A0A096MV28_PAPAN Loading...

Zinc finger protein with KRAB and SCAN domains 1

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A096MV28, Species PAPAN (Papio anubis, Olive baboon), Gene ZKSCAN1, Length 563 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	40.2	Very low	35.1	Very low	240 Å²	240	149.4 Å²	149.4	100%	1.182	84%	0.838	S	S	*	*				0	161.4	0	-80.1	-178.5	162.4	0	0	108.6
2	M	31.1	Very low	34.6	Very low	176 Å²	176	151.1 Å²	151.1	87%	0.867	84%	0.842	S	S	*	*			trans	84.6	79.3	-167.1	-51	-55.6	178.6	0	0	115.3
3	T	39.8	Very low	34.6	Very low	132 Å²	132	147.5 Å²	147.5	81%	0.81	83%	0.834	S	S	*	*				-8.4	159.2	129.5	47.9	0	0	0	0	118.9
4	A	41.6	Very low	35	Very low	84 Å²	84	145.2 Å²	145.2	69%	0.694	83%	0.828	S	S	*	*			cis	-173.9	-162.5	-11.6	0	0	0	0	0	109.1
5	E	35.9	Very low	34.6	Very low	185 Å²	185	147.9 Å²	147.9	86%	0.864	83%	0.83	S	S	*	*			trans	85.5	145.7	169.4	-54.2	-170	103.1	0	0	118.3
6	S	38.6	Very low	34.4	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	83%	0.825	S	S	*	*			cis	-179.7	131.3	-26.9	-94	0	0	0	0	108.3
7	R	33.1	Very low	34.1	Very low	247 Å²	247	140.4 Å²	140.4	93%	0.932	81%	0.814	S	S	*	*			trans	168.2	152.5	139.9	-97.9	168.1	167.5	168.9	-3.5	116.3
8	E	33.7	Very low	33.9	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	81%	0.813	S	S	*	*			trans	-82.7	-178.4	174.8	-49.5	156.2	109.4	0	0	110.7
9	A	33.1	Very low	33.8	Very low	77 Å²	77	140.8 Å²	140.8	64%	0.636	80%	0.8	S	S	*	*			cis	-159.4	152.4	13.2	0	0	0	0	0	113.7
10	T	31.6	Very low	33.9	Very low	134 Å²	134	141.9 Å²	141.9	82%	0.822	80%	0.795	S	S	*	*			trans	34.3	133.4	143.2	55.9	0	0	0	0	124.2
11	G	26.7	Very low	33.8	Very low	81 Å²	81	142.5 Å²	142.5	84%	0.835	80%	0.796	S	S	*	*			trans	-154.4	128.3	149.2	0	0	0	0	0	110.7
12	L	30	Very low	33.2	Very low	170 Å²	170	134.7 Å²	134.7	89%	0.89	78%	0.777	S	S	*	*			trans	-114.7	165.5	-165.2	-86.3	161.2	0	0	0	114.8
13	S	33.9	Very low	33	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	78%	0.777	S	S	*	*			trans	-66.6	170.4	176.3	-174.2	0	0	0	0	114.1
14	P	40.6	Very low	32.4	Very low	115 Å²	115	134 Å²	134	75%	0.747	78%	0.775	S	S	*	*				-150.9	156.9	107.9	37.9	-20.3	0	0	0	119.4
15	Q	29.1	Very low	32.3	Very low	185 Å²	185	137.5 Å²	137.5	86%	0.864	78%	0.78	S	S	*	*			trans	-8.3	163.9	138.1	-77.3	174.1	-8	0	0	120.9
16	A	31.2	Very low	31.8	Very low	90 Å²	90	135 Å²	135	74%	0.744	78%	0.777	S	S	*	*			cis	-174.1	-176	-2.7	0	0	0	0	0	113.6
17	A	29.8	Very low	31.6	Very low	78 Å²	78	138.6 Å²	138.6	65%	0.645	78%	0.78	S	S	*	*			trans	78.3	117.8	153.9	0	0	0	0	0	121
18	Q	30.9	Very low	31.4	Very low	168 Å²	168	132.9 Å²	132.9	79%	0.785	77%	0.772	S	S	*	*				101.9	145.1	90.7	-86.2	178.1	-97.4	0	0	111.8
19	E	30.7	Very low	31.1	Very low	121 Å²	121	131.7 Å²	131.7	57%	0.565	77%	0.767	S	S	*	*			cis	-163.4	148.6	0.7	-135.3	176.8	132.7	0	0	111.9
20	K	36.3	Very low	31.5	Very low	162 Å²	162	137.3 Å²	137.3	70%	0.704	78%	0.78	S	S	*	*			trans	56.9	152.1	148.5	-77.1	168.2	-173.5	161.8	0	121.7
21	D	31.2	Very low	31.4	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	78%	0.782	S	S	*	*			cis	-146.6	159	9.7	-96.3	-43	0	0	0	111.8
22	G	27.3	Very low	31.6	Very low	76 Å²	76	143.4 Å²	143.4	78%	0.784	78%	0.783	S	S	*	*			trans	145	111.1	164.8	0	0	0	0	0	116.6
23	I	28.8	Very low	32.1	Very low	168 Å²	168	144 Å²	144	86%	0.862	78%	0.781	S	S	*	*			trans	-112.1	142.6	-179.6	-67	170.7	0	0	0	108.4
24	V	27	Very low	31.9	Very low	125 Å²	125	147.2 Å²	147.2	76%	0.758	78%	0.784	S	S	*	*				-165.7	144.3	90.5	165.4	0	0	0	0	110.6	V26	V24-V26 HydrophobicContact CG1-CG2 4.35Å
25	I	37.7	Very low	31.6	Very low	159 Å²	159	148.8 Å²	148.8	82%	0.815	79%	0.786	S	S	*	*			trans	-95.7	136.9	171.3	-62.2	171.1	0	0	0	110.2
26	V	27.2	Very low	31.4	Very low	131 Å²	131	146.9 Å²	146.9	79%	0.794	78%	0.777	S	S	*	*			trans	-140	139.1	155.6	179.8	0	0	0	0	109.6	V24	V24-V26 HydrophobicContact CG1-CG2 4.35Å
27	K	32.8	Very low	31.6	Very low	176 Å²	176	148.9 Å²	148.9	77%	0.765	78%	0.78	S	S	*	*			trans	-79.1	146.8	171.8	-71.1	175.5	165.5	-170.4	0	111.7
28	V	29.2	Very low	31.5	Very low	127 Å²	127	155.9 Å²	155.9	77%	0.77	79%	0.79	S	S	*	*			trans	-149.6	99	143.1	-175.4	0	0	0	0	104.1
29	E	28.5	Very low	31.4	Very low	162 Å²	162	150.6 Å²	150.6	76%	0.757	78%	0.781	S	S	*	*				70	94.6	87.6	-69.8	173	-178.5	0	0	112.4
30	E	41.4	Very low	31.7	Very low	196 Å²	196	154.7 Å²	154.7	92%	0.916	80%	0.8	S	S	*	*			trans	-94.2	123.3	152.7	-65.6	177.3	145	0	0	106.2
31	E	29.6	Very low	31.2	Very low	186 Å²	186	154.4 Å²	154.4	87%	0.869	81%	0.806	S	S	*	*			trans	-140.9	157.4	161.3	-74.5	-162.6	162.4	0	0	109.4
32	D	31.2	Very low	31.6	Very low	157 Å²	157	152.5 Å²	152.5	84%	0.84	81%	0.805	S	S	*	*			trans	-92.7	-170.8	-153.6	-64.2	-79.1	0	0	0	115.8
33	E	39.2	Very low	31.8	Very low	181 Å²	181	154.3 Å²	154.3	85%	0.846	81%	0.805	S	S	*	*			trans	-5.5	141.5	159.9	-58.8	-176.1	157.1	0	0	119.3
34	E	30	Very low	32.6	Very low	174 Å²	174	153.1 Å²	153.1	81%	0.813	80%	0.8	S	S	*	*				-154.7	132.3	118.2	-119.6	-179	-147.5	0	0	113.1
35	D	34.5	Very low	32.8	Very low	147 Å²	147	155.5 Å²	155.5	79%	0.786	80%	0.803	S	S	*	*			trans	-65.9	142.5	164.6	-81.4	-54.5	0	0	0	110.4
36	H	26	Very low	32.9	Very low	146 Å²	146	154.9 Å²	154.9	68%	0.676	80%	0.801	S	S	*	*			trans	-135.9	94.8	160.2	-111.3	60.6	0	0	0	112.5	W38	H36-W38 AromaticContact CD2-CD1 3.84Å; H36-W38 AromaticContact CD2-NE1 3.98Å
37	V	34.8	Very low	33.3	Very low	132 Å²	132	154.3 Å²	154.3	80%	0.8	80%	0.798	S	S	*	*			trans	-80.8	111.2	162.7	172.5	0	0	0	0	109.1
38	W	27.3	Very low	33.8	Very low	224 Å²	224	151.3 Å²	151.3	85%	0.848	80%	0.797	S	S	*	*			trans	-128.9	132.1	144.7	-74.3	84.9	0	0	0	105.6	H36	H36-W38 AromaticContact CD2-CD1 3.84Å; H36-W38 AromaticContact CD2-NE1 3.98Å
39	G	28.9	Very low	34.9	Very low	58 Å²	58	149.9 Å²	149.9	60%	0.598	79%	0.79	S	S	*	*			cis	107	119.8	39.2	0	0	0	0	0	106	D41	G39-D41 PolarHBondContact O-N 3.07Å
40	Q	37	Very low	36.4	Very low	207 Å²	207	145.7 Å²	145.7	97%	0.967	78%	0.777	S	S	*	*			trans	-63	118	-173.9	-65.3	169	-52.4	0	0	111
41	D	25.6	Very low	37.3	Very low	156 Å²	156	139.3 Å²	139.3	83%	0.834	75%	0.749	S	S	*	*			trans	-156	164.6	131.4	-142.6	-20.9	0	0	0	112.1	G39	G39-D41 PolarHBondContact O-N 3.07Å
42	S	40.3	Very low	38.8	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	72%	0.722	S	S	*	*			trans	-87.8	128.7	-170.9	-52.6	0	0	0	0	112.3
43	S	30.6	Very low	40.5	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	68%	0.683	S	S	*	*			trans	-154.2	132.1	152.1	-169.6	0	0	0	0	110.3	Q45	S43-Q45 PolarHBondContact O-N 3.33Å
44	L	45.8	Very low	41.9	Very low	143 Å²	143	120.2 Å²	120.2	75%	0.749	66%	0.66	S	S	*	*			trans	-65	130.8	177.1	-75.4	84.1	0	0	0	110.3
45	Q	32.2	Very low	43.8	Very low	175 Å²	175	112.7 Å²	112.7	82%	0.818	63%	0.625	S	S	*	*			trans	-132.6	104.7	144.7	-69.3	-166.7	5.1	0	0	108.2	S43 T47	S43-Q45 PolarHBondContact O-N 3.33Å; Q45-T47 VanDerWaalsContact C-N 3.28Å; Q45-T47 PolarHBondContact O-N 3.36Å
46	D	39.6	Very low	45.4	Very low	146 Å²	146	105.9 Å²	105.9	78%	0.781	59%	0.588	S	S	*	*			trans	-64.6	88.6	171.3	-74.1	-61.5	0	0	0	109.7
47	T	34.8	Very low	47.4	Very low	118 Å²	118	103 Å²	103	72%	0.724	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-78.3	120	154.3	43.1	0	0	0	0	106.6	Q45	Q45-T47 VanDerWaalsContact C-N 3.28Å; Q45-T47 PolarHBondContact O-N 3.36Å
48	P	43.5	Very low	49.1	Very low	114 Å²	114	103.4 Å²	103.4	74%	0.74	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-58.5	132.2	-179.3	23.1	-32.5	0	0	0	108.6
49	P	52.3	Low	51.2	Low	96 Å²	96	95.6 Å²	95.6	62%	0.623	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-59.7	132.6	-174.7	24.4	-33.9	0	0	0	108.9	D51	P49-D51 PolarHBondContact O-N 2.8Å
50	P	59.1	Low	53.1	Low	75 Å²	75	97 Å²	97	49%	0.487	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-55.1	138.7	-171.4	17.9	-30.9	0	0	0	111.5	F55 R86	P50-F55 HydrophobicContact CB-CE2 3.85Å; P50-F55 HydrophobicContact CB-CZ 4.1Å; P50-F55 HydrophobicContact CG-CE2 3.78Å; P50-F55 HydrophobicContact CG-CZ 3.74Å; P50-R86 PolarHBondContact O-NH2 3.01Å
51	D	60.6	Low	54.5	Low	61 Å²	61	97.3 Å²	97.3	33%	0.326	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-47.1	125.1	-174.3	175.6	-3.1	0	0	0	112.1	P49 E53 I54 F55 R120	P49-D51 PolarHBondContact O-N 2.8Å; D51-E53 PolarHBondContact O-N 2.91Å; D51-E53 VanDerWaalsContact O-N 3.13Å; D51-E53 VanDerWaalsContact OD1-CB 3.31Å; D51-E53 WeakPolarHBondContact OD1-CB 3.21Å; D51-E53 PolarHBondContact OD1-N 3.38Å; D51-I54 HydrophobicContact CB-CD1 3.99Å; D51-I54 HydrophobicContact CB-CG1 4.1Å; D51-I54 WeakPolarHBondContact O-CB 3.49Å; D51-I54 PolarHBondContact O-N 2.92Å; D51-F55 WeakPolarHBondContact O-CD2 3.26Å; D51-R120 IonicContact OD2-NE 3.58Å
52	P	62.3	Low	56.9	Low	46 Å²	46	92.6 Å²	92.6	30%	0.299	49%	0.486	S	S	.	.	H	α-helix	trans	-49.6	-32.3	174.7	-28.4	36.2	0	0	0	114.6	I54 F55 R56	P52-I54 VanDerWaalsContact C-N 3.3Å; P52-I54 PolarHBondContact O-N 2.99Å; P52-F55 PolarHBondContact O-N 2.87Å; P52-F55 VanDerWaalsContact O-N 3.08Å; P52-R56 PolarHBondContact O-N 2.69Å
53	E	66.5	Low	58	Low	7 Å²	7	90.2 Å²	90.2	3%	0.033	47%	0.468	C	S	.	.	H	α-helix	trans	-65	-31.4	179	-175.9	56.8	-146.6	0	0	112.2	D51 F55 R56 Q57 R60 R120	D51-E53 PolarHBondContact O-N 2.91Å; D51-E53 VanDerWaalsContact O-N 3.13Å; D51-E53 VanDerWaalsContact OD1-CB 3.31Å; D51-E53 WeakPolarHBondContact OD1-CB 3.21Å; D51-E53 PolarHBondContact OD1-N 3.38Å; E53-F55 PolarHBondContact O-N 2.81Å; E53-R56 PolarHBondContact O-N 2.99Å; E53-R56 WeakPolarHBondContact OE2-CD 3.5Å; E53-R56 IonicContact OE2-CZ 3.93Å; E53-R56 IonicContact OE2-NE 3.34Å; E53-R56 IonicContact OE2-NH1 3.19Å; E53-R56 PolarHBondContact OE2-NH1 3.31Å; E53-R56 VanDerWaalsContact OE2-NH1 3.12Å; E53-Q57 HydrophobicContact CG-CG 4.45Å; E53-Q57 WeakPolarHBondContact O-CB 3.26Å; E53-Q57 VanDerWaalsContact O-CG 3.3Å; E53-Q57 WeakPolarHBondContact O-CG 3.36Å; E53-Q57 PolarHBondContact O-N 3.22Å; E53-Q57 WeakPolarHBondContact OE1-CG 3.21Å; E53-Q57 PolarHBondContact OE1-NE2 3.46Å; E53-Q57 VanDerWaalsContact OE1-NE2 3.11Å; E53-R60 IonicContact OE1-NH1 3.67Å; E53-R120 HydrophobicContact CG-CG 4.32Å
54	I	69.1	Low	59.5	Low	71 Å²	71	91.2 Å²	91.2	36%	0.364	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-35.2	173.9	-62	172.5	0	0	0	110.6	D51 P52 R58	D51-I54 HydrophobicContact CB-CD1 3.99Å; D51-I54 HydrophobicContact CB-CG1 4.1Å; D51-I54 WeakPolarHBondContact O-CB 3.49Å; D51-I54 PolarHBondContact O-N 2.92Å; P52-I54 VanDerWaalsContact C-N 3.3Å; P52-I54 PolarHBondContact O-N 2.99Å; I54-R58 WeakPolarHBondContact O-CB 3.47Å; I54-R58 WeakPolarHBondContact O-CD 3.38Å; I54-R58 VanDerWaalsContact O-CG 3.23Å; I54-R58 WeakPolarHBondContact O-CG 3.36Å; I54-R58 PolarHBondContact O-N 2.91Å; I54-R58 VanDerWaalsContact O-N 3.11Å
55	F	68.4	Low	60.1	Low	16 Å²	16	92.9 Å²	92.9	7%	0.07	46%	0.46	C	S	.	.	H	α-helix	trans	-79.6	-38.2	178.4	-59.8	-79.6	0	0	0	112.1	P50 D51 P52 E53 Q57 R58 F59 Q83 W84 R86	P50-F55 HydrophobicContact CB-CE2 3.85Å; P50-F55 HydrophobicContact CB-CZ 4.1Å; P50-F55 HydrophobicContact CG-CE2 3.78Å; P50-F55 HydrophobicContact CG-CZ 3.74Å; D51-F55 WeakPolarHBondContact O-CD2 3.26Å; P52-F55 PolarHBondContact O-N 2.87Å; P52-F55 VanDerWaalsContact O-N 3.08Å; E53-F55 PolarHBondContact O-N 2.81Å; F55-Q57 VanDerWaalsContact C-N 3.34Å; F55-Q57 PolarHBondContact O-N 3.42Å; F55-R58 PolarHBondContact O-N 3.12Å; F55-F59 WeakPolarHBondContact O-CB 3.39Å; F55-F59 PolarHBondContact O-N 3.21Å; F55-Q83 HydrophobicContact CD1-CB 3.46Å; F55-Q83 VanDerWaalsContact CD1-CB 3.46Å; F55-Q83 HydrophobicContact CD1-CG 4.39Å; F55-Q83 HydrophobicContact CE1-CB 3.73Å; F55-Q83 HydrophobicContact CE1-CG 4.26Å; F55-Q83 VanDerWaalsContact CE1-OE1 3.26Å; F55-Q83 HydrophobicContact CG-CB 4.16Å; F55-W84 HydrophobicContact CB-CB 3.96Å; F55-R86 VanDerWaalsContact CE2-NH2 3.29Å
56	R	69.2	Low	61.4	Low	4 Å²	4	91 Å²	91	2%	0.015	46%	0.455	C	S	.	.	H	α-helix	trans	-55.1	-48.2	168.6	-69.1	171.9	-174.4	172.7	1.3	111.1	P52 E53 R58 F59 R60 W84 L98 P121 D122	P52-R56 PolarHBondContact O-N 2.69Å; E53-R56 PolarHBondContact O-N 2.99Å; E53-R56 WeakPolarHBondContact OE2-CD 3.5Å; E53-R56 IonicContact OE2-CZ 3.93Å; E53-R56 IonicContact OE2-NE 3.34Å; E53-R56 IonicContact OE2-NH1 3.19Å; E53-R56 PolarHBondContact OE2-NH1 3.31Å; E53-R56 VanDerWaalsContact OE2-NH1 3.12Å; R56-R58 PolarHBondContact O-N 2.84Å; R56-F59 WeakPolarHBondContact O-CB 3.42Å; R56-F59 PolarHBondContact O-N 3.3Å; R56-R60 WeakPolarHBondContact O-CG 3.43Å; R56-R60 PolarHBondContact O-N 2.87Å; R56-W84 HydrophobicContact CG-CD2 4.48Å; R56-W84 HydrophobicContact CG-CG 4.31Å; R56-W84 VanDerWaalsContact CG-NE1 3.28Å; R56-L98 VanDerWaalsContact NH2-CD2 3.35Å; R56-P121 PolarHBondContact NH1-O 2.86Å; R56-D122 IonicContact NH2-OD1 3.53Å
57	Q	67.6	Low	62.5	Low	86 Å²	86	85.3 Å²	85.3	40%	0.402	43%	0.426	S	S	.	.	H	α-helix	trans	-65.2	-39.5	178.8	-69.6	178.5	14.7	0	0	113.2	E53 F55 F59 R60 R61	E53-Q57 HydrophobicContact CG-CG 4.45Å; E53-Q57 WeakPolarHBondContact O-CB 3.26Å; E53-Q57 VanDerWaalsContact O-CG 3.3Å; E53-Q57 WeakPolarHBondContact O-CG 3.36Å; E53-Q57 PolarHBondContact O-N 3.22Å; E53-Q57 WeakPolarHBondContact OE1-CG 3.21Å; E53-Q57 PolarHBondContact OE1-NE2 3.46Å; E53-Q57 VanDerWaalsContact OE1-NE2 3.11Å; F55-Q57 VanDerWaalsContact C-N 3.34Å; F55-Q57 PolarHBondContact O-N 3.42Å; Q57-F59 VanDerWaalsContact C-N 3.31Å; Q57-F59 PolarHBondContact O-N 3.23Å; Q57-R60 PolarHBondContact O-N 2.46Å; Q57-R61 WeakPolarHBondContact O-CB 3.07Å; Q57-R61 PolarHBondContact O-N 3.06Å
58	R	69.8	Low	63.7	Low	139 Å²	139	89.3 Å²	89.3	53%	0.525	43%	0.433	S	S	.	.	H	α-helix	trans	-64.4	-34.9	173.4	-75.4	170.5	176.9	-173.5	0.6	112.4	I54 F55 R56 F62 L80	I54-R58 WeakPolarHBondContact O-CB 3.47Å; I54-R58 WeakPolarHBondContact O-CD 3.38Å; I54-R58 VanDerWaalsContact O-CG 3.23Å; I54-R58 WeakPolarHBondContact O-CG 3.36Å; I54-R58 PolarHBondContact O-N 2.91Å; I54-R58 VanDerWaalsContact O-N 3.11Å; F55-R58 PolarHBondContact O-N 3.12Å; R56-R58 PolarHBondContact O-N 2.84Å; R58-F62 PolarHBondContact O-N 3.49Å; R58-L80 HydrophobicContact CB-CD2 3.9Å
