondContact O-CB 3.44Å; H397-I400 WeakPolarHBondContact O-CG1 3.38Å; H397-I400 PolarHBondContact O-N 3.13Å; H397-H401 AromaticContact CD2-NE2 3.84Å; H397-H401 AromaticContact CE1-NE2 3.44Å; H397-H401 PolarHBondContact CE1-NE2 3.4Å; H397-H401 AromaticContact NE2-CD2 3.79Å; H397-H401 AromaticContact NE2-CE1 4Å; H397-H401 AromaticContact NE2-NE2 2.99Å; H397-H401 PolarHBondContact NE2-NE2 3.24Å
398	Q	91.1	Very high	83.5	Confident	70 Å²	70	96.9 Å²	96.9	33%	0.327	48%	0.482	S	S	.	.	H	α-helix	trans	-59.5	-32.1	176.7	-76.4	173	-41.5	0	0	112.6	L394 K395 I400 H401 T402	L394-Q398 HydrophobicContact CD1-CG 3.93Å; L394-Q398 HydrophobicContact CG-CG 4.31Å; L394-Q398 WeakPolarHBondContact O-CG 3.37Å; L394-Q398 PolarHBondContact O-N 3.19Å; K395-Q398 PolarHBondContact O-N 3Å; Q398-I400 PolarHBondContact O-N 3.29Å; Q398-H401 WeakPolarHBondContact O-CB 3.32Å; Q398-H401 PolarHBondContact O-N 3.07Å; Q398-T402 PolarHBondContact O-N 3.38Å
399	K	89.9	Confident	83.1	Confident	82 Å²	82	100.2 Å²	100.2	36%	0.357	50%	0.5	S	S	.	.	H	α-helix	trans	-61.6	-24.6	174	-68.1	-171.8	170.1	-151.8	0	114.2	K395 K396 H397 H401 T402 G403 E404	K395-K399 PolarHBondContact O-N 3.4Å; K396-K399 WeakPolarHBondContact O-CB 3.46Å; K396-K399 PolarHBondContact O-N 3.49Å; H397-K399 PolarHBondContact O-N 3.3Å; K399-H401 VanDerWaalsContact C-N 3.29Å; K399-T402 WeakPolarHBondContact CA-OG1 3.37Å; K399-T402 PolarHBondContact O-N 3.36Å; K399-T402 PolarHBondContact O-OG1 3.43Å; K399-G403 PolarHBondContact O-N 2.97Å; K399-E404 PolarHBondContact O-N 2.87Å
400	I	88.5	Confident	82.7	Confident	123 Å²	123	104 Å²	104	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-67.2	-36.7	175.6	-55.7	173.1	0	0	0	109.9	H397 Q398	H397-I400 VanDerWaalsContact O-CB 3.22Å; H397-I400 WeakPolarHBondContact O-CB 3.44Å; H397-I400 WeakPolarHBondContact O-CG1 3.38Å; H397-I400 PolarHBondContact O-N 3.13Å; Q398-I400 PolarHBondContact O-N 3.29Å
401	H	86.4	Confident	82.3	Confident	82 Å²	82	105.9 Å²	105.9	38%	0.38	53%	0.527	S	S	.	.	H	α-helix	trans	-75.8	-30.7	178.3	-61.1	-59.6	0	0	0	112.6	Q383 C384 H397 Q398 K399 G403	Q383-H401 HydrophobicContact CG-CB 4.36Å; C384-H401 PolarHBondContact SG-NE2 2.77Å; H397-H401 AromaticContact CD2-NE2 3.84Å; H397-H401 AromaticContact CE1-NE2 3.44Å; H397-H401 PolarHBondContact CE1-NE2 3.4Å; H397-H401 AromaticContact NE2-CD2 3.79Å; H397-H401 AromaticContact NE2-CE1 4Å; H397-H401 AromaticContact NE2-NE2 2.99Å; H397-H401 PolarHBondContact NE2-NE2 3.24Å; Q398-H401 WeakPolarHBondContact O-CB 3.32Å; Q398-H401 PolarHBondContact O-N 3.07Å; K399-H401 VanDerWaalsContact C-N 3.29Å; H401-G403 VanDerWaalsContact C-N 3.34Å
402	T	81.6	Confident	81.8	Confident	94 Å²	94	102.2 Å²	102.2	58%	0.577	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	1.8	179.9	62.1	0	0	0	0	113.6	Q398 K399 E404	Q398-T402 PolarHBondContact O-N 3.38Å; K399-T402 WeakPolarHBondContact CA-OG1 3.37Å; K399-T402 PolarHBondContact O-N 3.36Å; K399-T402 PolarHBondContact O-OG1 3.43Å; T402-E404 PolarHBondContact O-N 3.48Å; T402-E404 VanDerWaalsContact O-N 3.13Å
403	G	71.1	Confident	81.1	Confident	62 Å²	62	103.3 Å²	103.3	64%	0.639	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	3.5	179.3	0	0	0	0	0	115.2	K399 H401 R405	K399-G403 PolarHBondContact O-N 2.97Å; H401-G403 VanDerWaalsContact C-N 3.34Å; G403-R405 VanDerWaalsContact C-N 3.28Å; G403-R405 PolarHBondContact O-N 3.14Å
404	E	65.6	Low	80.2	Confident	121 Å²	121	105.6 Å²	105.6	57%	0.565	53%	0.531	S	S	*	.			trans	-77.1	75.8	176.4	-66.3	-174.3	170.6	0	0	110.3	K399 T402 T406	K399-E404 PolarHBondContact O-N 2.87Å; T402-E404 PolarHBondContact O-N 3.48Å; T402-E404 VanDerWaalsContact O-N 3.13Å; E404-T406 PolarHBondContact O-N 2.78Å
405	R	51.9	Low	79.1	Confident	244 Å²	244	113.1 Å²	113.1	92%	0.921	57%	0.568	S	S	*	*			trans	-72.9	117	170.9	-85.4	178.3	149.2	151.9	-5.7	110	G403	G403-R405 VanDerWaalsContact C-N 3.28Å; G403-R405 PolarHBondContact O-N 3.14Å
406	T	47.8	Very low	78	Confident	186 Å²	186	112.4 Å²	112.4	100%	1.141	57%	0.572	S	S	*	*			trans	-87.8	0	158.5	53	0	0	0	0	110.6	E404	E404-T406 PolarHBondContact O-N 2.78Å

Retrieved 406 of 406 residues in 626.1 ms (Link to these results)

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