59	F	72.6	Confident	64.9	Low	60 Å²	60	84.9 Å²	84.9	26%	0.263	41%	0.409	S	S	.	.	H	α-helix	trans	-67.2	-49.9	173.2	-177.7	-97.1	0	0	0	111.4	F55 R56 Q57 R61 F62 L77 L80 W84	F55-F59 WeakPolarHBondContact O-CB 3.39Å; F55-F59 PolarHBondContact O-N 3.21Å; R56-F59 WeakPolarHBondContact O-CB 3.42Å; R56-F59 PolarHBondContact O-N 3.3Å; Q57-F59 VanDerWaalsContact C-N 3.31Å; Q57-F59 PolarHBondContact O-N 3.23Å; F59-R61 PolarHBondContact O-N 3.08Å; F59-F62 VanDerWaalsContact O-CB 3.3Å; F59-F62 WeakPolarHBondContact O-CB 3.32Å; F59-F62 PolarHBondContact O-N 3.16Å; F59-F62 VanDerWaalsContact O-N 3.13Å; F59-L77 HydrophobicContact CD2-CD1 4.12Å; F59-L77 HydrophobicContact CE2-CD1 3.6Å; F59-L80 HydrophobicContact CD2-CB 4.45Å; F59-W84 HydrophobicContact CD1-CE3 4.25Å; F59-W84 AromaticContact CD1-CZ3 3.99Å; F59-W84 HydrophobicContact CD1-CZ3 3.99Å; F59-W84 HydrophobicContact CD2-CE3 4.32Å; F59-W84 AromaticContact CE1-CZ3 3.91Å; F59-W84 HydrophobicContact CE1-CZ3 3.91Å; F59-W84 HydrophobicContact CE2-CZ3 4.49Å; F59-W84 HydrophobicContact CG-CE3 4.15Å; F59-W84 HydrophobicContact CG-CZ3 4.33Å; F59-W84 HydrophobicContact CZ-CZ3 4.17Å
60	R	67.9	Low	65.4	Low	87 Å²	87	84.2 Å²	84.2	33%	0.328	40%	0.404	S	S	.	.	H	α-helix	trans	-57	-34.2	175.6	-71.4	177.7	-175.2	160.4	6.6	113.4	E53 R56 Q57 E102	E53-R60 IonicContact OE1-NH1 3.67Å; R56-R60 WeakPolarHBondContact O-CG 3.43Å; R56-R60 PolarHBondContact O-N 2.87Å; Q57-R60 PolarHBondContact O-N 2.46Å; R60-E102 WeakPolarHBondContact CG-OE1 3.39Å; R60-E102 IonicContact CZ-OE1 3.77Å; R60-E102 IonicContact CZ-OE2 2.86Å; R60-E102 VanDerWaalsContact CZ-OE2 3.29Å; R60-E102 IonicContact NE-OE1 3.81Å; R60-E102 PolarHBondContact NE-OE1 3.48Å; R60-E102 IonicContact NE-OE2 2.67Å; R60-E102 PolarHBondContact NE-OE2 2.84Å; R60-E102 VanDerWaalsContact NE-OE2 3.11Å; R60-E102 IonicContact NH2-OE1 3.12Å; R60-E102 IonicContact NH2-OE2 3.78Å; R60-E102 PolarHBondContact NH2-OE2 3.33Å
61	R	67.1	Low	65.6	Low	214 Å²	214	91 Å²	91	81%	0.808	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	10.2	-178.8	-159	167.8	178.9	165	-0.6	114	Q57 F59 C63	Q57-R61 WeakPolarHBondContact O-CB 3.07Å; Q57-R61 PolarHBondContact O-N 3.06Å; F59-R61 PolarHBondContact O-N 3.08Å; R61-C63 PolarHBondContact O-N 2.56Å; R61-C63 VanDerWaalsContact O-N 3.15Å
62	F	75.1	Confident	66.1	Low	58 Å²	58	92.5 Å²	92.5	25%	0.254	43%	0.425	S	S	.	.			trans	-72	105.3	180	179.8	-101.3	0	0	0	112.4	R58 F59 T67 A73 R76 L77 L80	R58-F62 PolarHBondContact O-N 3.49Å; F59-F62 VanDerWaalsContact O-CB 3.3Å; F59-F62 WeakPolarHBondContact O-CB 3.32Å; F59-F62 PolarHBondContact O-N 3.16Å; F59-F62 VanDerWaalsContact O-N 3.13Å; F62-T67 HydrophobicContact CE2-CG2 4.37Å; F62-T67 HydrophobicContact CZ-CG2 4.29Å; F62-A73 HydrophobicContact CZ-CB 4.18Å; F62-R76 HydrophobicContact CE2-CB 4.09Å; F62-R76 HydrophobicContact CE2-CG 3.92Å; F62-L77 HydrophobicContact CD1-CD1 4.23Å; F62-L77 HydrophobicContact CE1-CD1 4.45Å; F62-L80 HydrophobicContact CB-CD1 4.26Å; F62-L80 HydrophobicContact CD2-CD1 3.78Å; F62-L80 HydrophobicContact CG-CD1 4.27Å
63	C	64.4	Low	66.6	Low	63 Å²	63	90.5 Å²	90.5	43%	0.426	41%	0.413	S	S	.	.			trans	-99.4	116.7	177.5	-68.6	0	0	0	0	112.1	R61 Q65 N66	R61-C63 PolarHBondContact O-N 2.56Å; R61-C63 VanDerWaalsContact O-N 3.15Å; C63-Q65 PolarHBondContact O-N 2.95Å; C63-Q65 VanDerWaalsContact O-N 3.09Å; C63-N66 PolarHBondContact O-N 3.27Å; C63-N66 VanDerWaalsContact O-N 3.11Å
64	Y	61	Low	66.6	Low	137 Å²	137	95.9 Å²	95.9	54%	0.537	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-55.7	-28.4	176.6	-174.9	-92.8	0	0	0	113.7	N66 T67 P70 A73	Y64-N66 PolarHBondContact O-N 3.44Å; Y64-T67 PolarHBondContact O-N 3.12Å; Y64-T67 PolarHBondContact O-OG1 3.27Å; Y64-P70 WeakPolarHBondContact OH-CB 3.32Å; Y64-A73 HydrophobicContact CD2-CB 3.72Å; Y64-A73 HydrophobicContact CE2-CB 3.64Å
65	Q	58.5	Low	66.9	Low	177 Å²	177	96.1 Å²	96.1	83%	0.827	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-62.5	-18.2	179.5	-65	169.8	1.5	0	0	113.7	C63	C63-Q65 PolarHBondContact O-N 2.95Å; C63-Q65 VanDerWaalsContact O-N 3.09Å
66	N	59.7	Low	67.1	Low	135 Å²	135	101.9 Å²	101.9	72%	0.722	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-102.4	28.6	-176.2	-61.4	-6.2	0	0	0	112.7	C63 Y64	C63-N66 PolarHBondContact O-N 3.27Å; C63-N66 VanDerWaalsContact O-N 3.11Å; Y64-N66 PolarHBondContact O-N 3.44Å
67	T	63.6	Low	67.3	Low	28 Å²	28	104.4 Å²	104.4	17%	0.172	48%	0.484	C	S	.	.	S	Bend	trans	-131.1	143.6	-177.4	64.8	0	0	0	0	111	F62 Y64 G69 A73	F62-T67 HydrophobicContact CE2-CG2 4.37Å; F62-T67 HydrophobicContact CZ-CG2 4.29Å; Y64-T67 PolarHBondContact O-N 3.12Å; Y64-T67 PolarHBondContact O-OG1 3.27Å; T67-G69 PolarHBondContact O-N 2.97Å; T67-G69 VanDerWaalsContact O-N 3.09Å; T67-A73 HydrophobicContact CG2-CB 4.16Å
68	F	58.3	Low	67.5	Low	201 Å²	201	108 Å²	108	88%	0.882	50%	0.498	S	S	*	.	S	Bend	trans	-78.9	15.3	-178.6	-63.6	-85.1	0	0	0	113.2	E72	F68-E72 WeakPolarHBondContact CA-OE2 3.45Å; F68-E72 WeakPolarHBondContact CB-OE2 3.36Å; F68-E72 PolarHBondContact N-OE2 3.35Å
69	G	70.7	Confident	67.9	Low	21 Å²	21	105.1 Å²	105.1	22%	0.216	49%	0.49	C	S	.	.	S	Bend	trans	150.6	172.8	167.6	0	0	0	0	0	114.9	T67 R71 E72 A73	T67-G69 PolarHBondContact O-N 2.97Å; T67-G69 VanDerWaalsContact O-N 3.09Å; G69-R71 PolarHBondContact O-N 3.41Å; G69-R71 VanDerWaalsContact O-N 3.17Å; G69-E72 PolarHBondContact O-N 2.87Å; G69-A73 PolarHBondContact O-N 3.09Å
70	P	62.6	Low	68	Low	82 Å²	82	102.7 Å²	102.7	53%	0.532	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-28.1	-173.3	23.3	-33.9	0	0	0	114.1	Y64 L74	Y64-P70 WeakPolarHBondContact OH-CB 3.32Å; P70-L74 WeakPolarHBondContact O-CB 3.32Å; P70-L74 WeakPolarHBondContact O-CD1 3.37Å; P70-L74 VanDerWaalsContact O-CG 3.25Å; P70-L74 WeakPolarHBondContact O-CG 3.47Å; P70-L74 PolarHBondContact O-N 2.98Å; P70-L74 VanDerWaalsContact O-N 3.15Å
71	R	62.8	Low	68.2	Low	217 Å²	217	100.4 Å²	100.4	82%	0.819	48%	0.477	S	S	*	.	H	α-helix	trans	-71.6	-43.1	178.6	-175.8	179.6	-114.5	-144.6	-2.1	111.5	G69 S75	G69-R71 PolarHBondContact O-N 3.41Å; G69-R71 VanDerWaalsContact O-N 3.17Å; R71-S75 PolarHBondContact O-N 3.17Å; R71-S75 VanDerWaalsContact O-N 3.08Å; R71-S75 PolarHBondContact O-OG 3.3Å; R71-S75 VanDerWaalsContact O-OG 3.08Å
72	E	71.9	Confident	68.5	Low	94 Å²	94	94.3 Å²	94.3	44%	0.439	46%	0.458	S	S	.	.	H	α-helix	trans	-69.8	-42.4	177.3	-173.5	-177.9	-144.1	0	0	110.9	F68 G69 L74 S75 R76	F68-E72 WeakPolarHBondContact CA-OE2 3.45Å; F68-E72 WeakPolarHBondContact CB-OE2 3.36Å; F68-E72 PolarHBondContact N-OE2 3.35Å; G69-E72 PolarHBondContact O-N 2.87Å; E72-L74 VanDerWaalsContact C-N 3.3Å; E72-L74 PolarHBondContact O-N 3.22Å; E72-S75 PolarHBondContact O-N 3.14Å; E72-S75 VanDerWaalsContact O-N 3.13Å; E72-R76 WeakPolarHBondContact O-CB 3.02Å; E72-R76 PolarHBondContact O-N 3.38Å
73	A	70.8	Confident	68.5	Low	4 Å²	4	94.2 Å²	94.2	3%	0.033	46%	0.458	C	S	.	.	H	α-helix	trans	-54.8	-44.3	173.9	0	0	0	0	0	112.5	F62 Y64 T67 G69 L77	F62-A73 HydrophobicContact CZ-CB 4.18Å; Y64-A73 HydrophobicContact CD2-CB 3.72Å; Y64-A73 HydrophobicContact CE2-CB 3.64Å; T67-A73 HydrophobicContact CG2-CB 4.16Å; G69-A73 PolarHBondContact O-N 3.09Å; A73-L77 VanDerWaalsContact O-CB 3.23Å; A73-L77 WeakPolarHBondContact O-CB 3.43Å; A73-L77 PolarHBondContact O-N 3.14Å
74	L	68.3	Low	69	Low	120 Å²	120	91.5 Å²	91.5	63%	0.628	44%	0.439	S	S	*	.	H	α-helix	trans	-68.4	-38.3	176.5	-73.7	170.2	0	0	0	112.7	P70 E72 K78	P70-L74 WeakPolarHBondContact O-CB 3.32Å; P70-L74 WeakPolarHBondContact O-CD1 3.37Å; P70-L74 VanDerWaalsContact O-CG 3.25Å; P70-L74 WeakPolarHBondContact O-CG 3.47Å; P70-L74 PolarHBondContact O-N 2.98Å; P70-L74 VanDerWaalsContact O-N 3.15Å; E72-L74 VanDerWaalsContact C-N 3.3Å; E72-L74 PolarHBondContact O-N 3.22Å; L74-K78 WeakPolarHBondContact O-CB 3.48Å; L74-K78 PolarHBondContact O-N 3.14Å
75	S	74.6	Confident	69.7	Low	75 Å²	75	86.3 Å²	86.3	52%	0.524	42%	0.42	S	S	.	.	H	α-helix	trans	-64.5	-43.9	174.6	-62.1	0	0	0	0	111.6	R71 E72 K78 E79	R71-S75 PolarHBondContact O-N 3.17Å; R71-S75 VanDerWaalsContact O-N 3.08Å; R71-S75 PolarHBondContact O-OG 3.3Å; R71-S75 VanDerWaalsContact O-OG 3.08Å; E72-S75 PolarHBondContact O-N 3.14Å; E72-S75 VanDerWaalsContact O-N 3.13Å; S75-K78 PolarHBondContact O-N 3.05Å; S75-E79 PolarHBondContact O-N 3.2Å
76	R	72.4	Confident	70.5	Confident	138 Å²	138	80 Å²	80	52%	0.521	39%	0.388	S	S	.	.	H	α-helix	trans	-69.1	-36.9	178.5	-168.9	57.1	166.5	175.8	-3.9	112.3	F62 E72 E79 L80	F62-R76 HydrophobicContact CE2-CB 4.09Å; F62-R76 HydrophobicContact CE2-CG 3.92Å; E72-R76 WeakPolarHBondContact O-CB 3.02Å; E72-R76 PolarHBondContact O-N 3.38Å; R76-E79 PolarHBondContact O-N 3.34Å; R76-L80 WeakPolarHBondContact O-CG 3.45Å; R76-L80 PolarHBondContact O-N 3.17Å
77	L	73.6	Confident	70.9	Confident	57 Å²	57	76.7 Å²	76.7	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-43.2	172.7	-173.8	67.1	0	0	0	111.4	F59 F62 A73 E79 L80 C81	F59-L77 HydrophobicContact CD2-CD1 4.12Å; F59-L77 HydrophobicContact CE2-CD1 3.6Å; F62-L77 HydrophobicContact CD1-CD1 4.23Å; F62-L77 HydrophobicContact CE1-CD1 4.45Å; A73-L77 VanDerWaalsContact O-CB 3.23Å; A73-L77 WeakPolarHBondContact O-CB 3.43Å; A73-L77 PolarHBondContact O-N 3.14Å; L77-E79 VanDerWaalsContact C-N 3.31Å; L77-E79 PolarHBondContact O-N 3.3Å; L77-L80 PolarHBondContact O-N 3.11Å; L77-C81 PolarHBondContact O-N 3.41Å; L77-C81 PolarHBondContact O-SG 3.5Å
78	K	72.3	Confident	71.3	Confident	161 Å²	161	81.3 Å²	81.3	70%	0.7	39%	0.394	S	S	*	.	H	α-helix	trans	-57.5	-45.9	174.6	-174.1	-169.9	175.2	-164.3	0	111	L74 S75 C81 H82	L74-K78 WeakPolarHBondContact O-CB 3.48Å; L74-K78 PolarHBondContact O-N 3.14Å; S75-K78 PolarHBondContact O-N 3.05Å; K78-C81 PolarHBondContact O-N 2.8Å; K78-H82 WeakPolarHBondContact O-CB 3.33Å; K78-H82 PolarHBondContact O-N 3.4Å
79	E	77.7	Confident	71.9	Confident	79 Å²	79	77.7 Å²	77.7	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-60.5	-48.1	177.9	-171.9	58.1	-149.5	0	0	111.9	S75 R76 L77 C81 H82 Q83	S75-E79 PolarHBondContact O-N 3.2Å; R76-E79 PolarHBondContact O-N 3.34Å; L77-E79 VanDerWaalsContact C-N 3.31Å; L77-E79 PolarHBondContact O-N 3.3Å; E79-C81 PolarHBondContact O-N 3.06Å; E79-H82 WeakPolarHBondContact O-CB 3.36Å; E79-H82 PolarHBondContact O-N 3.34Å; E79-Q83 WeakPolarHBondContact O-CG 2.99Å; E79-Q83 PolarHBondContact O-N 3.16Å; E79-Q83 PolarHBondContact OE1-NE2 3.27Å
80	L	73.8	Confident	71.9	Confident	9 Å²	9	78.8 Å²	78.8	5%	0.047	38%	0.384	C	S	.	.	H	α-helix	trans	-62.5	-41.4	177.2	-70.9	171.5	0	0	0	112.5	R58 F59 F62 R76 L77 H82 Q83 W84	R58-L80 HydrophobicContact CB-CD2 3.9Å; F59-L80 HydrophobicContact CD2-CB 4.45Å; F62-L80 HydrophobicContact CB-CD1 4.26Å; F62-L80 HydrophobicContact CD2-CD1 3.78Å; F62-L80 HydrophobicContact CG-CD1 4.27Å; R76-L80 WeakPolarHBondContact O-CG 3.45Å; R76-L80 PolarHBondContact O-N 3.17Å; L77-L80 PolarHBondContact O-N 3.11Å; L80-H82 VanDerWaalsContact C-N 3.31Å; L80-H82 PolarHBondContact O-N 3.4Å; L80-Q83 PolarHBondContact O-N 3.26Å; L80-W84 VanDerWaalsContact O-CB 3.3Å; L80-W84 WeakPolarHBondContact O-CB 3.21Å; L80-W84 PolarHBondContact O-N 2.98Å
81	C	72.6	Confident	72.7	Confident	39 Å²	39	78 Å²	78	26%	0.264	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-37.7	174.3	-69.1	0	0	0	0	112.3	L77 K78 E79 L85	L77-C81 PolarHBondContact O-N 3.41Å; L77-C81 PolarHBondContact O-SG 3.5Å; K78-C81 PolarHBondContact O-N 2.8Å; E79-C81 PolarHBondContact O-N 3.06Å; C81-L85 VanDerWaalsContact O-CB 3.26Å; C81-L85 WeakPolarHBondContact O-CB 3.45Å; C81-L85 WeakPolarHBondContact O-CG 3.36Å; C81-L85 PolarHBondContact O-N 3.16Å
82	H	72.9	Confident	72.9	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.398	37%	0.372	S	S	.	.	H	α-helix	trans	-69.2	-47	179.4	-159.4	44.7	0	0	0	110.9	K78 E79 L80 W84 R86 E88	K78-H82 WeakPolarHBondContact O-CB 3.33Å; K78-H82 PolarHBondContact O-N 3.4Å; E79-H82 WeakPolarHBondContact O-CB 3.36Å; E79-H82 PolarHBondContact O-N 3.34Å; L80-H82 VanDerWaalsContact C-N 3.31Å; L80-H82 PolarHBondContact O-N 3.4Å; H82-W84 VanDerWaalsContact C-N 3.33Å; H82-W84 PolarHBondContact O-N 3.1Å; H82-R86 WeakPolarHBondContact O-CA 3.48Å; H82-R86 PolarHBondContact O-N 3.15Å; H82-E88 IonicContact CE1-OE1 3.11Å; H82-E88 PolarHBondContact CE1-OE1 3.25Å; H82-E88 IonicContact ND1-OE1 3.29Å; H82-E88 IonicContact NE2-OE1 3.94Å
83	Q	76	Confident	73	Confident	55 Å²	55	76.8 Å²	76.8	26%	0.257	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-32.7	178.2	-66.5	177.5	4.1	0	0	113.5	F55 E79 L80 R86	F55-Q83 HydrophobicContact CD1-CB 3.46Å; F55-Q83 VanDerWaalsContact CD1-CB 3.46Å; F55-Q83 HydrophobicContact CD1-CG 4.39Å; F55-Q83 HydrophobicContact CE1-CB 3.73Å; F55-Q83 HydrophobicContact CE1-CG 4.26Å; F55-Q83 VanDerWaalsContact CE1-OE1 3.26Å; F55-Q83 HydrophobicContact CG-CB 4.16Å; E79-Q83 WeakPolarHBondContact O-CG 2.99Å; E79-Q83 PolarHBondContact O-N 3.16Å; E79-Q83 PolarHBondContact OE1-NE2 3.27Å; L80-Q83 PolarHBondContact O-N 3.26Å; Q83-R86 WeakPolarHBondContact O-CG 3.37Å; Q83-R86 PolarHBondContact O-NE 3.41Å
84	W	75.6	Confident	73	Confident	7 Å²	7	81.1 Å²	81.1	3%	0.027	40%	0.398	C	S	.	.	H	α-helix	trans	-77	-55.8	174.8	169.3	31.1	0	0	0	112.4	F55 R56 F59 L80 H82 L99 E102	F55-W84 HydrophobicContact CB-CB 3.96Å; R56-W84 HydrophobicContact CG-CD2 4.48Å; R56-W84 HydrophobicContact CG-CG 4.31Å; R56-W84 VanDerWaalsContact CG-NE1 3.28Å; F59-W84 HydrophobicContact CD1-CE3 4.25Å; F59-W84 AromaticContact CD1-CZ3 3.99Å; F59-W84 HydrophobicContact CD1-CZ3 3.99Å; F59-W84 HydrophobicContact CD2-CE3 4.32Å; F59-W84 AromaticContact CE1-CZ3 3.91Å; F59-W84 HydrophobicContact CE1-CZ3 3.91Å; F59-W84 HydrophobicContact CE2-CZ3 4.49Å; F59-W84 HydrophobicContact CG-CE3 4.15Å; F59-W84 HydrophobicContact CG-CZ3 4.33Å; F59-W84 HydrophobicContact CZ-CZ3 4.17Å; L80-W84 VanDerWaalsContact O-CB 3.3Å; L80-W84 WeakPolarHBondContact O-CB 3.21Å; L80-W84 PolarHBondContact O-N 2.98Å; H82-W84 VanDerWaalsContact C-N 3.33Å; H82-W84 PolarHBondContact O-N 3.1Å; W84-L99 HydrophobicContact CH2-CD2 3.81Å; W84-L99 HydrophobicContact CZ3-CD2 4.14Å; W84-E102 HydrophobicContact CH2-CB 3.7Å; W84-E102 HydrophobicContact CH2-CG 3.78Å; W84-E102 HydrophobicContact CZ2-CB 3.77Å; W84-E102 HydrophobicContact CZ2-CG 4.18Å
85	L	74.8	Confident	73.4	Confident	27 Å²	27	77 Å²	77	14%	0.141	38%	0.377	C	S	.	.	H	α-helix	trans	-81.4	-16	-170.8	-60.6	175.1	0	0	0	113.6	C81 N90 I95 L98 L99	C81-L85 VanDerWaalsContact O-CB 3.26Å; C81-L85 WeakPolarHBondContact O-CB 3.45Å; C81-L85 WeakPolarHBondContact O-CG 3.36Å; C81-L85 PolarHBondContact O-N 3.16Å; L85-N90 PolarHBondContact O-ND2 3.03Å; L85-I95 HydrophobicContact CD1-CG2 4.37Å; L85-I95 HydrophobicContact CD2-CG2 4.43Å; L85-L98 HydrophobicContact CD2-CB 4.28Å; L85-L99 HydrophobicContact CD1-CD2 4.36Å; L85-L99 HydrophobicContact CD2-CD2 4.16Å; L85-L99 HydrophobicContact CD2-CG 4.23Å
86	R	75	Confident	73.3	Confident	44 Å²	44	78.5 Å²	78.5	17%	0.166	38%	0.378	C	S	.	.			trans	36.5	62.5	177.8	-60.3	-172.8	-177.3	167.6	1.5	113.6	P50 F55 H82 Q83 E88 I89 N90	P50-R86 PolarHBondContact O-NH2 3.01Å; F55-R86 VanDerWaalsContact CE2-NH2 3.29Å; H82-R86 WeakPolarHBondContact O-CA 3.48Å; H82-R86 PolarHBondContact O-N 3.15Å; Q83-R86 WeakPolarHBondContact O-CG 3.37Å; Q83-R86 PolarHBondContact O-NE 3.41Å; R86-E88 WeakPolarHBondContact CA-OE2 3.47Å; R86-E88 PolarHBondContact O-N 2.9Å; R86-I89 PolarHBondContact O-N 3.13Å; R86-N90 PolarHBondContact O-N 3.48Å
87	P	68.1	Low	73.5	Confident	66 Å²	66	76.3 Å²	76.3	43%	0.429	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-4.5	-176.2	28.1	-34	0	0	0	114.2	I89 I95	P87-I89 VanDerWaalsContact C-N 3.34Å; P87-I95 HydrophobicContact CB-CD1 4.02Å
88	E	72.9	Confident	73.6	Confident	126 Å²	126	74.7 Å²	74.7	59%	0.589	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-24.4	170.1	-58.1	62.7	-129.2	0	0	112.4	H82 R86	H82-E88 IonicContact CE1-OE1 3.11Å; H82-E88 PolarHBondContact CE1-OE1 3.25Å; H82-E88 IonicContact ND1-OE1 3.29Å; H82-E88 IonicContact NE2-OE1 3.94Å; R86-E88 WeakPolarHBondContact CA-OE2 3.47Å; R86-E88 PolarHBondContact O-N 2.9Å
89	I	70.4	Confident	73.8	Confident	125 Å²	125	70.6 Å²	70.6	64%	0.641	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-41.5	-171.1	-55.9	176.1	0	0	0	110.9	R86 P87	R86-I89 PolarHBondContact O-N 3.13Å; P87-I89 VanDerWaalsContact C-N 3.34Å
90	N	71.9	Confident	73.7	Confident	44 Å²	44	70.6 Å²	70.6	24%	0.235	36%	0.355	C	S	.	.	S	Bend	trans	-85.7	137.1	-174.9	-66.5	-36.5	0	0	0	112.4	L85 R86 Q94 I95	L85-N90 PolarHBondContact O-ND2 3.03Å; R86-N90 PolarHBondContact O-N 3.48Å; N90-Q94 HydrophobicContact CB-CB 4.17Å; N90-I95 HydrophobicContact CB-CD1 4.34Å; N90-I95 HydrophobicContact CB-CG1 3.78Å
91	T	78.4	Confident	73.9	Confident	65 Å²	65	70.2 Å²	70.2	40%	0.399	35%	0.354	S	S	.	.			trans	-70.1	168.1	171.4	83.2	0	0	0	0	111.5	E93 Q94 I95	T91-E93 WeakPolarHBondContact CB-OE2 3.5Å; T91-E93 PolarHBondContact O-N 3.29Å; T91-E93 PolarHBondContact OG1-N 2.84Å; T91-E93 PolarHBondContact OG1-OE2 2.91Å; T91-Q94 PolarHBondContact O-N 3.41Å; T91-Q94 PolarHBondContact OG1-N 2.88Å; T91-I95 VanDerWaalsContact O-CG1 3.3Å; T91-I95 WeakPolarHBondContact O-CG1 3.48Å; T91-I95 PolarHBondContact O-N 2.9Å
92	K	66.6	Low	74.1	Confident	163 Å²	163	69.5 Å²	69.5	71%	0.709	35%	0.346	S	S	*	.	H	α-helix	trans	-61	-35.4	179.2	-68.8	177.2	-178.3	172	0	112	L96	K92-L96 VanDerWaalsContact O-CG 3.26Å; K92-L96 WeakPolarHBondContact O-CG 3.43Å; K92-L96 PolarHBondContact O-N 3Å
93	E	74.6	Confident	74.3	Confident	123 Å²	123	70.7 Å²	70.7	58%	0.575	35%	0.352	S	S	*	.	H	α-helix	trans	-67.8	-48.4	178.7	-57	67.4	-144.1	0	0	109.6	T91 I95 L96 E97	T91-E93 WeakPolarHBondContact CB-OE2 3.5Å; T91-E93 PolarHBondContact O-N 3.29Å; T91-E93 PolarHBondContact OG1-N 2.84Å; T91-E93 PolarHBondContact OG1-OE2 2.91Å; E93-I95 VanDerWaalsContact C-N 3.35Å; E93-I95 PolarHBondContact O-N 2.77Å; E93-L96 WeakPolarHBondContact O-CB 3.35Å; E93-L96 PolarHBondContact O-N 2.79Å; E93-L96 VanDerWaalsContact O-N 3.08Å; E93-E97 PolarHBondContact O-N 3.17Å
94	Q	70.9	Confident	74.2	Confident	95 Å²	95	71 Å²	71	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-39.3	175.6	-67.6	169.8	-26.9	0	0	112.5	N90 T91 L96 E97 L98	N90-Q94 HydrophobicContact CB-CB 4.17Å; T91-Q94 PolarHBondContact O-N 3.41Å; T91-Q94 PolarHBondContact OG1-N 2.88Å; Q94-L96 VanDerWaalsContact C-N 3.31Å; Q94-L96 PolarHBondContact O-N 3.08Å; Q94-E97 PolarHBondContact O-N 3.16Å; Q94-L98 VanDerWaalsContact O-CG 3.32Å; Q94-L98 WeakPolarHBondContact O-CG 3.39Å; Q94-L98 PolarHBondContact O-N 3.4Å
95	I	76	Confident	74	Confident	34 Å²	34	71.2 Å²	71.2	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-63.6	-38	173.7	-68.5	166.4	0	0	0	111.2	L85 P87 N90 T91 E93 L99	L85-I95 HydrophobicContact CD1-CG2 4.37Å; L85-I95 HydrophobicContact CD2-CG2 4.43Å; P87-I95 HydrophobicContact CB-CD1 4.02Å; N90-I95 HydrophobicContact CB-CD1 4.34Å; N90-I95 HydrophobicContact CB-CG1 3.78Å; T91-I95 VanDerWaalsContact O-CG1 3.3Å; T91-I95 WeakPolarHBondContact O-CG1 3.48Å; T91-I95 PolarHBondContact O-N 2.9Å; E93-I95 VanDerWaalsContact C-N 3.35Å; E93-I95 PolarHBondContact O-N 2.77Å; I95-L99 HydrophobicContact CG2-CD1 4.13Å; I95-L99 WeakPolarHBondContact O-CD1 3.5Å; I95-L99 VanDerWaalsContact O-CG 3.24Å; I95-L99 WeakPolarHBondContact O-CG 3.4Å; I95-L99 PolarHBondContact O-N 3.02Å; I95-L99 VanDerWaalsContact O-N 3.15Å
96	L	72.6	Confident	73.8	Confident	106 Å²	106	73 Å²	73	56%	0.555	37%	0.369	S	S	*	.	H	α-helix	trans	-67.3	-43.5	175.4	-72.9	168.3	0	0	0	111.4	K92 E93 Q94 L98 L99 V100	K92-L96 VanDerWaalsContact O-CG 3.26Å; K92-L96 WeakPolarHBondContact O-CG 3.43Å; K92-L96 PolarHBondContact O-N 3Å; E93-L96 WeakPolarHBondContact O-CB 3.35Å; E93-L96 PolarHBondContact O-N 2.79Å; E93-L96 VanDerWaalsContact O-N 3.08Å; Q94-L96 VanDerWaalsContact C-N 3.31Å; Q94-L96 PolarHBondContact O-N 3.08Å; L96-L98 PolarHBondContact O-N 3.11Å; L96-L99 PolarHBondContact O-N 2.83Å; L96-V100 VanDerWaalsContact O-CG2 3.32Å; L96-V100 WeakPolarHBondContact O-CG2 3.16Å; L96-V100 PolarHBondContact O-N 3.29Å
97	E	77.1	Confident	73.8	Confident	92 Å²	92	76.9 Å²	76.9	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-60.5	-43.7	175.2	-71.3	-52.1	131.8	0	0	112.4	E93 Q94 L99 V100 L101	E93-E97 PolarHBondContact O-N 3.17Å; Q94-E97 PolarHBondContact O-N 3.16Å; E97-L99 VanDerWaalsContact C-N 3.29Å; E97-L99 PolarHBondContact O-N 2.88Å; E97-V100 PolarHBondContact O-N 3.33Å; E97-L101 WeakPolarHBondContact O-CB 3.46Å; E97-L101 PolarHBondContact O-N 3.46Å
98	L	74.8	Confident	74	Confident	22 Å²	22	75.1 Å²	75.1	12%	0.115	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-37.2	174.7	-72.3	170.2	0	0	0	112.7	R56 L85 Q94 L96 E102	R56-L98 VanDerWaalsContact NH2-CD2 3.35Å; L85-L98 HydrophobicContact CD2-CB 4.28Å; Q94-L98 VanDerWaalsContact O-CG 3.32Å; Q94-L98 WeakPolarHBondContact O-CG 3.39Å; Q94-L98 PolarHBondContact O-N 3.4Å; L96-L98 PolarHBondContact O-N 3.11Å; L98-E102 PolarHBondContact O-N 2.89Å; L98-E102 VanDerWaalsContact O-N 3.14Å
99	L	76.8	Confident	74	Confident	75 Å²	75	72.5 Å²	72.5	39%	0.393	37%	0.373	S	S	.	.	H	α-helix	trans	-74	-35.6	176.2	-70.5	169.3	0	0	0	112.6	W84 L85 I95 L96 E97 Q103	W84-L99 HydrophobicContact CH2-CD2 3.81Å; W84-L99 HydrophobicContact CZ3-CD2 4.14Å; L85-L99 HydrophobicContact CD1-CD2 4.36Å; L85-L99 HydrophobicContact CD2-CD2 4.16Å; L85-L99 HydrophobicContact CD2-CG 4.23Å; I95-L99 HydrophobicContact CG2-CD1 4.13Å; I95-L99 WeakPolarHBondContact O-CD1 3.5Å; I95-L99 VanDerWaalsContact O-CG 3.24Å; I95-L99 WeakPolarHBondContact O-CG 3.4Å; I95-L99 PolarHBondContact O-N 3.02Å; I95-L99 VanDerWaalsContact O-N 3.15Å; L96-L99 PolarHBondContact O-N 2.83Å; E97-L99 VanDerWaalsContact C-N 3.29Å; E97-L99 PolarHBondContact O-N 2.88Å; L99-Q103 WeakPolarHBondContact O-CB 3.47Å; L99-Q103 PolarHBondContact O-N 3.06Å; L99-Q103 VanDerWaalsContact O-N 3.08Å
100	V	76.1	Confident	73.9	Confident	79 Å²	79	74 Å²	74	48%	0.479	38%	0.375	S	S	.	.	H	α-helix	trans	-66.8	-45	174.5	167.8	0	0	0	0	110.2	L96 E97 Q103 F104	L96-V100 VanDerWaalsContact O-CG2 3.32Å; L96-V100 WeakPolarHBondContact O-CG2 3.16Å; L96-V100 PolarHBondContact O-N 3.29Å; E97-V100 PolarHBondContact O-N 3.33Å; V100-Q103 CarbonylContact O-C 3.58Å; V100-Q103 PolarHBondContact O-N 2.83Å; V100-F104 WeakPolarHBondContact O-CB 3.39Å; V100-F104 PolarHBondContact O-N 3.16Å
101	L	77.6	Confident	73.9	Confident	1 Å²	1	78.6 Å²	78.6	1%	0.005	40%	0.395	C	S	.	.	H	α-helix	trans	-59.1	-47.2	175.4	174.5	60.7	0	0	0	112	E97 Q103 F104 L105 P121 A127	E97-L101 WeakPolarHBondContact O-CB 3.46Å; E97-L101 PolarHBondContact O-N 3.46Å; L101-Q103 VanDerWaalsContact C-N 3.32Å; L101-Q103 PolarHBondContact O-N 2.87Å; L101-F104 WeakPolarHBondContact O-CB 3.33Å; L101-F104 PolarHBondContact O-N 3Å; L101-L105 HydrophobicContact CD1-CD1 3.83Å; L101-L105 HydrophobicContact CD1-CG 3.93Å; L101-L105 HydrophobicContact CG-CD1 4.01Å; L101-L105 HydrophobicContact CG-CG 4.47Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 WeakPolarHBondContact O-CG 3.32Å; L101-L105 PolarHBondContact O-N 2.87Å; L101-P121 HydrophobicContact CD1-CB 4.47Å; L101-P121 HydrophobicContact CD1-CG 4.2Å; L101-P121 WeakPolarHBondContact CD2-O 3.29Å; L101-A127 HydrophobicContact CD1-CB 3.64Å
102	E	78	Confident	73.5	Confident	24 Å²	24	78.1 Å²	78.1	11%	0.112	39%	0.389	C	S	.	.	H	α-helix	trans	-62.3	-40.7	176.2	-178.1	62.4	-165	0	0	111.7	R60 W84 L98 S106	R60-E102 WeakPolarHBondContact CG-OE1 3.39Å; R60-E102 IonicContact CZ-OE1 3.77Å; R60-E102 IonicContact CZ-OE2 2.86Å; R60-E102 VanDerWaalsContact CZ-OE2 3.29Å; R60-E102 IonicContact NE-OE1 3.81Å; R60-E102 PolarHBondContact NE-OE1 3.48Å; R60-E102 IonicContact NE-OE2 2.67Å; R60-E102 PolarHBondContact NE-OE2 2.84Å; R60-E102 VanDerWaalsContact NE-OE2 3.11Å; R60-E102 IonicContact NH2-OE1 3.12Å; R60-E102 IonicContact NH2-OE2 3.78Å; R60-E102 PolarHBondContact NH2-OE2 3.33Å; W84-E102 HydrophobicContact CH2-CB 3.7Å; W84-E102 HydrophobicContact CH2-CG 3.78Å; W84-E102 HydrophobicContact CZ2-CB 3.77Å; W84-E102 HydrophobicContact CZ2-CG 4.18Å; L98-E102 PolarHBondContact O-N 2.89Å; L98-E102 VanDerWaalsContact O-N 3.14Å; E102-S106 WeakPolarHBondContact O-CB 3.44Å; E102-S106 PolarHBondContact O-N 3.21Å; E102-S106 PolarHBondContact O-OG 3.07Å
103	Q	76.4	Confident	73.8	Confident	112 Å²	112	72.5 Å²	72.5	52%	0.523	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-39.1	176	-176.8	58.1	87.3	0	0	111.8	L99 V100 L101 S106 I107	L99-Q103 WeakPolarHBondContact O-CB 3.47Å; L99-Q103 PolarHBondContact O-N 3.06Å; L99-Q103 VanDerWaalsContact O-N 3.08Å; V100-Q103 CarbonylContact O-C 3.58Å; V100-Q103 PolarHBondContact O-N 2.83Å; L101-Q103 VanDerWaalsContact C-N 3.32Å; L101-Q103 PolarHBondContact O-N 2.87Å; Q103-S106 PolarHBondContact NE2-OG 3.03Å; Q103-S106 PolarHBondContact O-OG 2.84Å; Q103-I107 HydrophobicContact CG-CD1 4.35Å; Q103-I107 WeakPolarHBondContact O-CD1 3.22Å; Q103-I107 WeakPolarHBondContact O-CG1 3.43Å
104	F	72.7	Confident	73.7	Confident	61 Å²	61	71.2 Å²	71.2	27%	0.268	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-54.5	175.8	-179.8	-104.6	0	0	0	111.1	V100 L101 S106 I107 L108 A127 V128 L131	V100-F104 WeakPolarHBondContact O-CB 3.39Å; V100-F104 PolarHBondContact O-N 3.16Å; L101-F104 WeakPolarHBondContact O-CB 3.33Å; L101-F104 PolarHBondContact O-N 3Å; F104-S106 PolarHBondContact O-N 3.02Å; F104-I107 PolarHBondContact O-N 3.34Å; F104-L108 HydrophobicContact CD1-CD1 4.24Å; F104-L108 HydrophobicContact CE1-CD1 3.93Å; F104-L108 HydrophobicContact CZ-CD2 4.38Å; F104-L108 PolarHBondContact O-N 3.5Å; F104-A127 HydrophobicContact CD1-CB 4.01Å; F104-A127 HydrophobicContact CE1-CB 3.86Å; F104-V128 HydrophobicContact CE1-CG2 4.24Å; F104-V128 HydrophobicContact CE2-CG2 3.99Å; F104-V128 HydrophobicContact CZ-CG2 3.64Å; F104-L131 HydrophobicContact CE1-CD1 3.82Å; F104-L131 HydrophobicContact CZ-CD1 3.71Å
105	L	72.3	Confident	73.9	Confident	12 Å²	12	69.6 Å²	69.6	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-56.1	-39.4	177.9	-68.1	173.9	0	0	0	111.6	L101 I107 L108 Q113 L116	L101-L105 HydrophobicContact CD1-CD1 3.83Å; L101-L105 HydrophobicContact CD1-CG 3.93Å; L101-L105 HydrophobicContact CG-CD1 4.01Å; L101-L105 HydrophobicContact CG-CG 4.47Å; L101-L105 WeakPolarHBondContact O-CB 3.47Å; L101-L105 WeakPolarHBondContact O-CG 3.32Å; L101-L105 PolarHBondContact O-N 2.87Å; L105-I107 PolarHBondContact O-N 3.12Å; L105-L108 HydrophobicContact CD2-CD1 4.17Å; L105-L108 PolarHBondContact O-N 3.23Å; L105-Q113 WeakPolarHBondContact O-CG 3.47Å; L105-Q113 PolarHBondContact O-NE2 2.84Å; L105-L116 HydrophobicContact CD2-CB 4.12Å; L105-L116 HydrophobicContact CD2-CD1 3.63Å
106	S	71.7	Confident	73.8	Confident	64 Å²	64	68.1 Å²	68.1	45%	0.448	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.5	178.6	76.8	0	0	0	0	115.6	E102 Q103 F104	E102-S106 WeakPolarHBondContact O-CB 3.44Å; E102-S106 PolarHBondContact O-N 3.21Å; E102-S106 PolarHBondContact O-OG 3.07Å; Q103-S106 PolarHBondContact NE2-OG 3.03Å; Q103-S106 PolarHBondContact O-OG 2.84Å; F104-S106 PolarHBondContact O-N 3.02Å
107	I	73.8	Confident	73.6	Confident	126 Å²	126	66.5 Å²	66.5	65%	0.646	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-24.8	-178.7	-68	163.8	0	0	0	111.7	Q103 F104 L105	Q103-I107 HydrophobicContact CG-CD1 4.35Å; Q103-I107 WeakPolarHBondContact O-CD1 3.22Å; Q103-I107 WeakPolarHBondContact O-CG1 3.43Å; F104-I107 PolarHBondContact O-N 3.34Å; L105-I107 PolarHBondContact O-N 3.12Å
108	L	71.5	Confident	73.4	Confident	28 Å²	28	69 Å²	69	15%	0.147	35%	0.349	C	S	.	.	S	Bend	trans	-66.9	151.3	-176.9	-66.2	173.7	0	0	0	112.9	F104 L105 L112 Q113 L116 L131	F104-L108 HydrophobicContact CD1-CD1 4.24Å; F104-L108 HydrophobicContact CE1-CD1 3.93Å; F104-L108 HydrophobicContact CZ-CD2 4.38Å; F104-L108 PolarHBondContact O-N 3.5Å; L105-L108 HydrophobicContact CD2-CD1 4.17Å; L105-L108 PolarHBondContact O-N 3.23Å; L108-L112 HydrophobicContact CB-CB 4.5Å; L108-Q113 HydrophobicContact CB-CG 4Å; L108-Q113 PolarHBondContact O-NE2 2.98Å; L108-L116 HydrophobicContact CD1-CD1 3.39Å; L108-L131 HydrophobicContact CD1-CD1 3.95Å; L108-L131 HydrophobicContact CD2-CD1 3.95Å
109	P	73.1	Confident	73.1	Confident	72 Å²	72	74 Å²	74	47%	0.468	37%	0.367	S	S	.	.			trans	-51.4	147.1	165.8	-24.9	33.9	0	0	0	111.9	E111 L112 Q113	P109-E111 WeakPolarHBondContact CB-OE2 3.48Å; P109-E111 PolarHBondContact O-N 2.83Å; P109-E111 VanDerWaalsContact O-N 3.16Å; P109-L112 HydrophobicContact CG-CD1 4.31Å; P109-L112 PolarHBondContact O-N 2.86Å; P109-L112 VanDerWaalsContact O-N 3.1Å; P109-Q113 WeakPolarHBondContact O-CG 3.43Å; P109-Q113 PolarHBondContact O-N 2.7Å
110	K	69.4	Low	72.8	Confident	156 Å²	156	76.3 Å²	76.3	68%	0.678	37%	0.371	S	S	*	.	H	α-helix	trans	-61.4	-30.4	-174.6	-70.4	-179	178.9	177.4	0	112.6	Q113 V114	K110-Q113 PolarHBondContact O-N 3.27Å; K110-V114 WeakPolarHBondContact O-CG2 3.43Å; K110-V114 PolarHBondContact O-N 3.3Å
111	E	72.1	Confident	72.6	Confident	141 Å²	141	72.7 Å²	72.7	66%	0.659	35%	0.349	S	S	*	.	H	α-helix	trans	-64.4	-47	179	-58.8	67.8	-148.5	0	0	109.8	P109 V114 W115	P109-E111 WeakPolarHBondContact CB-OE2 3.48Å; P109-E111 PolarHBondContact O-N 2.83Å; P109-E111 VanDerWaalsContact O-N 3.16Å; E111-V114 PolarHBondContact O-N 2.68Å; E111-W115 PolarHBondContact O-N 3.21Å; E111-W115 VanDerWaalsContact O-N 3.16Å
112	L	70.4	Confident	72	Confident	55 Å²	55	77.8 Å²	77.8	29%	0.288	38%	0.376	S	S	.	.	H	α-helix	trans	-74	-30.7	174.6	-65.3	178.4	0	0	0	112.7	L108 P109 W115 L116 L131 L134	L108-L112 HydrophobicContact CB-CB 4.5Å; P109-L112 HydrophobicContact CG-CD1 4.31Å; P109-L112 PolarHBondContact O-N 2.86Å; P109-L112 VanDerWaalsContact O-N 3.1Å; L112-W115 PolarHBondContact O-N 3.31Å; L112-L116 WeakPolarHBondContact O-CB 3.38Å; L112-L116 PolarHBondContact O-N 3.24Å; L112-L131 HydrophobicContact CB-CD2 4.42Å; L112-L131 HydrophobicContact CD1-CD2 4.21Å; L112-L131 HydrophobicContact CD2-CD2 4.12Å; L112-L131 HydrophobicContact CG-CD2 4.49Å; L112-L134 HydrophobicContact CD2-CD2 3.61Å
113	Q	71.3	Confident	71.8	Confident	44 Å²	44	78.3 Å²	78.3	21%	0.206	38%	0.383	C	S	.	.	H	α-helix	trans	-62.8	-41.7	171.8	-72.5	176.6	-11.4	0	0	112.1	L105 L108 P109 K110 Q117	L105-Q113 WeakPolarHBondContact O-CG 3.47Å; L105-Q113 PolarHBondContact O-NE2 2.84Å; L108-Q113 HydrophobicContact CB-CG 4Å; L108-Q113 PolarHBondContact O-NE2 2.98Å; P109-Q113 WeakPolarHBondContact O-CG 3.43Å; P109-Q113 PolarHBondContact O-N 2.7Å; K110-Q113 PolarHBondContact O-N 3.27Å; Q113-Q117 WeakPolarHBondContact O-CB 3.16Å; Q113-Q117 WeakPolarHBondContact O-CG 3.32Å; Q113-Q117 PolarHBondContact O-N 3Å; Q113-Q117 VanDerWaalsContact O-N 3.09Å; Q113-Q117 PolarHBondContact O-NE2 3.21Å; Q113-Q117 VanDerWaalsContact O-NE2 3.09Å
114	V	72.9	Confident	71.5	Confident	96 Å²	96	73.5 Å²	73.5	58%	0.582	36%	0.363	S	S	*	.	H	α-helix	trans	-68.9	-40.3	177.6	169.3	0	0	0	0	110.6	K110 E111 Q117	K110-V114 WeakPolarHBondContact O-CG2 3.43Å; K110-V114 PolarHBondContact O-N 3.3Å; E111-V114 PolarHBondContact O-N 2.68Å; V114-Q117 WeakPolarHBondContact O-CB 3.18Å; V114-Q117 PolarHBondContact O-N 3.26Å
115	W	74.8	Confident	71.6	Confident	62 Å²	62	78 Å²	78	24%	0.235	39%	0.385	C	S	.	.	H	α-helix	trans	-63.4	-51.4	175.5	-172.2	83.1	0	0	0	112	E111 L112 Q117 E118 Y119 L130 L134	E111-W115 PolarHBondContact O-N 3.21Å; E111-W115 VanDerWaalsContact O-N 3.16Å; L112-W115 PolarHBondContact O-N 3.31Å; W115-Q117 PolarHBondContact O-N 3.36Å; W115-E118 VanDerWaalsContact O-CB 3.28Å; W115-E118 WeakPolarHBondContact O-CB 3.48Å; W115-E118 PolarHBondContact O-N 3Å; W115-Y119 HydrophobicContact CD2-CD2 4.2Å; W115-Y119 HydrophobicContact CD2-CE2 4.02Å; W115-Y119 AromaticContact CE2-CE2 3.44Å; W115-Y119 VanDerWaalsContact CE2-CE2 3.44Å; W115-Y119 HydrophobicContact CE3-CD2 4.38Å; W115-Y119 HydrophobicContact CH2-CD2 4.25Å; W115-Y119 HydrophobicContact CH2-CE2 4.13Å; W115-Y119 HydrophobicContact CZ2-CD2 4.07Å; W115-Y119 AromaticContact CZ2-CE2 3.51Å; W115-Y119 HydrophobicContact CZ2-CE2 3.51Å; W115-Y119 AromaticContact CZ2-CZ 3.91Å; W115-Y119 HydrophobicContact CZ3-CD2 4.41Å; W115-Y119 AromaticContact NE1-CE2 3.66Å; W115-Y119 WeakPolarHBondContact O-CD2 3.19Å; W115-L130 HydrophobicContact CH2-CB 4.33Å; W115-L130 WeakPolarHBondContact CH2-O 3.44Å; W115-L130 HydrophobicContact CZ3-CB 4.1Å; W115-L130 WeakPolarHBondContact CZ3-O 3.33Å; W115-L134 HydrophobicContact CD2-CD2 3.97Å; W115-L134 HydrophobicContact CE3-CD2 3.89Å; W115-L134 HydrophobicContact CH2-CB 3.91Å; W115-L134 HydrophobicContact CH2-CD1 4.47Å; W115-L134 HydrophobicContact CH2-CD2 4.21Å; W115-L134 HydrophobicContact CH2-CG 4.42Å; W115-L134 HydrophobicContact CZ2-CB 4.26Å; W115-L134 HydrophobicContact CZ2-CD1 3.99Å; W115-L134 HydrophobicContact CZ2-CD2 4.28Å; W115-L134 HydrophobicContact CZ2-CG 4.4Å; W115-L134 HydrophobicContact CZ3-CB 4.26Å; W115-L134 HydrophobicContact CZ3-CD2 4.01Å
116	L	73.8	Confident	71.9	Confident	2 Å²	2	81.2 Å²	81.2	1%	0.01	40%	0.4	C	S	.	.	H	α-helix	trans	-64.4	-23.4	176.8	-74.7	175	0	0	0	114	L105 L108 L112 E118 Y119 R120 P121 L130 L131	L105-L116 HydrophobicContact CD2-CB 4.12Å; L105-L116 HydrophobicContact CD2-CD1 3.63Å; L108-L116 HydrophobicContact CD1-CD1 3.39Å; L112-L116 WeakPolarHBondContact O-CB 3.38Å; L112-L116 PolarHBondContact O-N 3.24Å; L116-E118 PolarHBondContact O-N 3.44Å; L116-Y119 PolarHBondContact O-N 3.45Å; L116-R120 PolarHBondContact O-N 3.15Å; L116-P121 WeakPolarHBondContact O-CD 3.41Å; L116-L130 HydrophobicContact CD2-CB 3.88Å; L116-L130 HydrophobicContact CD2-CD1 4.13Å; L116-L131 HydrophobicContact CD1-CD1 4.04Å; L116-L131 HydrophobicContact CD1-CD2 4.09Å; L116-L131 HydrophobicContact CD1-CG 4.04Å; L116-L131 HydrophobicContact CD2-CD2 4.49Å; L116-L131 HydrophobicContact CD2-CG 4.37Å; L116-L131 HydrophobicContact CG-CD2 4.3Å
117	Q	68.2	Low	72.1	Confident	73 Å²	73	78.2 Å²	78.2	34%	0.341	38%	0.379	S	S	.	.	H	α-helix	trans	-67.8	-20.1	172.3	-81.3	162.4	42.3	0	0	113.1	Q113 V114 W115	Q113-Q117 WeakPolarHBondContact O-CB 3.16Å; Q113-Q117 WeakPolarHBondContact O-CG 3.32Å; Q113-Q117 PolarHBondContact O-N 3Å; Q113-Q117 VanDerWaalsContact O-N 3.09Å; Q113-Q117 PolarHBondContact O-NE2 3.21Å; Q113-Q117 VanDerWaalsContact O-NE2 3.09Å; V114-Q117 WeakPolarHBondContact O-CB 3.18Å; V114-Q117 PolarHBondContact O-N 3.26Å; W115-Q117 PolarHBondContact O-N 3.36Å
118	E	72.9	Confident	72.2	Confident	144 Å²	144	74.6 Å²	74.6	67%	0.673	36%	0.363	S	S	*	.	H	α-helix	trans	-77.6	-39.6	174.4	-166.4	163	-163.9	0	0	111.6	W115 L116	W115-E118 VanDerWaalsContact O-CB 3.28Å; W115-E118 WeakPolarHBondContact O-CB 3.48Å; W115-E118 PolarHBondContact O-N 3Å; L116-E118 PolarHBondContact O-N 3.44Å
119	Y	69.9	Low	72.6	Confident	126 Å²	126	76.1 Å²	76.1	49%	0.494	37%	0.373	S	S	.	.	H	α-helix	trans	-86.4	-17.3	-178.1	-66.7	-90.8	0	0	0	114.8	W115 L116 L130	W115-Y119 HydrophobicContact CD2-CD2 4.2Å; W115-Y119 HydrophobicContact CD2-CE2 4.02Å; W115-Y119 AromaticContact CE2-CE2 3.44Å; W115-Y119 VanDerWaalsContact CE2-CE2 3.44Å; W115-Y119 HydrophobicContact CE3-CD2 4.38Å; W115-Y119 HydrophobicContact CH2-CD2 4.25Å; W115-Y119 HydrophobicContact CH2-CE2 4.13Å; W115-Y119 HydrophobicContact CZ2-CD2 4.07Å; W115-Y119 AromaticContact CZ2-CE2 3.51Å; W115-Y119 HydrophobicContact CZ2-CE2 3.51Å; W115-Y119 AromaticContact CZ2-CZ 3.91Å; W115-Y119 HydrophobicContact CZ3-CD2 4.41Å; W115-Y119 AromaticContact NE1-CE2 3.66Å; W115-Y119 WeakPolarHBondContact O-CD2 3.19Å; L116-Y119 PolarHBondContact O-N 3.45Å; Y119-L130 HydrophobicContact CD1-CD2 4.26Å; Y119-L130 HydrophobicContact CG-CD2 4.45Å
120	R	69.2	Low	73	Confident	125 Å²	125	74.3 Å²	74.3	47%	0.472	36%	0.359	S	S	.	.			trans	46.9	67.6	176.2	-63.6	-163.1	-176.6	83.3	7.7	115.1	D51 E53 L116 D122	D51-R120 IonicContact OD2-NE 3.58Å; E53-R120 HydrophobicContact CG-CG 4.32Å; L116-R120 PolarHBondContact O-N 3.15Å; R120-D122 PolarHBondContact O-N 3.31Å
121	P	72.2	Confident	73.4	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.019	33%	0.334	C	S	.	.			trans	-59.8	139.7	172.3	25.6	-34	0	0	0	112	R56 L101 L116 E126 A127 L130	R56-P121 PolarHBondContact NH1-O 2.86Å; L101-P121 HydrophobicContact CD1-CB 4.47Å; L101-P121 HydrophobicContact CD1-CG 4.2Å; L101-P121 WeakPolarHBondContact CD2-O 3.29Å; L116-P121 WeakPolarHBondContact O-CD 3.41Å; P121-E126 WeakPolarHBondContact CA-OE2 3.29Å; P121-E126 HydrophobicContact CB-CB 4.26Å; P121-E126 HydrophobicContact CB-CG 4.06Å; P121-A127 HydrophobicContact CB-CB 3.8Å; P121-A127 HydrophobicContact CG-CB 3.73Å; P121-L130 HydrophobicContact CB-CD1 4.38Å
122	D	65.9	Low	73.6	Confident	107 Å²	107	66.7 Å²	66.7	57%	0.572	33%	0.327	S	S	*	.	S	Bend	trans	-92.6	-22	174.1	-86.4	-31	0	0	0	112.2	R56 R120 E126	R56-D122 IonicContact NH2-OD1 3.53Å; R120-D122 PolarHBondContact O-N 3.31Å; D122-E126 PolarHBondContact N-OE2 2.85Å
123	S	73.7	Confident	74.1	Confident	36 Å²	36	68.4 Å²	68.4	25%	0.252	34%	0.336	S	S	.	.	S	Bend	trans	-127.5	160.6	177.6	71	0	0	0	0	113.6	E125 E126 A127	S123-E125 VanDerWaalsContact C-N 3.31Å; S123-E126 PolarHBondContact N-OE2 3.01Å; S123-E126 WeakPolarHBondContact OG-CB 3.16Å; S123-E126 PolarHBondContact OG-N 3.28Å; S123-E126 VanDerWaalsContact OG-N 3.11Å; S123-A127 PolarHBondContact O-N 3.08Å; S123-A127 VanDerWaalsContact O-N 3.16Å
124	G	69.9	Low	74.3	Confident	11 Å²	11	67.9 Å²	67.9	11%	0.113	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-33.3	173	0	0	0	0	0	113.1	A127 V128	G124-A127 PolarHBondContact O-N 3.45Å; G124-V128 WeakPolarHBondContact O-CG2 3.32Å; G124-V128 PolarHBondContact O-N 3.2Å; G124-V128 VanDerWaalsContact O-N 3.15Å
125	E	74.6	Confident	74.3	Confident	156 Å²	156	70 Å²	70	73%	0.729	34%	0.339	S	S	*	.	H	α-helix	trans	-64	-48.5	176.3	-173.9	171.1	-170.7	0	0	111.2	S123 A127 V128 T129	S123-E125 VanDerWaalsContact C-N 3.31Å; E125-A127 VanDerWaalsContact C-N 3.34Å; E125-A127 PolarHBondContact O-N 2.79Å; E125-V128 WeakPolarHBondContact O-CA 3.32Å; E125-V128 WeakPolarHBondContact O-CB 3.09Å; E125-V128 PolarHBondContact O-N 2.85Å; E125-T129 PolarHBondContact O-N 2.96Å
126	E	78.4	Confident	74	Confident	79 Å²	79	72.2 Å²	72.2	37%	0.369	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-37	176	-177.2	178	-149.2	0	0	113	P121 D122 S123 V128 T129 L130	P121-E126 WeakPolarHBondContact CA-OE2 3.29Å; P121-E126 HydrophobicContact CB-CB 4.26Å; P121-E126 HydrophobicContact CB-CG 4.06Å; D122-E126 PolarHBondContact N-OE2 2.85Å; S123-E126 PolarHBondContact N-OE2 3.01Å; S123-E126 WeakPolarHBondContact OG-CB 3.16Å; S123-E126 PolarHBondContact OG-N 3.28Å; S123-E126 VanDerWaalsContact OG-N 3.11Å; E126-V128 VanDerWaalsContact C-N 3.25Å; E126-V128 PolarHBondContact O-N 2.81Å; E126-T129 WeakPolarHBondContact CA-OG1 3.47Å; E126-T129 PolarHBondContact O-N 3.1Å; E126-T129 PolarHBondContact O-OG1 3.3Å; E126-T129 VanDerWaalsContact O-OG1 3.04Å; E126-L130 HydrophobicContact CG-CD1 4.36Å; E126-L130 WeakPolarHBondContact O-CB 3.46Å; E126-L130 VanDerWaalsContact O-CG 3.27Å; E126-L130 WeakPolarHBondContact O-CG 3.38Å; E126-L130 PolarHBondContact O-N 3.06Å
127	A	77.1	Confident	73.6	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.6	-27.3	173.8	0	0	0	0	0	112.9	L101 F104 P121 S123 G124 E125 L131	L101-A127 HydrophobicContact CD1-CB 3.64Å; F104-A127 HydrophobicContact CD1-CB 4.01Å; F104-A127 HydrophobicContact CE1-CB 3.86Å; P121-A127 HydrophobicContact CB-CB 3.8Å; P121-A127 HydrophobicContact CG-CB 3.73Å; S123-A127 PolarHBondContact O-N 3.08Å; S123-A127 VanDerWaalsContact O-N 3.16Å; G124-A127 PolarHBondContact O-N 3.45Å; E125-A127 VanDerWaalsContact C-N 3.34Å; E125-A127 PolarHBondContact O-N 2.79Å; A127-L131 WeakPolarHBondContact O-CD1 3.48Å; A127-L131 WeakPolarHBondContact O-CG 3.34Å
128	V	75.7	Confident	73.4	Confident	51 Å²	51	80.5 Å²	80.5	31%	0.309	40%	0.4	S	S	.	.	H	α-helix	trans	-78.9	-47.1	174.3	169.8	0	0	0	0	110.4	F104 G124 E125 E126 L130 L131 E132	F104-V128 HydrophobicContact CE1-CG2 4.24Å; F104-V128 HydrophobicContact CE2-CG2 3.99Å; F104-V128 HydrophobicContact CZ-CG2 3.64Å; G124-V128 WeakPolarHBondContact O-CG2 3.32Å; G124-V128 PolarHBondContact O-N 3.2Å; G124-V128 VanDerWaalsContact O-N 3.15Å; E125-V128 WeakPolarHBondContact O-CA 3.32Å; E125-V128 WeakPolarHBondContact O-CB 3.09Å; E125-V128 PolarHBondContact O-N 2.85Å; E126-V128 VanDerWaalsContact C-N 3.25Å; E126-V128 PolarHBondContact O-N 2.81Å; V128-L130 VanDerWaalsContact C-N 3.3Å; V128-L130 PolarHBondContact O-N 2.47Å; V128-L131 WeakPolarHBondContact O-CA 3.49Å; V128-L131 WeakPolarHBondContact O-CB 3.37Å; V128-L131 PolarHBondContact O-N 3.12Å; V128-E132 HydrophobicContact CG1-CG 4.16Å; V128-E132 WeakPolarHBondContact O-CG 3.22Å; V128-E132 PolarHBondContact O-N 2.83Å
129	T	80.3	Confident	72.6	Confident	60 Å²	60	78.1 Å²	78.1	37%	0.368	40%	0.399	S	S	.	.	H	α-helix	trans	-59.9	-40.2	179	55.3	0	0	0	0	112.1	E125 E126 L131 E132 D133	E125-T129 PolarHBondContact O-N 2.96Å; E126-T129 WeakPolarHBondContact CA-OG1 3.47Å; E126-T129 PolarHBondContact O-N 3.1Å; E126-T129 PolarHBondContact O-OG1 3.3Å; E126-T129 VanDerWaalsContact O-OG1 3.04Å; T129-L131 VanDerWaalsContact C-N 3.27Å; T129-L131 PolarHBondContact O-N 2.86Å; T129-E132 PolarHBondContact O-N 3.13Å; T129-D133 WeakPolarHBondContact O-CB 3.13Å; T129-D133 VanDerWaalsContact O-CG 3.32Å; T129-D133 PolarHBondContact O-N 3.34Å
130	L	81.1	Confident	71.9	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	40%	0.401	C	S	.	.	H	α-helix	trans	-62.1	-31.5	174.5	-72.8	168.9	0	0	0	113.2	W115 L116 Y119 P121 E126 V128 L134	W115-L130 HydrophobicContact CH2-CB 4.33Å; W115-L130 WeakPolarHBondContact CH2-O 3.44Å; W115-L130 HydrophobicContact CZ3-CB 4.1Å; W115-L130 WeakPolarHBondContact CZ3-O 3.33Å; L116-L130 HydrophobicContact CD2-CB 3.88Å; L116-L130 HydrophobicContact CD2-CD1 4.13Å; Y119-L130 HydrophobicContact CD1-CD2 4.26Å; Y119-L130 HydrophobicContact CG-CD2 4.45Å; P121-L130 HydrophobicContact CB-CD1 4.38Å; E126-L130 HydrophobicContact CG-CD1 4.36Å; E126-L130 WeakPolarHBondContact O-CB 3.46Å; E126-L130 VanDerWaalsContact O-CG 3.27Å; E126-L130 WeakPolarHBondContact O-CG 3.38Å; E126-L130 PolarHBondContact O-N 3.06Å; V128-L130 VanDerWaalsContact C-N 3.3Å; V128-L130 PolarHBondContact O-N 2.47Å; L130-L134 WeakPolarHBondContact O-CB 3.39Å; L130-L134 PolarHBondContact O-N 2.95Å
131	L	76.8	Confident	71	Confident	29 Å²	29	75.9 Å²	75.9	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-80.1	-35.1	175.7	-72.5	172.6	0	0	0	112.4	F104 L108 L112 L116 A127 V128 T129 L134 E135	F104-L131 HydrophobicContact CE1-CD1 3.82Å; F104-L131 HydrophobicContact CZ-CD1 3.71Å; L108-L131 HydrophobicContact CD1-CD1 3.95Å; L108-L131 HydrophobicContact CD2-CD1 3.95Å; L112-L131 HydrophobicContact CB-CD2 4.42Å; L112-L131 HydrophobicContact CD1-CD2 4.21Å; L112-L131 HydrophobicContact CD2-CD2 4.12Å; L112-L131 HydrophobicContact CG-CD2 4.49Å; L116-L131 HydrophobicContact CD1-CD1 4.04Å; L116-L131 HydrophobicContact CD1-CD2 4.09Å; L116-L131 HydrophobicContact CD1-CG 4.04Å; L116-L131 HydrophobicContact CD2-CD2 4.49Å; L116-L131 HydrophobicContact CD2-CG 4.37Å; L116-L131 HydrophobicContact CG-CD2 4.3Å; A127-L131 WeakPolarHBondContact O-CD1 3.48Å; A127-L131 WeakPolarHBondContact O-CG 3.34Å; V128-L131 WeakPolarHBondContact O-CA 3.49Å; V128-L131 WeakPolarHBondContact O-CB 3.37Å; V128-L131 PolarHBondContact O-N 3.12Å; T129-L131 VanDerWaalsContact C-N 3.27Å; T129-L131 PolarHBondContact O-N 2.86Å; L131-L134 HydrophobicContact CD2-CD2 4.47Å; L131-L134 PolarHBondContact O-N 3.16Å; L131-E135 WeakPolarHBondContact O-CB 3.49Å; L131-E135 PolarHBondContact O-N 2.63Å
132	E	77.5	Confident	69.3	Low	108 Å²	108	85.2 Å²	85.2	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-65.8	-42.6	173.6	-70	178.3	162.3	0	0	110.7	V128 T129 L134 E135 L136	V128-E132 HydrophobicContact CG1-CG 4.16Å; V128-E132 WeakPolarHBondContact O-CG 3.22Å; V128-E132 PolarHBondContact O-N 2.83Å; T129-E132 PolarHBondContact O-N 3.13Å; E132-L134 PolarHBondContact O-N 2.78Å; E132-E135 PolarHBondContact O-N 2.77Å; E132-L136 VanDerWaalsContact O-CG 3.3Å; E132-L136 WeakPolarHBondContact O-CG 3.48Å; E132-L136 PolarHBondContact O-N 3.2Å
133	D	79.7	Confident	68	Low	91 Å²	91	85.4 Å²	85.4	49%	0.487	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-41.7	172.9	-72.7	-24.7	0	0	0	111.6	T129 L136 D137	T129-D133 WeakPolarHBondContact O-CB 3.13Å; T129-D133 VanDerWaalsContact O-CG 3.32Å; T129-D133 PolarHBondContact O-N 3.34Å; D133-L136 WeakPolarHBondContact O-CB 3.04Å; D133-L136 PolarHBondContact O-N 2.9Å; D133-D137 PolarHBondContact O-N 3.02Å
134	L	76.3	Confident	66.6	Low	32 Å²	32	89.9 Å²	89.9	17%	0.168	49%	0.489	C	S	.	.	H	α-helix	trans	-64.9	-38.4	174.6	-179	65.4	0	0	0	112.6	L112 W115 L130 L131 E132 D137 L138	L112-L134 HydrophobicContact CD2-CD2 3.61Å; W115-L134 HydrophobicContact CD2-CD2 3.97Å; W115-L134 HydrophobicContact CE3-CD2 3.89Å; W115-L134 HydrophobicContact CH2-CB 3.91Å; W115-L134 HydrophobicContact CH2-CD1 4.47Å; W115-L134 HydrophobicContact CH2-CD2 4.21Å; W115-L134 HydrophobicContact CH2-CG 4.42Å; W115-L134 HydrophobicContact CZ2-CB 4.26Å; W115-L134 HydrophobicContact CZ2-CD1 3.99Å; W115-L134 HydrophobicContact CZ2-CD2 4.28Å; W115-L134 HydrophobicContact CZ2-CG 4.4Å; W115-L134 HydrophobicContact CZ3-CB 4.26Å; W115-L134 HydrophobicContact CZ3-CD2 4.01Å; L130-L134 WeakPolarHBondContact O-CB 3.39Å; L130-L134 PolarHBondContact O-N 2.95Å; L131-L134 HydrophobicContact CD2-CD2 4.47Å; L131-L134 PolarHBondContact O-N 3.16Å; E132-L134 PolarHBondContact O-N 2.78Å; L134-D137 PolarHBondContact O-N 3.13Å; L134-L138 HydrophobicContact CD1-CD1 4.46Å; L134-L138 HydrophobicContact CG-CD1 4.2Å; L134-L138 WeakPolarHBondContact O-CB 3.2Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.24Å
135	E	72.6	Confident	64.8	Low	142 Å²	142	92.9 Å²	92.9	66%	0.664	52%	0.52	S	S	*	.	H	α-helix	trans	-67.2	-38.2	175	-174.2	167.5	-164.1	0	0	111.3	L131 E132 L138 S139	L131-E135 WeakPolarHBondContact O-CB 3.49Å; L131-E135 PolarHBondContact O-N 2.63Å; E132-E135 PolarHBondContact O-N 2.77Å; E135-L138 PolarHBondContact O-N 3.27Å; E135-S139 WeakPolarHBondContact O-CB 3.47Å; E135-S139 PolarHBondContact O-N 2.99Å; E135-S139 PolarHBondContact O-OG 3.43Å
136	L	68.6	Low	62.9	Low	107 Å²	107	93.9 Å²	93.9	56%	0.56	53%	0.525	S	S	*	.	H	α-helix	trans	-62.5	-47.8	173	-72.1	169.7	0	0	0	111.6	E132 D133 L138 S139 G140	E132-L136 VanDerWaalsContact O-CG 3.3Å; E132-L136 WeakPolarHBondContact O-CG 3.48Å; E132-L136 PolarHBondContact O-N 3.2Å; D133-L136 WeakPolarHBondContact O-CB 3.04Å; D133-L136 PolarHBondContact O-N 2.9Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 3.19Å; L136-S139 CarbonylContact O-C 3.57Å; L136-S139 PolarHBondContact O-N 3.23Å; L136-S139 VanDerWaalsContact O-N 3.13Å; L136-S139 PolarHBondContact O-OG 3.43Å; L136-G140 PolarHBondContact O-N 3.44Å
137	D	65.4	Low	60.7	Low	121 Å²	121	95.9 Å²	95.9	65%	0.647	54%	0.542	S	S	*	.	H	α-helix	trans	-60.5	-39.4	176.7	-88.2	-13.6	0	0	0	112.7	D133 L134 G140	D133-D137 PolarHBondContact O-N 3.02Å; L134-D137 PolarHBondContact O-N 3.13Å; D137-G140 PolarHBondContact O-N 3.05Å
138	L	62.8	Low	58.8	Low	128 Å²	128	104.1 Å²	104.1	67%	0.67	58%	0.58	S	S	*	*	H	α-helix	trans	-70.3	-31.4	175.4	-71.2	169.7	0	0	0	112.6	L134 E135 L136	L134-L138 HydrophobicContact CD1-CD1 4.46Å; L134-L138 HydrophobicContact CG-CD1 4.2Å; L134-L138 WeakPolarHBondContact O-CB 3.2Å; L134-L138 VanDerWaalsContact O-CG 3.24Å; L134-L138 WeakPolarHBondContact O-CG 3.4Å; L134-L138 PolarHBondContact O-N 3.24Å; E135-L138 PolarHBondContact O-N 3.27Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 3.19Å
139	S	57.3	Low	56.6	Low	94 Å²	94	105.1 Å²	105.1	66%	0.657	60%	0.601	S	S	*	*	H	α-helix	trans	-78.7	-21.5	174.9	79.6	0	0	0	0	113.6	E135 L136	E135-S139 WeakPolarHBondContact O-CB 3.47Å; E135-S139 PolarHBondContact O-N 2.99Å; E135-S139 PolarHBondContact O-OG 3.43Å; L136-S139 CarbonylContact O-C 3.57Å; L136-S139 PolarHBondContact O-N 3.23Å; L136-S139 VanDerWaalsContact O-N 3.13Å; L136-S139 PolarHBondContact O-OG 3.43Å
140	G	54.2	Low	54.8	Low	51 Å²	51	108.6 Å²	108.6	53%	0.526	62%	0.624	S	S	.	*			trans	-91	-2.6	-167.1	0	0	0	0	0	116.9	L136 D137 Q142	L136-G140 PolarHBondContact O-N 3.44Å; D137-G140 PolarHBondContact O-N 3.05Å; G140-Q142 VanDerWaalsContact C-N 3.33Å; G140-Q142 PolarHBondContact O-N 3.37Å
141	Q	51.3	Low	52.6	Low	154 Å²	154	114.8 Å²	114.8	72%	0.72	65%	0.652	S	S	*	*			trans	-76	74.7	-172.2	-72.6	-170.5	-4.9	0	0	115	V143	Q141-V143 HydrophobicContact CB-CG2 4.19Å; Q141-V143 HydrophobicContact CG-CG2 4.29Å
142	Q	36.3	Very low	50.8	Low	198 Å²	198	119.7 Å²	119.7	93%	0.925	68%	0.676	S	S	*	*			trans	-110.7	117.6	135.1	-71.6	-171.9	19.8	0	0	108.6	G140	G140-Q142 VanDerWaalsContact C-N 3.33Å; G140-Q142 PolarHBondContact O-N 3.37Å
143	V	38.8	Very low	48.7	Very low	112 Å²	112	122.3 Å²	122.3	68%	0.679	69%	0.693	S	S	*	*			trans	-107	145.1	-162.8	-176.1	0	0	0	0	107.4	Q141	Q141-V143 HydrophobicContact CB-CG2 4.19Å; Q141-V143 HydrophobicContact CG-CG2 4.29Å
144	P	43.8	Very low	46.7	Very low	130 Å²	130	122 Å²	122	84%	0.844	70%	0.703	S	S	*	*				-153.6	155.1	56	40.7	-18.5	0	0	0	121.7
145	G	32.2	Very low	44.6	Very low	74 Å²	74	132.2 Å²	132.2	76%	0.763	74%	0.739	S	S	*	*			trans	176.1	106.6	160.2	0	0	0	0	0	113.1
146	Q	34.6	Very low	42.5	Very low	177 Å²	177	129.2 Å²	129.2	83%	0.827	75%	0.747	S	S	*	*			trans	-46.6	154	-176.7	-80	172.6	-58.6	0	0	115.8
147	V	32.3	Very low	40.8	Very low	121 Å²	121	132.8 Å²	132.8	73%	0.733	76%	0.762	S	S	*	*				-154.9	139.1	65.4	167.9	0	0	0	0	114
148	H	36.9	Very low	39.3	Very low	173 Å²	173	133.8 Å²	133.8	80%	0.801	77%	0.773	S	S	*	*			trans	17.1	136.7	163.4	-51.5	-49.7	0	0	0	121.3
149	G	29.1	Very low	38.8	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	77%	0.77	S	S	*	*			cis	148.5	175.7	8.2	0	0	0	0	0	109.4
150	P	43.2	Very low	37.4	Very low	133 Å²	133	136.1 Å²	136.1	86%	0.864	78%	0.783	S	S	*	*			cis	-117	150	-2.9	39.3	-25.9	0	0	0	114.5
151	E	35.4	Very low	36	Very low	163 Å²	163	140.8 Å²	140.8	76%	0.762	80%	0.796	S	S	*	*			trans	-91.8	146.8	169	-160.8	-165.3	164.5	0	0	110.5
152	M	37.4	Very low	36.4	Very low	133 Å²	133	138.8 Å²	138.8	66%	0.655	80%	0.796	S	S	*	*			trans	157.7	115.3	137.2	-87	-68.5	104.6	0	0	112.1
153	L	34.7	Very low	35.9	Very low	163 Å²	163	135.6 Å²	135.6	85%	0.853	79%	0.79	S	S	*	*				-171	86.4	111.3	-101.2	172.6	0	0	0	111.2
154	A	37.1	Very low	35.5	Very low	85 Å²	85	138.2 Å²	138.2	70%	0.702	80%	0.795	S	S	*	*			trans	-86.9	132.1	158.7	0	0	0	0	0	109.9
155	R	32.6	Very low	34.5	Very low	245 Å²	245	141.1 Å²	141.1	93%	0.925	80%	0.797	S	S	*	*			trans	-143.5	111.5	160.2	-102.5	-168.7	172.9	-162.8	-1.8	110.2
156	G	29.1	Very low	34.3	Very low	80 Å²	80	142.5 Å²	142.5	83%	0.825	80%	0.795	S	S	*	*			trans	111.4	57.2	160.7	0	0	0	0	0	117.7
157	M	31.6	Very low	33.9	Very low	181 Å²	181	139.6 Å²	139.6	89%	0.892	79%	0.794	S	S	*	*			trans	-70.9	154.4	138	-76.6	-170.9	159.2	0	0	108.6
158	V	34.8	Very low	33.5	Very low	143 Å²	143	138.2 Å²	138.2	87%	0.867	79%	0.79	S	S	*	*				-148.4	145.2	88.4	160.6	0	0	0	0	110.5
159	P	52.8	Low	32.9	Very low	95 Å²	95	138.2 Å²	138.2	62%	0.617	79%	0.788	S	S	*	*			trans	-104	171.8	-171.4	41	-35.9	0	0	0	114.1
160	L	26.3	Very low	32.9	Very low	176 Å²	176	140.3 Å²	140.3	92%	0.921	78%	0.782	S	S	*	*			trans	-149.9	114.9	154.5	-78.3	-177	0	0	0	111.6
161	D	26.5	Very low	32.2	Very low	148 Å²	148	139.8 Å²	139.8	79%	0.791	77%	0.772	S	S	*	*			trans	-91.3	-175.2	152.9	-69.1	-60.3	0	0	0	109
162	P	58.2	Low	31.9	Very low	113 Å²	113	139.5 Å²	139.5	73%	0.734	77%	0.77	S	S	*	*				-123.4	-172.1	-73.1	38.1	-22.9	0	0	0	110.5
163	V	26	Very low	31.5	Very low	130 Å²	130	139.7 Å²	139.7	79%	0.788	77%	0.769	S	S	*	*			trans	161.5	152.2	137.7	157.5	0	0	0	0	111.9
164	Q	30.1	Very low	31.1	Very low	168 Å²	168	139.4 Å²	139.4	79%	0.785	76%	0.763	S	S	*	*			trans	-63.4	151.6	-178.8	-54.9	152.3	-95.9	0	0	113.8
165	E	23.9	Very low	30.7	Very low	190 Å²	190	139.5 Å²	139.5	89%	0.888	76%	0.764	S	S	*	*				-179.4	173.7	103.7	-97.5	-168.8	154.5	0	0	113
166	S	27.8	Very low	30.5	Very low	103 Å²	103	135 Å²	135	72%	0.72	76%	0.764	S	S	*	*			trans	-89.6	178	-165.2	55.8	0	0	0	0	116.1
167	S	25.4	Very low	30.5	Very low	117 Å²	117	139.5 Å²	139.5	82%	0.818	76%	0.764	S	S	*	*			trans	83.1	153.7	169.2	90.2	0	0	0	0	114.7
168	S	24.6	Very low	30.3	Very low	92 Å²	92	136.2 Å²	136.2	64%	0.643	76%	0.759	S	S	*	*			cis	-171.8	149.3	-14.8	159.3	0	0	0	0	109.7
169	F	24.8	Very low	30	Very low	173 Å²	173	136.7 Å²	136.7	76%	0.759	75%	0.751	S	S	*	*			trans	70.6	128.2	156.4	-92.9	-126	0	0	0	121.3
170	D	28.8	Very low	28.6	Very low	115 Å²	115	142.3 Å²	142.3	62%	0.615	77%	0.766	S	S	*	*				64.9	151.9	129.3	-69.4	7.4	0	0	0	121.9
171	L	28.9	Very low	28.8	Very low	123 Å²	123	141.5 Å²	141.5	64%	0.644	76%	0.755	S	S	*	*			cis	-165.3	155.5	-12.4	-111.4	170.2	0	0	0	109
172	H	28.3	Very low	28.9	Very low	157 Å²	157	143.2 Å²	143.2	73%	0.727	76%	0.758	S	S	*	*			trans	59.7	168.5	162	-75.8	-76	0	0	0	117.7
173	H	28.5	Very low	27.1	Very low	136 Å²	136	142.1 Å²	142.1	63%	0.63	75%	0.753	S	S	*	*			cis	-145.9	163.1	10.1	-142.6	-89.1	0	0	0	111.6
174	E	27	Very low	27.1	Very low	157 Å²	157	140.8 Å²	140.8	73%	0.734	75%	0.749	S	S	*	*			trans	3.4	133.4	161.5	-72.9	169.4	165	0	0	121.7
175	A	27.9	Very low	26.9	Very low	88 Å²	88	144.8 Å²	144.8	73%	0.727	76%	0.757	S	S	*	*				85.2	131.6	57.4	0	0	0	0	0	115.8
176	T	28.7	Very low	27.2	Very low	151 Å²	151	145.2 Å²	145.2	93%	0.926	76%	0.756	S	S	*	*			trans	-157.4	144.8	152	1.7	0	0	0	0	110.1
177	Q	29.4	Very low	27.3	Very low	174 Å²	174	146.7 Å²	146.7	81%	0.813	76%	0.763	S	S	*	*			trans	-105	151.8	-172.1	-60.6	171.5	-6.2	0	0	112.1
178	S	27	Very low	27.3	Very low	112 Å²	112	152.2 Å²	152.2	78%	0.783	77%	0.766	S	S	*	*				171.7	122	119.1	43.8	0	0	0	0	109.4
179	H	29.8	Very low	27.5	Very low	153 Å²	153	155.2 Å²	155.2	71%	0.708	77%	0.774	S	S	*	*				59	100.1	67.7	-91.4	-84	0	0	0	115.7
180	F	23.5	Very low	27.5	Very low	212 Å²	212	155.3 Å²	155.3	93%	0.93	78%	0.782	S	S	*	*			trans	-147.3	147.2	133.5	-115.6	-82.3	0	0	0	111
181	K	29.4	Very low	27.4	Very low	160 Å²	160	158.2 Å²	158.2	70%	0.696	79%	0.791	S	S	*	*			trans	-123.4	173.9	-177.8	-85.6	-175.3	176.8	176.8	0	110.6
182	H	28.1	Very low	27.4	Very low	183 Å²	183	158.1 Å²	158.1	85%	0.847	80%	0.801	S	S	*	*			trans	89.6	152.8	170.1	-59	-79	0	0	0	116.4
183	S	22.2	Very low	27.2	Very low	91 Å²	91	162.6 Å²	162.6	64%	0.636	81%	0.812	S	S	*	*			cis	-170.7	142.5	-28.8	-178.1	0	0	0	0	109.2
184	S	25.8	Very low	27	Very low	101 Å²	101	160 Å²	160	71%	0.706	81%	0.814	S	S	*	*			trans	29.4	126.7	149	-45.5	0	0	0	0	121.6
185	R	25.1	Very low	27.1	Very low	252 Å²	252	160.3 Å²	160.3	95%	0.951	82%	0.82	S	S	*	*				-169.8	137.8	129	-103.8	153.6	-163.9	-126.2	4.6	113.7
186	K	29.9	Very low	27.7	Very low	200 Å²	200	162.1 Å²	162.1	87%	0.87	82%	0.824	S	S	*	*			trans	-94.6	164.4	157.6	-67.3	177.8	176.9	177.3	0	108.9
187	P	30.5	Very low	27.7	Very low	133 Å²	133	159.4 Å²	159.4	86%	0.864	82%	0.817	S	S	*	*			trans	-121.7	169.1	142.7	15.2	4.8	0	0	0	113.8
188	R	24.9	Very low	27.6	Very low	234 Å²	234	155.6 Å²	155.6	88%	0.883	82%	0.815	S	S	*	*			trans	-106.5	153.8	-175.4	-103.5	179.5	169.1	-173.4	-2.7	112.1
189	L	28.4	Very low	27.6	Very low	155 Å²	155	159.1 Å²	159.1	81%	0.812	82%	0.819	S	S	*	*			trans	-0.4	144.1	147.7	-63.6	167	0	0	0	120.3
190	L	24.6	Very low	27.7	Very low	174 Å²	174	157.7 Å²	157.7	91%	0.911	82%	0.821	S	S	*	*			trans	-142.8	158.1	138.8	-106.5	168.2	0	0	0	111
191	Q	28.4	Very low	28.2	Very low	176 Å²	176	153.7 Å²	153.7	82%	0.822	82%	0.816	S	S	*	*			trans	-111	159.6	-168.8	-62.8	167.3	-53.9	0	0	113.2
192	S	27.2	Very low	28.1	Very low	122 Å²	122	150.3 Å²	150.3	85%	0.853	82%	0.818	S	S	*	*			trans	153.9	158.9	142.3	49.3	0	0	0	0	110.3
193	R	24.6	Very low	28.9	Very low	251 Å²	251	146.8 Å²	146.8	95%	0.947	81%	0.811	S	S	*	*			cis	-161.3	162.9	-28.3	178	171.5	175.6	172.7	-1.8	105.7
194	A	25.3	Very low	29.7	Very low	82 Å²	82	148.8 Å²	148.8	68%	0.678	82%	0.822	S	S	*	*			trans	-111.9	158.9	-161.7	0	0	0	0	0	116.8
195	L	27.9	Very low	29.9	Very low	163 Å²	163	151.7 Å²	151.7	85%	0.853	82%	0.824	S	S	*	*			trans	72.1	161.4	155.6	-68.1	179.1	0	0	0	118.5
196	P	41.8	Very low	29.9	Very low	125 Å²	125	147.6 Å²	147.6	81%	0.812	82%	0.816	S	S	*	*			cis	-129.3	-172.6	15.2	42.4	-25	0	0	0	117.4
197	A	28.6	Very low	29.7	Very low	95 Å²	95	141.9 Å²	141.9	79%	0.785	81%	0.813	S	S	*	*			trans	-102.5	163.8	-173.4	0	0	0	0	0	114.2
198	A	26.3	Very low	29.5	Very low	94 Å²	94	140.9 Å²	140.9	78%	0.777	81%	0.81	S	S	*	*			trans	-154.5	134.9	160.8	0	0	0	0	0	114
199	H	28.1	Very low	30.2	Very low	186 Å²	186	135.6 Å²	135.6	86%	0.861	81%	0.805	S	S	*	*			trans	61.8	123.9	150.8	-94.9	-81.1	0	0	0	125.1
200	V	31.7	Very low	30.2	Very low	123 Å²	123	138.6 Å²	138.6	75%	0.745	81%	0.806	S	S	*	*			trans	-94.8	146.7	157.8	172.8	0	0	0	0	107.4
201	P	32.5	Very low	30.3	Very low	127 Å²	127	136.2 Å²	136.2	83%	0.825	79%	0.794	S	S	*	*				-147	161.5	104	37.3	-19.8	0	0	0	116.7
202	A	27.1	Very low	30.4	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	80%	0.801	S	S	*	*			trans	-148.6	169	157.2	0	0	0	0	0	106.9
203	P	46.9	Very low	30.3	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	80%	0.798	S	S	*	*			cis	-119.4	-155.6	-15.4	40.4	-23.8	0	0	0	110.7
204	P	37	Very low	30.4	Very low	132 Å²	132	133.2 Å²	133.2	86%	0.857	80%	0.801	S	S	*	*				-133.3	-177.4	119.9	38.8	-30.4	0	0	0	114.6
205	H	30.1	Very low	30.3	Very low	162 Å²	162	134 Å²	134	75%	0.75	81%	0.807	S	S	*	*			trans	-121	-178.9	-159.7	-143.7	-103.3	0	0	0	112.1
206	E	27	Very low	30.3	Very low	167 Å²	167	132 Å²	132	78%	0.78	81%	0.807	S	S	*	*			trans	78.4	140.6	167.6	-57.5	-57.2	112.6	0	0	120.3
207	G	25.6	Very low	29.7	Very low	79 Å²	79	130.2 Å²	130.2	81%	0.814	80%	0.803	S	S	*	*			trans	130.3	94.7	152	0	0	0	0	0	118.3
208	S	25.6	Very low	29.7	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	80%	0.803	S	S	*	*			trans	-128.2	142.4	153.6	-178.2	0	0	0	0	108.4
209	P	38.8	Very low	29.7	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	81%	0.805	S	S	*	*				-149.5	142.4	119.6	34.4	-16.6	0	0	0	117.3
210	R	29.6	Very low	29.8	Very low	219 Å²	219	135.4 Å²	135.4	83%	0.826	81%	0.807	S	S	*	*			trans	18.3	134.7	143.3	-76.8	-173.4	166.7	177	-5.2	124.9
211	D	26.9	Very low	29.8	Very low	124 Å²	124	134.3 Å²	134.3	66%	0.663	81%	0.81	S	S	*	*				61.8	109.4	125.5	-53	-25.1	0	0	0	123.9
212	Q	30.3	Very low	30.1	Very low	207 Å²	207	133.8 Å²	133.8	97%	0.967	80%	0.801	S	S	*	*			trans	-179.7	143.1	137.8	-99.3	156.5	79.6	0	0	107.5
213	G	24.9	Very low	30.6	Very low	77 Å²	77	134.7 Å²	134.7	79%	0.794	80%	0.802	S	S	*	*			cis	-167.3	168.6	-4.7	0	0	0	0	0	109.2
214	M	25.7	Very low	29.9	Very low	201 Å²	201	136.6 Å²	136.6	99%	0.99	80%	0.801	S	S	*	*			trans	-84.8	139	-167.9	-63.5	174.8	174.5	0	0	116
215	A	24.9	Very low	29.8	Very low	98 Å²	98	132.5 Å²	132.5	81%	0.81	78%	0.778	S	S	*	*			trans	170.8	139.8	144.7	0	0	0	0	0	108
216	S	26.6	Very low	29.8	Very low	122 Å²	122	131.9 Å²	131.9	85%	0.853	78%	0.778	S	S	*	*			cis	-141.6	162.9	8.1	-70.8	0	0	0	0	110.7
217	A	28.6	Very low	30.3	Very low	88 Å²	88	128.1 Å²	128.1	73%	0.727	77%	0.766	S	S	*	*			trans	-87.5	147	176.7	0	0	0	0	0	112.8
218	L	29.1	Very low	30.9	Very low	151 Å²	151	130.6 Å²	130.6	79%	0.791	75%	0.754	S	S	*	*				170.5	154.5	110.9	-88	167.7	0	0	0	112.1
219	F	27.6	Very low	31.3	Very low	185 Å²	185	131.3 Å²	131.3	81%	0.811	75%	0.748	S	S	*	*			trans	57	97.7	173.5	-67.6	-78.2	0	0	0	119.2
220	T	29.1	Very low	31.3	Very low	147 Å²	147	132.1 Å²	132.1	90%	0.902	74%	0.741	S	S	*	*				-172.2	119.5	106.2	20.8	0	0	0	0	109.8
221	A	31.1	Very low	31.6	Very low	100 Å²	100	127 Å²	127	83%	0.826	73%	0.73	S	S	*	*			trans	-96	139.3	170.7	0	0	0	0	0	110.1
222	D	39.2	Very low	32	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	73%	0.729	S	S	*	*			trans	58.4	84.3	158.7	-147.2	0.8	0	0	0	120.1	Q224 A225	D222-Q224 PolarHBondContact OD1-N 3.12Å; D222-A225 WeakPolarHBondContact OD1-CB 3.45Å; D222-A225 PolarHBondContact OD1-N 3.1Å; D222-A225 WeakPolarHBondContact OD2-CB 3.37Å
223	S	37.3	Very low	32.1	Very low	108 Å²	108	119.4 Å²	119.4	76%	0.755	70%	0.699	S	S	*	*	S	Bend	trans	-117.2	8.9	157	57.4	0	0	0	0	112.8
224	Q	33.4	Very low	32.6	Very low	150 Å²	150	119.5 Å²	119.5	70%	0.701	68%	0.684	S	S	*	*	S	Bend	trans	-116.6	-5.4	-171.4	-141.7	-178.5	45.9	0	0	114.2	D222 K228	D222-Q224 PolarHBondContact OD1-N 3.12Å; Q224-K228 WeakPolarHBondContact O-CE 3.37Å; Q224-K228 PolarHBondContact O-NZ 3.42Å
225	A	34.5	Very low	33	Very low	46 Å²	46	113.2 Å²	113.2	38%	0.38	66%	0.66	S	S	.	*	S	Bend	trans	-82.9	-45.9	167.9	0	0	0	0	0	112.8	D222 V227 K228	D222-A225 WeakPolarHBondContact OD1-CB 3.45Å; D222-A225 PolarHBondContact OD1-N 3.1Å; D222-A225 WeakPolarHBondContact OD2-CB 3.37Å; A225-V227 VanDerWaalsContact C-N 3.35Å; A225-V227 PolarHBondContact O-N 2.8Å; A225-K228 PolarHBondContact O-N 3.07Å
226	M	29.6	Very low	33.4	Very low	150 Å²	150	113.6 Å²	113.6	74%	0.739	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-39.6	-175.5	-71.4	-164.4	-172	0	0	113.7	K228 I229	M226-K228 PolarHBondContact O-N 2.9Å; M226-I229 PolarHBondContact O-N 2.85Å
227	V	37.7	Very low	33.9	Very low	88 Å²	88	112.5 Å²	112.5	53%	0.533	63%	0.632	S	S	.	*	H	α-helix	trans	-58.8	-19.1	-177.6	-177.4	0	0	0	0	113.2	A225	A225-V227 VanDerWaalsContact C-N 3.35Å; A225-V227 PolarHBondContact O-N 2.8Å
228	K	38.7	Very low	34.4	Very low	130 Å²	130	113.9 Å²	113.9	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-88.2	-19.9	-176.7	-67.3	168.4	-172.9	148.7	0	114.3	Q224 A225 M226 M232	Q224-K228 WeakPolarHBondContact O-CE 3.37Å; Q224-K228 PolarHBondContact O-NZ 3.42Å; A225-K228 PolarHBondContact O-N 3.07Å; M226-K228 PolarHBondContact O-N 2.9Å; K228-M232 WeakPolarHBondContact O-CG 3.23Å
229	I	34.3	Very low	34.9	Very low	128 Å²	128	110.7 Å²	110.7	66%	0.656	61%	0.607	S	S	*	*	H	α-helix	trans	-84.5	-42.3	-179	-61.6	178.4	0	0	0	110	M226 M232 A233	M226-I229 PolarHBondContact O-N 2.85Å; I229-M232 PolarHBondContact O-N 2.94Å; I229-A233 WeakPolarHBondContact O-CB 3.32Å; I229-A233 PolarHBondContact O-N 3.41Å
230	E	37.9	Very low	35.1	Very low	140 Å²	140	107.9 Å²	107.9	65%	0.654	60%	0.597	S	S	*	*	H	α-helix	trans	-65.6	-43.8	177.9	-62.4	-174.6	154.5	0	0	112.2	M232 A233 V234	E230-M232 PolarHBondContact O-N 3.25Å; E230-A233 PolarHBondContact O-N 3.47Å; E230-V234 WeakPolarHBondContact O-CB 3.41Å; E230-V234 VanDerWaalsContact O-CG2 3.31Å; E230-V234 WeakPolarHBondContact O-CG2 3.47Å; E230-V234 PolarHBondContact O-N 2.93Å
231	D	36.2	Very low	35.3	Very low	112 Å²	112	108.8 Å²	108.8	60%	0.599	58%	0.584	S	S	*	*	H	α-helix	trans	-62.2	-29.3	175.4	-99.7	-7.5	0	0	0	112.8	S235	D231-S235 VanDerWaalsContact O-CB 3.22Å; D231-S235 WeakPolarHBondContact O-CB 3.48Å; D231-S235 PolarHBondContact O-N 3.01Å; D231-S235 PolarHBondContact O-OG 3.39Å
232	M	35.2	Very low	35.7	Very low	128 Å²	128	105.8 Å²	105.8	63%	0.631	56%	0.563	S	S	*	*	H	α-helix	trans	-78.8	-42.5	173	-75.6	-174.1	61.7	0	0	112.2	K228 I229 E230 S235 L236	K228-M232 WeakPolarHBondContact O-CG 3.23Å; I229-M232 PolarHBondContact O-N 2.94Å; E230-M232 PolarHBondContact O-N 3.25Å; M232-S235 PolarHBondContact O-N 3.4Å; M232-L236 VanDerWaalsContact O-CG 3.3Å; M232-L236 WeakPolarHBondContact O-CG 3.25Å; M232-L236 PolarHBondContact O-N 3.19Å
233	A	32.1	Very low	35.6	Very low	42 Å²	42	103.9 Å²	103.9	35%	0.347	56%	0.557	S	S	.	*	H	α-helix	trans	-65	-46.2	177.8	0	0	0	0	0	111.8	I229 E230 S235 L236 I237	I229-A233 WeakPolarHBondContact O-CB 3.32Å; I229-A233 PolarHBondContact O-N 3.41Å; E230-A233 PolarHBondContact O-N 3.47Å; A233-S235 VanDerWaalsContact C-N 3.31Å; A233-S235 PolarHBondContact O-N 3.27Å; A233-L236 PolarHBondContact O-N 3.09Å; A233-I237 WeakPolarHBondContact O-CB 3.39Å; A233-I237 VanDerWaalsContact O-CG1 3.27Å; A233-I237 WeakPolarHBondContact O-CG1 3.45Å; A233-I237 PolarHBondContact O-N 3.15Å
234	V	36.7	Very low	35.4	Very low	79 Å²	79	103.8 Å²	103.8	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-63.9	-36.7	175	173.3	0	0	0	0	110.9	E230 L238	E230-V234 WeakPolarHBondContact O-CB 3.41Å; E230-V234 VanDerWaalsContact O-CG2 3.31Å; E230-V234 WeakPolarHBondContact O-CG2 3.47Å; E230-V234 PolarHBondContact O-N 2.93Å; V234-L238 HydrophobicContact CG1-CD1 3.71Å; V234-L238 HydrophobicContact CG1-CG 4.26Å; V234-L238 WeakPolarHBondContact O-CB 3.4Å; V234-L238 WeakPolarHBondContact O-CG 3.21Å; V234-L238 PolarHBondContact O-N 3.44Å
235	S	33.9	Very low	35.3	Very low	69 Å²	69	99.1 Å²	99.1	48%	0.483	53%	0.525	S	S	.	.	H	α-helix	trans	-65	-42.4	173	-66.6	0	0	0	0	112.5	D231 M232 A233 E239	D231-S235 VanDerWaalsContact O-CB 3.22Å; D231-S235 WeakPolarHBondContact O-CB 3.48Å; D231-S235 PolarHBondContact O-N 3.01Å; D231-S235 PolarHBondContact O-OG 3.39Å; M232-S235 PolarHBondContact O-N 3.4Å; A233-S235 VanDerWaalsContact C-N 3.31Å; A233-S235 PolarHBondContact O-N 3.27Å; S235-E239 WeakPolarHBondContact O-CB 3.4Å; S235-E239 WeakPolarHBondContact O-CG 3.48Å; S235-E239 PolarHBondContact O-N 3.05Å
236	L	33.2	Very low	35.6	Very low	106 Å²	106	101.3 Å²	101.3	56%	0.555	53%	0.529	S	S	*	.	H	α-helix	trans	-68.1	-45.2	178.4	-71.9	167.7	0	0	0	111.7	M232 A233 L238 E239 E240	M232-L236 VanDerWaalsContact O-CG 3.3Å; M232-L236 WeakPolarHBondContact O-CG 3.25Å; M232-L236 PolarHBondContact O-N 3.19Å; A233-L236 PolarHBondContact O-N 3.09Å; L236-L238 PolarHBondContact O-N 3.07Å; L236-E239 PolarHBondContact O-N 2.86Å; L236-E240 WeakPolarHBondContact O-CB 3.34Å; L236-E240 PolarHBondContact O-N 3.3Å
237	I	36.3	Very low	35.9	Very low	100 Å²	100	96.5 Å²	96.5	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-63.2	-41.2	176.4	-66.2	164.5	0	0	0	110.5	A233 E240 W241	A233-I237 WeakPolarHBondContact O-CB 3.39Å; A233-I237 VanDerWaalsContact O-CG1 3.27Å; A233-I237 WeakPolarHBondContact O-CG1 3.45Å; A233-I237 PolarHBondContact O-N 3.15Å; I237-E240 PolarHBondContact O-N 2.82Å; I237-W241 WeakPolarHBondContact O-CB 3.46Å; I237-W241 PolarHBondContact O-N 3.46Å
238	L	40	Very low	35.7	Very low	117 Å²	117	101.2 Å²	101.2	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-72.6	-26.6	175.4	-72.1	173.6	0	0	0	113.8	V234 L236 G242	V234-L238 HydrophobicContact CG1-CD1 3.71Å; V234-L238 HydrophobicContact CG1-CG 4.26Å; V234-L238 WeakPolarHBondContact O-CB 3.4Å; V234-L238 WeakPolarHBondContact O-CG 3.21Å; V234-L238 PolarHBondContact O-N 3.44Å; L236-L238 PolarHBondContact O-N 3.07Å; L238-G242 WeakPolarHBondContact O-CA 3.38Å; L238-G242 PolarHBondContact O-N 2.92Å
239	E	39.2	Very low	35.5	Very low	84 Å²	84	103.4 Å²	103.4	39%	0.393	53%	0.527	S	S	.	.	H	α-helix	trans	-74.5	-36.7	170.2	-77.2	-162.3	144.6	0	0	111.6	S235 L236 G242 C243	S235-E239 WeakPolarHBondContact O-CB 3.4Å; S235-E239 WeakPolarHBondContact O-CG 3.48Å; S235-E239 PolarHBondContact O-N 3.05Å; L236-E239 PolarHBondContact O-N 2.86Å; E239-G242 PolarHBondContact O-N 2.91Å; E239-C243 WeakPolarHBondContact O-CB 3.01Å; E239-C243 PolarHBondContact O-N 3.03Å; E239-C243 PolarHBondContact O-SG 3.15Å
240	E	32	Very low	35.6	Very low	126 Å²	126	100.8 Å²	100.8	59%	0.589	51%	0.514	S	S	*	.	H	α-helix	trans	-71.5	-52.3	177.1	-172.5	160.4	-140.6	0	0	111.9	L236 I237 G242 C243 Q244	L236-E240 WeakPolarHBondContact O-CB 3.34Å; L236-E240 PolarHBondContact O-N 3.3Å; I237-E240 PolarHBondContact O-N 2.82Å; E240-G242 PolarHBondContact O-N 2.96Å; E240-C243 PolarHBondContact O-N 3.4Å; E240-C243 VanDerWaalsContact O-N 3.11Å; E240-Q244 PolarHBondContact O-N 2.84Å
241	W	32.4	Very low	35.6	Very low	166 Å²	166	98.5 Å²	98.5	63%	0.629	51%	0.506	S	S	*	.	H	α-helix	trans	-61.3	-32.9	168.8	-105	60.5	0	0	0	112	I237 C243 N245	I237-W241 WeakPolarHBondContact O-CB 3.46Å; I237-W241 PolarHBondContact O-N 3.46Å; W241-C243 VanDerWaalsContact C-N 3.35Å; W241-N245 WeakPolarHBondContact O-CB 3.24Å; W241-N245 PolarHBondContact O-N 3.35Å; W241-N245 PolarHBondContact O-ND2 3.31Å
242	G	40	Very low	35.2	Very low	37 Å²	37	96.7 Å²	96.7	38%	0.381	50%	0.502	S	S	.	.	H	α-helix	trans	-64.9	-37.8	174.1	0	0	0	0	0	112.4	L238 E239 E240 L246	L238-G242 WeakPolarHBondContact O-CA 3.38Å; L238-G242 PolarHBondContact O-N 2.92Å; E239-G242 PolarHBondContact O-N 2.91Å; E240-G242 PolarHBondContact O-N 2.96Å; G242-L246 WeakPolarHBondContact O-CB 3.28Å; G242-L246 PolarHBondContact O-N 3.06Å
243	C	37.8	Very low	35.1	Very low	75 Å²	75	98.6 Å²	98.6	51%	0.507	50%	0.502	S	S	.	.	H	α-helix	trans	-77.7	-41.3	175.9	-69.6	0	0	0	0	112.3	E239 E240 W241 L246 A247	E239-C243 WeakPolarHBondContact O-CB 3.01Å; E239-C243 PolarHBondContact O-N 3.03Å; E239-C243 PolarHBondContact O-SG 3.15Å; E240-C243 PolarHBondContact O-N 3.4Å; E240-C243 VanDerWaalsContact O-N 3.11Å; W241-C243 VanDerWaalsContact C-N 3.35Å; C243-L246 PolarHBondContact O-N 3.31Å; C243-A247 WeakPolarHBondContact O-CB 3.4Å; C243-A247 PolarHBondContact O-N 3.45Å
244	Q	31.4	Very low	35.2	Very low	107 Å²	107	99.7 Å²	99.7	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-63	-41.6	172.4	-73.1	-173.7	3.3	0	0	111.7	E240 L246 A247 R248	E240-Q244 PolarHBondContact O-N 2.84Å; Q244-L246 VanDerWaalsContact C-N 3.35Å; Q244-A247 PolarHBondContact O-N 3.38Å; Q244-R248 WeakPolarHBondContact O-CB 3.27Å; Q244-R248 PolarHBondContact O-N 2.68Å
245	N	33.1	Very low	35.1	Very low	52 Å²	52	102.2 Å²	102.2	28%	0.278	51%	0.509	S	S	.	.	H	α-helix	trans	-71.8	-26.1	174.4	-81.1	-78.6	0	0	0	113	W241 R249	W241-N245 WeakPolarHBondContact O-CB 3.24Å; W241-N245 PolarHBondContact O-N 3.35Å; W241-N245 PolarHBondContact O-ND2 3.31Å; N245-R249 WeakPolarHBondContact O-CB 3.41Å; N245-R249 WeakPolarHBondContact O-CG 3.31Å; N245-R249 PolarHBondContact O-N 3.08Å
246	L	39.1	Very low	35	Very low	91 Å²	91	109.1 Å²	109.1	48%	0.476	52%	0.524	S	S	.	.	H	α-helix	trans	-74.3	-37.2	169.7	-151	82.9	0	0	0	111.1	G242 C243 Q244 R249 N250	G242-L246 WeakPolarHBondContact O-CB 3.28Å; G242-L246 PolarHBondContact O-N 3.06Å; C243-L246 PolarHBondContact O-N 3.31Å; Q244-L246 VanDerWaalsContact C-N 3.35Å; L246-R249 PolarHBondContact O-N 2.8Å; L246-N250 VanDerWaalsContact O-CB 3.28Å; L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 3.22Å; L246-N250 PolarHBondContact O-ND2 2.83Å
247	A	36.5	Very low	35.3	Very low	50 Å²	50	110.8 Å²	110.8	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-50.9	173.1	0	0	0	0	0	110.9	C243 Q244 R249 N250 L251	C243-A247 WeakPolarHBondContact O-CB 3.4Å; C243-A247 PolarHBondContact O-N 3.45Å; Q244-A247 PolarHBondContact O-N 3.38Å; A247-R249 PolarHBondContact O-N 2.87Å; A247-N250 PolarHBondContact O-N 3.12Å; A247-L251 WeakPolarHBondContact O-CB 3.4Å; A247-L251 VanDerWaalsContact O-CG 3.31Å; A247-L251 WeakPolarHBondContact O-CG 3.35Å; A247-L251 PolarHBondContact O-N 3.2Å
248	R	33.8	Very low	35.3	Very low	187 Å²	187	110.9 Å²	110.9	71%	0.706	53%	0.527	S	S	*	.	H	α-helix	trans	-60.7	-37.3	172.7	-84.4	-178.4	151.1	-176.7	-7.2	113	Q244 S252	Q244-R248 WeakPolarHBondContact O-CB 3.27Å; Q244-R248 PolarHBondContact O-N 2.68Å; R248-S252 WeakPolarHBondContact O-CB 3.41Å; R248-S252 PolarHBondContact O-N 3.18Å
249	R	35.5	Very low	34.9	Very low	175 Å²	175	112.3 Å²	112.3	66%	0.66	54%	0.535	S	S	*	.	H	α-helix	trans	-75.4	-28.1	174	-79.4	179.7	171.9	136.7	2.6	113.9	N245 L246 A247 R253	N245-R249 WeakPolarHBondContact O-CB 3.41Å; N245-R249 WeakPolarHBondContact O-CG 3.31Å; N245-R249 PolarHBondContact O-N 3.08Å; L246-R249 PolarHBondContact O-N 2.8Å; A247-R249 PolarHBondContact O-N 2.87Å; R249-R253 WeakPolarHBondContact O-CB 3.31Å; R249-R253 PolarHBondContact O-N 3.4Å
250	N	35.7	Very low	34.5	Very low	73 Å²	73	119 Å²	119	39%	0.39	56%	0.559	S	S	.	*	H	α-helix	trans	-71.2	-49.9	171.1	-71.3	-29.7	0	0	0	109.1	L246 A247 S252 R253 D254	L246-N250 VanDerWaalsContact O-CB 3.28Å; L246-N250 WeakPolarHBondContact O-CB 3.47Å; L246-N250 PolarHBondContact O-N 3.22Å; L246-N250 PolarHBondContact O-ND2 2.83Å; A247-N250 PolarHBondContact O-N 3.12Å; N250-S252 VanDerWaalsContact C-N 3.32Å; N250-S252 PolarHBondContact O-N 3.44Å; N250-R253 PolarHBondContact O-N 2.82Å; N250-R253 VanDerWaalsContact O-N 3.08Å; N250-D254 WeakPolarHBondContact O-CB 3.4Å; N250-D254 PolarHBondContact O-N 3.41Å
251	L	37.8	Very low	34.8	Very low	92 Å²	92	116.5 Å²	116.5	48%	0.482	57%	0.567	S	S	.	*	H	α-helix	trans	-51.1	-48.2	170.4	-73.1	163	0	0	0	111.8	A247 D254 H255	A247-L251 WeakPolarHBondContact O-CB 3.4Å; A247-L251 VanDerWaalsContact O-CG 3.31Å; A247-L251 WeakPolarHBondContact O-CG 3.35Å; A247-L251 PolarHBondContact O-N 3.2Å; L251-D254 PolarHBondContact O-N 2.66Å; L251-H255 WeakPolarHBondContact O-CB 3.37Å; L251-H255 PolarHBondContact O-N 3.36Å
252	S	28.5	Very low	34.6	Very low	74 Å²	74	113.7 Å²	113.7	52%	0.517	57%	0.573	S	S	.	*	H	α-helix	trans	-73.1	-25.8	179.7	-178.3	0	0	0	0	113.9	R248 N250 R256	R248-S252 WeakPolarHBondContact O-CB 3.41Å; R248-S252 PolarHBondContact O-N 3.18Å; N250-S252 VanDerWaalsContact C-N 3.32Å; N250-S252 PolarHBondContact O-N 3.44Å; S252-R256 WeakPolarHBondContact O-CB 3.21Å; S252-R256 PolarHBondContact O-N 3.03Å
253	R	32.6	Very low	34.1	Very low	168 Å²	168	118.7 Å²	118.7	63%	0.634	60%	0.596	S	S	*	*	H	α-helix	trans	-79.8	-32.3	173.4	-168.5	-178.2	73.4	135.6	9.4	111.6	R249 N250 Q257	R249-R253 WeakPolarHBondContact O-CB 3.31Å; R249-R253 PolarHBondContact O-N 3.4Å; N250-R253 PolarHBondContact O-N 2.82Å; N250-R253 VanDerWaalsContact O-N 3.08Å; R253-Q257 PolarHBondContact O-N 2.75Å
254	D	34.7	Very low	33.5	Very low	66 Å²	66	124 Å²	124	35%	0.353	61%	0.611	S	S	.	*	H	α-helix	trans	-68.2	-46	169.3	-62.3	-29.2	0	0	0	109	N250 L251 R256 Q257 E258	N250-D254 WeakPolarHBondContact O-CB 3.4Å; N250-D254 PolarHBondContact O-N 3.41Å; L251-D254 PolarHBondContact O-N 2.66Å; D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 3.37Å; D254-Q257 CarbonylContact O-C 3.6Å; D254-Q257 WeakPolarHBondContact O-CA 3.43Å; D254-Q257 VanDerWaalsContact O-CB 3.24Å; D254-Q257 WeakPolarHBondContact O-CB 3.35Å; D254-Q257 PolarHBondContact O-N 2.78Å; D254-E258 WeakPolarHBondContact O-CG 3.38Å; D254-E258 PolarHBondContact O-N 3.03Å
255	H	34.3	Very low	33.8	Very low	132 Å²	132	124.7 Å²	124.7	61%	0.611	63%	0.625	S	S	*	*	H	α-helix	trans	-57.9	-35.8	171.9	-116.9	34.8	0	0	0	114.4	L251 Q257 E258 N259	L251-H255 WeakPolarHBondContact O-CB 3.37Å; L251-H255 PolarHBondContact O-N 3.36Å; H255-Q257 PolarHBondContact O-N 3.13Å; H255-E258 WeakPolarHBondContact CA-OE2 3.43Å; H255-E258 IonicContact CE1-OE2 3.7Å; H255-E258 IonicContact CG-OE2 3.57Å; H255-E258 IonicContact ND1-OE2 2.89Å; H255-E258 PolarHBondContact ND1-OE2 3.27Å; H255-E258 PolarHBondContact O-N 3.23Å; H255-E258 VanDerWaalsContact O-N 3.13Å; H255-N259 PolarHBondContact O-N 2.91Å
256	R	32	Very low	33.5	Very low	213 Å²	213	131.3 Å²	131.3	80%	0.804	65%	0.654	S	S	*	*	H	α-helix	trans	-70.9	-18.2	175.6	-155.5	179.8	-161.5	124.7	4.2	112.9	S252 D254	S252-R256 WeakPolarHBondContact O-CB 3.21Å; S252-R256 PolarHBondContact O-N 3.03Å; D254-R256 VanDerWaalsContact C-N 3.32Å; D254-R256 PolarHBondContact O-N 3.37Å
257	Q	38.6	Very low	32.7	Very low	142 Å²	142	130.9 Å²	130.9	66%	0.664	67%	0.671	S	S	*	*	H	α-helix	trans	-87.3	-24.3	170.3	-153.3	81.8	31.1	0	0	111.5	R253 D254 H255	R253-Q257 PolarHBondContact O-N 2.75Å; D254-Q257 CarbonylContact O-C 3.6Å; D254-Q257 WeakPolarHBondContact O-CA 3.43Å; D254-Q257 VanDerWaalsContact O-CB 3.24Å; D254-Q257 WeakPolarHBondContact O-CB 3.35Å; D254-Q257 PolarHBondContact O-N 2.78Å; H255-Q257 PolarHBondContact O-N 3.13Å
258	E	36.8	Very low	32.1	Very low	101 Å²	101	132.4 Å²	132.4	47%	0.472	69%	0.692	S	S	.	*	H	α-helix	trans	-83.8	-19	-176.8	-71.1	153.9	-169	0	0	113.8	D254 H255 Y260	D254-E258 WeakPolarHBondContact O-CG 3.38Å; D254-E258 PolarHBondContact O-N 3.03Å; H255-E258 WeakPolarHBondContact CA-OE2 3.43Å; H255-E258 IonicContact CE1-OE2 3.7Å; H255-E258 IonicContact CG-OE2 3.57Å; H255-E258 IonicContact ND1-OE2 2.89Å; H255-E258 PolarHBondContact ND1-OE2 3.27Å; H255-E258 PolarHBondContact O-N 3.23Å; H255-E258 VanDerWaalsContact O-N 3.13Å; E258-Y260 VanDerWaalsContact C-N 3.32Å; E258-Y260 PolarHBondContact O-N 3.34Å
259	N	31.8	Very low	31.6	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	70%	0.699	S	S	*	*	S	Bend	trans	-90.5	20.7	-175.5	-142	2.9	0	0	0	115.1	H255	H255-N259 PolarHBondContact O-N 2.91Å
260	Y	31.1	Very low	31.1	Very low	224 Å²	224	131.8 Å²	131.8	88%	0.878	71%	0.71	S	S	*	*	S	Bend	trans	-121	82.8	165.4	-93.1	-79	0	0	0	109.7	E258	E258-Y260 VanDerWaalsContact C-N 3.32Å; E258-Y260 PolarHBondContact O-N 3.34Å
261	G	37.9	Very low	30.5	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	73%	0.731	S	S	*	*	S	Bend	trans	110.7	78.6	165.5	0	0	0	0	0	115.3
262	S	28.4	Very low	29.8	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	75%	0.751	S	S	*	*			trans	-154.2	107.8	150.2	-130.5	0	0	0	0	111.4
263	T	28.1	Very low	29.6	Very low	141 Å²	141	147.3 Å²	147.3	87%	0.865	77%	0.766	S	S	*	*			trans	-100.6	125.4	160.9	43.9	0	0	0	0	108.6
264	F	26.8	Very low	29.2	Very low	188 Å²	188	147.3 Å²	147.3	83%	0.825	78%	0.778	S	S	*	*			trans	-68.2	161.5	173.8	-84.5	-87.8	0	0	0	112.1
265	P	36.4	Very low	28.8	Very low	121 Å²	121	152.4 Å²	152.4	79%	0.786	80%	0.8	S	S	*	*				-139.9	137.8	85.6	30.7	-11.9	0	0	0	116.9
266	Q	26.3	Very low	28.2	Very low	190 Å²	190	154.1 Å²	154.1	89%	0.888	81%	0.808	S	S	*	*			trans	28.4	138.2	130.2	-105	171.4	-10.9	0	0	122.9
267	G	22.6	Very low	27.9	Very low	82 Å²	82	148 Å²	148	85%	0.845	80%	0.798	S	S	*	*			trans	148.4	131	143.2	0	0	0	0	0	115.9
268	G	24.2	Very low	27	Very low	83 Å²	83	147.6 Å²	147.6	86%	0.856	81%	0.805	S	S	*	*			trans	122.1	96.7	159	0	0	0	0	0	116.3
269	E	23.9	Very low	26.4	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	83%	0.825	S	S	*	*			trans	-72.5	152.1	167.6	-60.3	156.4	109.7	0	0	111.5
270	N	23.6	Very low	26	Very low	165 Å²	165	151.8 Å²	151.8	88%	0.882	83%	0.831	S	S	*	*				-168.6	136.3	123.9	-100.7	-44.7	0	0	0	112.5
271	R	23.6	Very low	25.7	Very low	220 Å²	220	145.3 Å²	145.3	83%	0.83	82%	0.824	S	S	*	*			trans	-74.2	151.8	166.6	-73.7	171	160.5	147.5	-8.3	109.9
272	N	24	Very low	25	Very low	169 Å²	169	150.4 Å²	150.4	90%	0.904	83%	0.828	S	S	*	*				-161.5	130.5	126.5	-99.4	-16.2	0	0	0	110.3
273	E	24.6	Very low	24.7	Very low	176 Å²	176	151.2 Å²	151.2	82%	0.822	83%	0.829	S	S	*	*			trans	-87.1	141.1	171.2	-62.9	160.3	154.3	0	0	108.4
274	N	23.4	Very low	24.5	Very low	168 Å²	168	151.5 Å²	151.5	90%	0.898	83%	0.83	S	S	*	*			trans	-163.4	154.4	135.8	-122.7	-10.1	0	0	0	112
275	E	25.6	Very low	24.4	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	83%	0.834	S	S	*	*			trans	-98.1	169.3	-163.1	-57.3	-168	122.1	0	0	115.2
276	E	22.6	Very low	23.8	Very low	169 Å²	169	153.5 Å²	153.5	79%	0.79	84%	0.837	S	S	*	*			trans	98.3	145.9	133.9	-113.8	-150.5	102.5	0	0	123.4
277	S	24.7	Very low	23.8	Very low	83 Å²	83	149.3 Å²	149.3	58%	0.58	83%	0.828	S	S	*	*			trans	77.5	80.2	148.8	-86.2	0	0	0	0	121.8
278	T	20.7	Very low	23.9	Very low	134 Å²	134	150.2 Å²	150.2	82%	0.822	83%	0.828	S	S	*	*				32.9	130	122.7	65.5	0	0	0	0	122.7
279	S	24.8	Very low	24	Very low	127 Å²	127	152 Å²	152	89%	0.888	83%	0.827	S	S	*	*			trans	-169.3	164.5	131.1	40.6	0	0	0	0	112.7
280	K	23.4	Very low	24.2	Very low	209 Å²	209	151.4 Å²	151.4	91%	0.909	82%	0.817	S	S	*	*			trans	-101.9	155.6	-167.1	-60.1	168.5	175.5	174.9	0	113.5
281	A	24	Very low	24.3	Very low	89 Å²	89	147.8 Å²	147.8	74%	0.736	82%	0.819	S	S	*	*			trans	155.5	108.8	140.7	0	0	0	0	0	108.9
282	E	23.8	Very low	24.5	Very low	180 Å²	180	144.3 Å²	144.3	84%	0.841	81%	0.812	S	S	*	*				80.7	105.7	83.1	-76.9	-170.4	153.2	0	0	115.8
283	T	22.5	Very low	24.7	Very low	126 Å²	126	143 Å²	143	77%	0.773	81%	0.811	S	S	*	*			trans	41.4	125.7	144.6	58.2	0	0	0	0	121.6
284	T	23.9	Very low	24.8	Very low	147 Å²	147	139 Å²	139	90%	0.902	81%	0.808	S	S	*	*				-164.1	154.4	116.3	12.7	0	0	0	0	111.5
285	E	24.2	Very low	25.1	Very low	191 Å²	191	135 Å²	135	89%	0.893	81%	0.806	S	S	*	*			trans	-81.9	148.7	-174.5	-51.1	175.9	135.7	0	0	111.8
286	D	22.6	Very low	25.2	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	81%	0.806	S	S	*	*			trans	-152.2	169.4	155.7	-147.2	-7.4	0	0	0	114.2
287	S	26.2	Very low	25.2	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	81%	0.81	S	S	*	*			trans	-106.7	147.3	-133	-50.7	0	0	0	0	113.8
288	A	26.2	Very low	25.3	Very low	102 Å²	102	143.5 Å²	143.5	84%	0.843	83%	0.825	S	S	*	*			trans	-71.6	144.9	-176.9	0	0	0	0	0	114.3
289	S	26.7	Very low	25.5	Very low	119 Å²	119	146.3 Å²	146.3	83%	0.832	83%	0.825	S	S	*	*			trans	-161.4	101.2	137.5	45.7	0	0	0	0	112.6
290	R	27	Very low	25.7	Very low	171 Å²	171	148.8 Å²	148.8	65%	0.645	82%	0.823	S	S	*	*			trans	-124.7	117	162.7	-65.6	-173.3	70.5	101	9.8	108.5	E292 S474	R290-E292 PolarHBondContact O-N 3.25Å; R290-S474 PolarHBondContact NH2-OG 3.02Å
291	G	25.8	Very low	25.7	Very low	89 Å²	89	148.3 Å²	148.3	92%	0.918	82%	0.821	S	S	*	*			trans	-72.6	108.6	174.7	0	0	0	0	0	110.9
292	E	27.8	Very low	25.7	Very low	147 Å²	147	147.3 Å²	147.3	69%	0.687	82%	0.819	S	S	*	*			trans	-94.8	121.9	164.5	-68.8	-170.8	136.7	0	0	109.3	R290 A294	R290-E292 PolarHBondContact O-N 3.25Å; E292-A294 VanDerWaalsContact C-N 3.31Å; E292-A294 PolarHBondContact O-N 3.25Å
293	T	29	Very low	25.8	Very low	143 Å²	143	146.1 Å²	146.1	88%	0.877	81%	0.814	S	S	*	*			trans	-74.8	83.4	172.2	49.9	0	0	0	0	110.1
294	A	26.4	Very low	25.9	Very low	92 Å²	92	148.4 Å²	148.4	76%	0.76	81%	0.813	S	S	*	*			trans	-90.7	110.1	167.2	0	0	0	0	0	109.8	E292	E292-A294 VanDerWaalsContact C-N 3.31Å; E292-A294 PolarHBondContact O-N 3.25Å
295	G	29	Very low	26	Very low	83 Å²	83	152.2 Å²	152.2	86%	0.856	81%	0.811	S	S	*	*			trans	-71.8	136.5	166.2	0	0	0	0	0	110.2
296	R	27.2	Very low	26.2	Very low	217 Å²	217	150.8 Å²	150.8	82%	0.819	81%	0.809	S	S	*	*			trans	-137.6	134.6	165	-154.6	177.1	-167.9	-176.3	2.8	111.5
297	F	22.9	Very low	26.4	Very low	197 Å²	197	151.6 Å²	151.6	86%	0.864	81%	0.808	S	S	*	*			trans	-48.3	144.2	162.7	-93.5	-123.7	0	0	0	111.6
298	Q	26.4	Very low	26.4	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	82%	0.817	S	S	*	*			trans	-63.5	145.9	164	-69.4	162.4	-53.8	0	0	110.3
299	K	26.2	Very low	26.3	Very low	192 Å²	192	154 Å²	154	84%	0.835	81%	0.808	S	S	*	*			trans	-144.7	117.1	150.9	-152.8	-179.8	-174.6	-169.5	0	107.5
300	E	28.9	Very low	26.4	Very low	179 Å²	179	158 Å²	158	84%	0.836	81%	0.81	S	S	*	*			trans	-67.9	137.4	177.3	-61.1	170.6	131.1	0	0	109.9
301	F	23	Very low	26.2	Very low	199 Å²	199	157 Å²	157	87%	0.873	82%	0.823	S	S	*	*			trans	-146.3	115	144.3	-100.3	-81.7	0	0	0	105.5
302	G	24.7	Very low	26.3	Very low	68 Å²	68	156.4 Å²	156.4	70%	0.701	82%	0.817	S	S	*	*			trans	-94	144.6	171.9	0	0	0	0	0	109.5
303	E	24.6	Very low	26.3	Very low	156 Å²	156	158.8 Å²	158.8	73%	0.729	83%	0.829	S	S	*	*			trans	-147.5	129.9	152.2	-116.1	-177.5	136	0	0	112.1
304	K	25.7	Very low	26.1	Very low	174 Å²	174	163 Å²	163	76%	0.757	83%	0.828	S	S	*	*			trans	47.1	127.5	148.6	-67.4	159.1	-171.7	161.6	0	119.9
305	R	25.5	Very low	26.1	Very low	227 Å²	227	167.1 Å²	167.1	86%	0.857	83%	0.832	S	S	*	*			trans	-115.3	107.2	176.5	176.2	-158.8	-54.4	-179	2.8	106.5
306	D	27.8	Very low	26.1	Very low	160 Å²	160	170.6 Å²	170.6	86%	0.856	83%	0.826	S	S	*	*			trans	-90.6	143.5	169.9	-71	-43.5	0	0	0	110.8
307	Q	27.1	Very low	26	Very low	177 Å²	177	169 Å²	169	83%	0.827	83%	0.825	S	S	*	*			trans	-105.3	123.3	-176.3	-59.8	173.8	11	0	0	110
308	E	26.1	Very low	26.4	Very low	190 Å²	190	166.2 Å²	166.2	89%	0.888	82%	0.818	S	S	*	*			trans	-147.8	139	142.6	-66.5	-162	150.2	0	0	106.8
309	G	24.8	Very low	26.7	Very low	64 Å²	64	163 Å²	163	66%	0.66	81%	0.813	S	S	*	*			cis	122.7	71.5	5.5	0	0	0	0	0	111.9
310	K	28.2	Very low	26.8	Very low	203 Å²	203	162.1 Å²	162.1	88%	0.883	81%	0.812	S	S	*	*			trans	-162.9	115.3	158.7	-106.2	138.3	-167.8	166.5	0	113.5
311	T	23.9	Very low	26.8	Very low	150 Å²	150	160.1 Å²	160.1	92%	0.92	80%	0.803	S	S	*	*			trans	-84.9	158.3	160.5	41.2	0	0	0	0	110.2
312	G	26.3	Very low	27.1	Very low	77 Å²	77	158.3 Å²	158.3	79%	0.794	79%	0.794	S	S	*	*			trans	177.3	113.7	174	0	0	0	0	0	112.3
313	E	28.1	Very low	27	Very low	197 Å²	197	161.4 Å²	161.4	92%	0.921	80%	0.8	S	S	*	*			trans	-79.9	158.6	-173.9	-54.4	157.7	93.5	0	0	113.2
314	R	24.8	Very low	27.1	Very low	231 Å²	231	157.2 Å²	157.2	87%	0.872	80%	0.799	S	S	*	*				-170.5	139.2	110.9	-151	164.2	-171.7	170.9	2.2	113.4
315	Q	27	Very low	27.1	Very low	178 Å²	178	157.9 Å²	157.9	83%	0.832	80%	0.802	S	S	*	*			trans	-95.6	152.9	173.4	-59.1	171.6	-2.3	0	0	112.7
316	Q	28.1	Very low	27.1	Very low	157 Å²	157	152.2 Å²	152.2	73%	0.734	79%	0.785	S	S	*	*			trans	169.4	149.7	146.2	-99.8	170	80.3	0	0	109.2
317	K	25.6	Very low	27.1	Very low	182 Å²	182	152 Å²	152	79%	0.791	78%	0.776	S	S	*	*			cis	-162.2	152.7	-11.3	-141.7	174.8	-173.5	179.5	0	107.5
318	I	30.6	Very low	27.1	Very low	140 Å²	140	152.7 Å²	152.7	72%	0.718	77%	0.771	S	S	*	*			trans	-82.6	162.8	169.8	-35.3	175.4	0	0	0	109.2	E320	I318-E320 HydrophobicContact CG2-CG 4.44Å
319	P	34.3	Very low	27	Very low	123 Å²	123	150.1 Å²	150.1	80%	0.799	76%	0.763	S	S	*	*				-142.7	158.6	99.3	38.3	-24.3	0	0	0	116.2
320	E	27.9	Very low	27.1	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	77%	0.77	S	S	*	*			trans	-77.9	174.5	167.4	-53.8	-176.4	137.5	0	0	110	I318	I318-E320 HydrophobicContact CG2-CG 4.44Å
321	E	28.6	Very low	26.9	Very low	136 Å²	136	146.1 Å²	146.1	64%	0.636	76%	0.762	S	S	*	*				-179.4	168.1	59	-144.6	-162	139.6	0	0	113.1
322	K	30.1	Very low	28	Very low	161 Å²	161	145.4 Å²	145.4	70%	0.7	76%	0.76	S	S	*	*			trans	75.7	139.9	156.4	-75.9	157.4	173.3	131.9	0	118.8
323	T	22.8	Very low	28	Very low	134 Å²	134	146.7 Å²	146.7	82%	0.822	76%	0.763	S	S	*	*			cis	-139.5	161	13	49.3	0	0	0	0	114.4
324	G	24.9	Very low	27.9	Very low	68 Å²	68	144.4 Å²	144.4	70%	0.701	76%	0.762	S	S	*	*			trans	-57.9	-173.8	174.5	0	0	0	0	0	117.1
325	K	27.1	Very low	28	Very low	188 Å²	188	136.9 Å²	136.9	82%	0.817	76%	0.757	S	S	*	*			cis	-167	173.9	35	-83.2	-178.6	152.3	-140.4	0	108.9
326	E	24.5	Very low	28.1	Very low	107 Å²	107	137.6 Å²	137.6	50%	0.5	76%	0.757	S	S	.	*			cis	-166.2	149.2	-16.5	-113.8	-177.8	103.8	0	0	108.5
327	K	27.7	Very low	28.1	Very low	156 Å²	156	137.2 Å²	137.2	68%	0.678	76%	0.76	S	S	*	*			trans	59.7	144.6	144.4	-72.2	176	-178	155.6	0	119.7
328	R	27	Very low	28.3	Very low	192 Å²	192	138.7 Å²	138.7	73%	0.725	77%	0.767	S	S	*	*			cis	-162.8	162.5	16.9	-123	-174.1	-103.1	-139.7	1.1	110.7
329	D	24.7	Very low	28.2	Very low	135 Å²	135	141.4 Å²	141.4	72%	0.722	77%	0.773	S	S	*	*			trans	32.9	144.5	140.2	-47.8	-22.7	0	0	0	120.8
330	S	26.7	Very low	27.7	Very low	115 Å²	115	142 Å²	142	80%	0.804	78%	0.775	S	S	*	*			cis	-168.8	154.8	10	43.8	0	0	0	0	110.1
331	G	23.7	Very low	27.7	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	77%	0.773	S	S	*	*			trans	-95.7	-162.4	156.4	0	0	0	0	0	111.2
332	P	47.2	Very low	28	Very low	135 Å²	135	139.4 Å²	139.4	88%	0.877	78%	0.782	S	S	*	*			cis	-127.1	177.2	-26.4	39.8	-25.6	0	0	0	111.8
333	A	26	Very low	27.7	Very low	105 Å²	105	135.3 Å²	135.3	87%	0.868	79%	0.786	S	S	*	*			trans	-146.1	126.5	169.1	0	0	0	0	0	114
334	T	27.3	Very low	28	Very low	148 Å²	148	138.4 Å²	138.4	91%	0.908	79%	0.791	S	S	*	*			trans	-92.6	146.7	175.3	52.5	0	0	0	0	111.7
335	G	26.8	Very low	28.1	Very low	73 Å²	73	146.9 Å²	146.9	75%	0.753	80%	0.802	S	S	*	*			trans	-179.3	74.5	174.5	0	0	0	0	0	119.7
336	K	27.7	Very low	28.1	Very low	193 Å²	193	141 Å²	141	84%	0.839	80%	0.795	S	S	*	*			trans	36.2	121.1	141	-60	-177.6	-180	-180	0	121.7
337	D	28.5	Very low	28.5	Very low	149 Å²	149	142.3 Å²	142.3	80%	0.797	81%	0.812	S	S	*	*				42.3	119.7	128.1	-51.1	-54.9	0	0	0	121.3
338	K	30.9	Very low	28.4	Very low	213 Å²	213	145.4 Å²	145.4	93%	0.926	82%	0.82	S	S	*	*			trans	-148.3	126.7	136.5	-114.6	167.2	-170.8	177	0	112.5
339	K	27.5	Very low	28.6	Very low	198 Å²	198	145.1 Å²	145.1	86%	0.861	83%	0.827	S	S	*	*			trans	-89.8	125.5	-176.8	171.7	-175.4	179.8	179.5	0	110.5
340	T	24.6	Very low	28.9	Very low	135 Å²	135	147.1 Å²	147.1	83%	0.828	83%	0.829	S	S	*	*			trans	-152	115.2	162.2	10.8	0	0	0	0	112
341	T	26.7	Very low	28.9	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	83%	0.827	S	S	*	*			trans	-118.6	172.7	151.8	55.6	0	0	0	0	106.1
342	P	36.8	Very low	29.2	Very low	130 Å²	130	152 Å²	152	84%	0.844	84%	0.838	S	S	*	*			cis	-125.7	-171.2	0.6	41.2	-24.9	0	0	0	113
343	G	23.8	Very low	28.2	Very low	75 Å²	75	149.1 Å²	149.1	77%	0.773	83%	0.832	S	S	*	*			trans	178	85	171.5	0	0	0	0	0	113.4
344	E	29.1	Very low	28.4	Very low	199 Å²	199	151.9 Å²	151.9	93%	0.93	83%	0.832	S	S	*	*			trans	-59.8	145.4	171.9	-63.9	176	101.6	0	0	111.7
345	R	26.1	Very low	28.5	Very low	247 Å²	247	148.8 Å²	148.8	93%	0.932	83%	0.829	S	S	*	*			trans	-149.6	122.7	154.2	-139.3	175.7	-63.8	-128.5	2.3	110.6
346	G	27.8	Very low	28.5	Very low	65 Å²	65	154.7 Å²	154.7	67%	0.67	83%	0.828	S	S	*	*			trans	-71.4	-171.1	-177.9	0	0	0	0	0	114.8
347	P	31.5	Very low	28.4	Very low	133 Å²	133	150.6 Å²	150.6	86%	0.864	82%	0.824	S	S	*	*			trans	-74.6	148.4	-157	30.6	-36.6	0	0	0	113.2
348	R	25.2	Very low	28.2	Very low	222 Å²	222	151.6 Å²	151.6	84%	0.838	82%	0.822	S	S	*	*			trans	-103.2	93.8	173.5	-160.4	-179.3	-159.1	-172.7	7.9	109.9	K350	R348-K350 PolarHBondContact O-N 3.23Å
349	E	31.6	Very low	28.1	Very low	185 Å²	185	146.2 Å²	146.2	86%	0.864	81%	0.811	S	S	*	*			trans	-59.6	133.4	161.8	-75.8	-153.3	135.9	0	0	110.4
350	K	31.3	Very low	28.1	Very low	177 Å²	177	143.7 Å²	143.7	77%	0.77	81%	0.806	S	S	*	*			trans	-147.7	115.5	148.5	-75.6	-156.6	173.7	-167	0	108.5	R348	R348-K350 PolarHBondContact O-N 3.23Å
351	G	27.1	Very low	28.3	Very low	74 Å²	74	142 Å²	142	76%	0.763	80%	0.8	S	S	*	*			trans	-83.2	-163.3	172.6	0	0	0	0	0	113.4
352	K	29.1	Very low	28.3	Very low	213 Å²	213	141.3 Å²	141.3	93%	0.926	80%	0.8	S	S	*	*			trans	79.3	80.5	177.5	-54.7	-167	178	-170.7	0	116
353	G	27.6	Very low	27.9	Very low	74 Å²	74	141.9 Å²	141.9	76%	0.763	80%	0.796	S	S	*	*				26.8	123.8	123.9	0	0	0	0	0	120.6
354	L	30.4	Very low	28.3	Very low	163 Å²	163	148.6 Å²	148.6	85%	0.853	80%	0.804	S	S	*	*			trans	-137.8	108.5	138.4	-82.4	179.6	0	0	0	108.1	R356	L354-R356 PolarHBondContact O-N 3.26Å; L354-R356 VanDerWaalsContact O-N 3.17Å
355	G	27.8	Very low	28.3	Very low	83 Å²	83	145 Å²	145	86%	0.856	80%	0.796	S	S	*	*			trans	-69.2	106	164.2	0	0	0	0	0	108.5
356	R	27.2	Very low	28.5	Very low	196 Å²	196	139 Å²	139	74%	0.74	79%	0.787	S	S	*	*			trans	-94.8	94.6	168.5	-91.8	-179.3	148.8	-131.8	-3.3	108.7	L354 F358	L354-R356 PolarHBondContact O-N 3.26Å; L354-R356 VanDerWaalsContact O-N 3.17Å; R356-F358 PolarHBondContact O-N 3.05Å
357	S	26.7	Very low	29.2	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	80%	0.796	S	S	*	*			trans	-56.3	120	157.9	38.4	0	0	0	0	108.6
358	F	24.5	Very low	29.2	Very low	171 Å²	171	144.4 Å²	144.4	75%	0.75	80%	0.795	S	S	*	*			trans	-98.2	87.4	168	-100.5	-86.4	0	0	0	107.9	R356 L360	R356-F358 PolarHBondContact O-N 3.05Å; F358-L360 PolarHBondContact O-N 2.99Å
359	S	27.4	Very low	30.2	Very low	100 Å²	100	142.8 Å²	142.8	70%	0.699	80%	0.796	S	S	*	*			trans	-67.5	115.4	170	-49.7	0	0	0	0	109	S361	S359-S361 PolarHBondContact O-N 2.86Å
360	L	28.3	Very low	31.1	Very low	145 Å²	145	139.6 Å²	139.6	76%	0.759	79%	0.79	S	S	*	*			trans	-85.4	83.2	174.2	-99.3	162.3	0	0	0	109.8	F358 Y461	F358-L360 PolarHBondContact O-N 2.99Å; L360-Y461 HydrophobicContact CD1-CE1 4.49Å
361	S	27.4	Very low	32.1	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	79%	0.789	S	S	*	*			trans	-101	95.4	165.5	-58.8	0	0	0	0	108.9	S359 N363	S359-S361 PolarHBondContact O-N 2.86Å; S361-N363 VanDerWaalsContact C-N 3.33Å; S361-N363 PolarHBondContact O-N 3.39Å; S361-N363 VanDerWaalsContact O-N 3.14Å
362	S	26.8	Very low	33.2	Very low	108 Å²	108	140 Å²	140	76%	0.755	79%	0.794	S	S	*	*			trans	-84.5	75	173.9	60.6	0	0	0	0	110.8
363	N	29.1	Very low	34.5	Very low	142 Å²	142	133.6 Å²	133.6	76%	0.759	79%	0.789	S	S	*	*			trans	-84	136.2	163.5	-76.3	-6.6	0	0	0	109.4	S361 T365	S361-N363 VanDerWaalsContact C-N 3.33Å; S361-N363 PolarHBondContact O-N 3.39Å; S361-N363 VanDerWaalsContact O-N 3.14Å; N363-T365 PolarHBondContact O-N 3.44Å
364	F	31.9	Very low	36.1	Very low	217 Å²	217	135.3 Å²	135.3	95%	0.952	79%	0.785	S	S	*	*			trans	-54.5	127.2	174.5	-85.4	-109.8	0	0	0	110.1
365	T	28.8	Very low	37.7	Very low	124 Å²	124	136.3 Å²	136.3	76%	0.761	78%	0.782	S	S	*	*			trans	-114.7	124.2	163.1	-48.2	0	0	0	0	107.1	N363	N363-T365 PolarHBondContact O-N 3.44Å
366	T	31.5	Very low	40.1	Very low	120 Å²	120	136 Å²	136	74%	0.736	77%	0.767	S	S	*	*			trans	-59.4	159.5	170.4	36.8	0	0	0	0	110.8	E368	T366-E368 PolarHBondContact O-N 3.11Å
367	P	41.9	Very low	42.9	Very low	132 Å²	132	129.8 Å²	129.8	86%	0.857	75%	0.746	S	S	*	*			trans	-72.4	90.1	-175.4	29.7	-35.5	0	0	0	111.4
368	E	32.2	Very low	45.8	Very low	180 Å²	180	132.2 Å²	132.2	84%	0.841	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-74.8	147.2	167.2	-154.4	-178.5	-162.2	0	0	110.6	T366	T366-E368 PolarHBondContact O-N 3.11Å
369	E	44.8	Very low	48.9	Very low	187 Å²	187	124 Å²	124	87%	0.874	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71	147.5	-159.4	-61.5	-156.7	139.9	0	0	115.3
370	V	51.9	Low	51.8	Low	119 Å²	119	125.1 Å²	125.1	72%	0.721	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-72.8	128	-177.3	176.9	0	0	0	0	110.9	T372	V370-T372 PolarHBondContact O-N 2.84Å
371	P	51.8	Low	54.6	Low	116 Å²	116	123.8 Å²	123.8	75%	0.753	69%	0.691	S	S	*	*			trans	-59.6	114.5	168.9	-24.1	34.7	0	0	0	111.4
372	T	51.1	Low	57.6	Low	142 Å²	142	121.2 Å²	121.2	87%	0.871	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	134.4	-178.6	49	0	0	0	0	112.1	V370	V370-T372 PolarHBondContact O-N 2.84Å
373	G	55.1	Low	60.4	Low	80 Å²	80	117.6 Å²	117.6	83%	0.825	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.8	-16.1	165.3	0	0	0	0	0	116.9
374	T	61.3	Low	63.3	Low	109 Å²	109	116.9 Å²	116.9	67%	0.669	64%	0.642	S	S	*	*			trans	-86.8	124.2	174.8	55.5	0	0	0	0	111.2	S376	T374-S376 PolarHBondContact O-N 3.22Å
375	K	63.8	Low	66	Low	185 Å²	185	110 Å²	110	80%	0.804	62%	0.621	S	S	*	*			trans	-63.8	104.3	172.2	-73.5	-177.5	177.7	178.9	0	108.9
376	S	79.4	Confident	69	Low	76 Å²	76	106.3 Å²	106.3	53%	0.531	59%	0.594	S	S	.	*			trans	-86	141.8	174.5	74.4	0	0	0	0	110.5	T374	T374-S376 PolarHBondContact O-N 3.22Å
377	H	84.7	Confident	71.8	Confident	65 Å²	65	106.2 Å²	106.2	30%	0.301	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	101.3	179.2	-67.6	-84	0	0	0	108	F386 R388 S389 L392	H377-F386 PolarHBondContact N-O 3.47Å; H377-F386 WeakPolarHBondContact O-CD2 3.24Å; H377-F386 PolarHBondContact O-N 3.48Å; H377-R388 VanDerWaalsContact CD2-C 3.46Å; H377-S389 PolarHBondContact CD2-N 2.8Å; H377-S389 PolarHBondContact NE2-N 2.71Å; H377-L392 HydrophobicContact CB-CB 3.97Å; H377-L392 HydrophobicContact CB-CD2 3.79Å
378	R	88	Confident	74	Confident	158 Å²	158	107.5 Å²	107.5	60%	0.596	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.3	143.7	179.1	172	171.8	-91.3	-165.2	-2.9	111.4	G383 K384 L392	R378-G383 PolarHBondContact NE-O 3.11Å; R378-K384 CarbonylContact C-O 3.57Å; R378-L392 WeakPolarHBondContact O-CD2 3.4Å
379	C	90.5	Very high	76.6	Confident	0 Å²	0	101.8 Å²	101.8	0%	0	56%	0.561	C	S	.	*			trans	-86.8	127.8	165.3	-169.3	0	0	0	0	110.4	E381 G383 K384 F386 L392 H395 H399	C379-E381 VanDerWaalsContact C-N 3.33Å; C379-G383 WeakPolarHBondContact O-CA 3.02Å; C379-G383 PolarHBondContact O-N 3.01Å; C379-K384 PolarHBondContact N-O 2.8Å; C379-F386 HydrophobicContact CB-CE2 4.26Å; C379-L392 HydrophobicContact CB-CD1 3.58Å; C379-H395 PolarHBondContact SG-CD2 2.81Å; C379-H395 PolarHBondContact SG-NE2 2.86Å; C379-H395 VanDerWaalsContact SG-NE2 3.38Å; C379-H399 PolarHBondContact SG-NE2 2.82Å
380	D	86.8	Confident	78.6	Confident	122 Å²	122	95.4 Å²	95.4	65%	0.652	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-28.2	-175.1	-44.1	-69	0	0	0	112.1	K396	D380-K396 IonicContact OD2-NZ 2.69Å; D380-K396 PolarHBondContact OD2-NZ 3.24Å
381	E	87.6	Confident	80.3	Confident	118 Å²	118	90.9 Å²	90.9	55%	0.551	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-25.9	-174.4	-64.6	174.9	-113.2	0	0	114.1	C379 H399	C379-E381 VanDerWaalsContact C-N 3.33Å; E381-H399 IonicContact OE1-CG 3.41Å; E381-H399 VanDerWaalsContact OE2-CB 3.26Å; E381-H399 WeakPolarHBondContact OE2-CB 3.11Å; E381-H399 IonicContact OE2-CG 3.96Å; E381-H399 IonicContact OE2-ND1 3.85Å
382	C	90.1	Very high	82.1	Confident	45 Å²	45	86.4 Å²	86.4	30%	0.304	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	13.5	-178.9	70.5	0	0	0	0	114.7	K384 H395 H399	C382-K384 PolarHBondContact O-N 3.34Å; C382-H395 PolarHBondContact SG-NE2 3.3Å; C382-H399 WeakPolarHBondContact CB-CE1 3.36Å; C382-H399 PolarHBondContact SG-CE1 3.5Å; C382-H399 PolarHBondContact SG-NE2 3.41Å
383	G	86.9	Confident	83.7	Confident	32 Å²	32	85 Å²	85	33%	0.33	47%	0.466	S	S	.	.			trans	68.7	-9.9	175.4	0	0	0	0	0	116.7	R378 C379 C385	R378-G383 PolarHBondContact NE-O 3.11Å; C379-G383 WeakPolarHBondContact O-CA 3.02Å; C379-G383 PolarHBondContact O-N 3.01Å; G383-C385 PolarHBondContact O-N 2.81Å
384	K	88.3	Confident	85.1	Confident	127 Å²	127	87.5 Å²	87.5	55%	0.552	45%	0.451	S	S	*	.			trans	-61.1	128.4	-174.5	-69.5	178.2	-175.5	175.2	0	111.8	R378 C379 C382 F386	R378-K384 CarbonylContact C-O 3.57Å; C379-K384 PolarHBondContact N-O 2.8Å; C382-K384 PolarHBondContact O-N 3.34Å; K384-F386 HydrophobicContact CB-CE2 3.86Å; K384-F386 HydrophobicContact CB-CZ 4.03Å; K384-F386 WeakPolarHBondContact O-CD2 3.38Å; K384-F386 WeakPolarHBondContact O-CE2 3.16Å
385	C	90.5	Very high	86.4	Confident	74 Å²	74	83.2 Å²	83.2	50%	0.5	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136.4	-179.7	-66.1	0	0	0	0	111.8	G383	G383-C385 PolarHBondContact O-N 2.81Å
386	F	90.3	Very high	87.5	Confident	46 Å²	46	77.8 Å²	77.8	20%	0.202	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140.3	-179.8	-61.5	-87.1	0	0	0	111.2	H377 C379 K384 R388 L392 H395	H377-F386 PolarHBondContact N-O 3.47Å; H377-F386 WeakPolarHBondContact O-CD2 3.24Å; H377-F386 PolarHBondContact O-N 3.48Å; C379-F386 HydrophobicContact CB-CE2 4.26Å; K384-F386 HydrophobicContact CB-CE2 3.86Å; K384-F386 HydrophobicContact CB-CZ 4.03Å; K384-F386 WeakPolarHBondContact O-CD2 3.38Å; K384-F386 WeakPolarHBondContact O-CE2 3.16Å; F386-R388 PolarHBondContact O-N 3.23Å; F386-L392 HydrophobicContact CB-CB 4.3Å; F386-L392 HydrophobicContact CD2-CB 3.94Å; F386-L392 HydrophobicContact CD2-CD1 3.86Å; F386-L392 HydrophobicContact CE2-CD1 4.06Å; F386-L392 HydrophobicContact CG-CB 4.3Å; F386-H395 HydrophobicContact CE1-CB 4.01Å; F386-H395 HydrophobicContact CE2-CB 3.88Å; F386-H395 AromaticContact CE2-CD2 3.32Å; F386-H395 WeakPolarHBondContact CE2-CD2 3.35Å; F386-H395 AromaticContact CE2-CG 3.63Å; F386-H395 HydrophobicContact CZ-CB 3.48Å; F386-H395 VanDerWaalsContact CZ-CB 3.48Å; F386-H395 AromaticContact CZ-CD2 3.43Å; F386-H395 VanDerWaalsContact CZ-CD2 3.43Å; F386-H395 WeakPolarHBondContact CZ-CD2 3.16Å; F386-H395 AromaticContact CZ-CG 3.26Å; F386-H395 AromaticContact CZ-ND1 3.85Å
387	T	90.1	Very high	87.8	Confident	117 Å²	117	75.7 Å²	75.7	72%	0.718	38%	0.382	S	S	*	.	S	Bend	trans	-71.8	-7.2	177.1	53.6	0	0	0	0	114.2
388	R	88.8	Confident	87.8	Confident	160 Å²	160	78.3 Å²	78.3	60%	0.604	40%	0.397	S	S	*	.	S	Bend	trans	-144.8	136.4	-177.2	-68.5	176.5	58	160.2	1	111.2	H377 F386 S390 S391 L392	H377-R388 VanDerWaalsContact CD2-C 3.46Å; F386-R388 PolarHBondContact O-N 3.23Å; R388-S390 VanDerWaalsContact C-N 3.28Å; R388-S390 PolarHBondContact NE-OG 3.41Å; R388-S390 PolarHBondContact O-N 2.86Å; R388-S391 WeakPolarHBondContact O-CB 3.35Å; R388-S391 PolarHBondContact O-N 2.77Å; R388-L392 PolarHBondContact O-N 2.87Å
389	S	87.5	Confident	87.7	Confident	59 Å²	59	74.6 Å²	74.6	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-53.9	-42.9	173.7	55.7	0	0	0	0	112.5	H377 S391 L392 I393	H377-S389 PolarHBondContact CD2-N 2.8Å; H377-S389 PolarHBondContact NE2-N 2.71Å; S389-S391 PolarHBondContact O-N 3.04Å; S389-L392 PolarHBondContact O-N 2.93Å; S389-L392 VanDerWaalsContact O-N 3.09Å; S389-I393 WeakPolarHBondContact O-CG1 3.3Å; S389-I393 PolarHBondContact O-N 3.4Å
390	S	86.6	Confident	87.4	Confident	54 Å²	54	78.3 Å²	78.3	38%	0.378	41%	0.409	S	S	.	.	H	α-helix	trans	-58.6	-31.8	176.6	60.7	0	0	0	0	113.4	R388 R394	R388-S390 VanDerWaalsContact C-N 3.28Å; R388-S390 PolarHBondContact NE-OG 3.41Å; R388-S390 PolarHBondContact O-N 2.86Å; S390-R394 WeakPolarHBondContact O-CB 3.36Å; S390-R394 PolarHBondContact O-N 2.97Å
391	S	87.8	Confident	87.3	Confident	24 Å²	24	74.8 Å²	74.8	17%	0.168	40%	0.401	C	S	.	.	H	α-helix	trans	-76.6	-37.8	176.7	-63.6	0	0	0	0	111.5	R388 S389 H395	R388-S391 WeakPolarHBondContact O-CB 3.35Å; R388-S391 PolarHBondContact O-N 2.77Å; S389-S391 PolarHBondContact O-N 3.04Å; S391-H395 WeakPolarHBondContact O-CB 3.33Å; S391-H395 PolarHBondContact O-N 2.97Å
392	L	88.1	Confident	87.2	Confident	22 Å²	22	74.7 Å²	74.7	12%	0.115	40%	0.401	C	S	.	.	H	α-helix	trans	-64.2	-47.6	172.2	172.7	62	0	0	0	111.4	H377 R378 C379 F386 R388 S389 R394 H395 K396	H377-L392 HydrophobicContact CB-CB 3.97Å; H377-L392 HydrophobicContact CB-CD2 3.79Å; R378-L392 WeakPolarHBondContact O-CD2 3.4Å; C379-L392 HydrophobicContact CB-CD1 3.58Å; F386-L392 HydrophobicContact CB-CB 4.3Å; F386-L392 HydrophobicContact CD2-CB 3.94Å; F386-L392 HydrophobicContact CD2-CD1 3.86Å; F386-L392 HydrophobicContact CE2-CD1 4.06Å; F386-L392 HydrophobicContact CG-CB 4.3Å; R388-L392 PolarHBondContact O-N 2.87Å; S389-L392 PolarHBondContact O-N 2.93Å; S389-L392 VanDerWaalsContact O-N 3.09Å; L392-R394 VanDerWaalsContact C-N 3.33Å; L392-R394 PolarHBondContact O-N 3.47Å; L392-H395 CarbonylContact O-C 3.53Å; L392-H395 WeakPolarHBondContact O-CA 3.26Å; L392-H395 WeakPolarHBondContact O-CB 3.36Å; L392-H395 PolarHBondContact O-N 2.88Å; L392-K396 HydrophobicContact CD1-CG 4.23Å; L392-K396 PolarHBondContact O-N 3.32Å
393	I	85.4	Confident	87.1	Confident	112 Å²	112	78.7 Å²	78.7	57%	0.574	41%	0.413	S	S	*	.	H	α-helix	trans	-56.7	-49.7	178.2	-67.6	164	0	0	0	109.9	S389 H395 K396 I397	S389-I393 WeakPolarHBondContact O-CG1 3.3Å; S389-I393 PolarHBondContact O-N 3.4Å; I393-H395 PolarHBondContact O-N 3.32Å; I393-K396 PolarHBondContact O-N 3.25Å; I393-K396 VanDerWaalsContact O-N 3.16Å; I393-I397 PolarHBondContact O-N 2.92Å
394	R	85.6	Confident	87	Confident	132 Å²	132	81.1 Å²	81.1	50%	0.498	42%	0.423	S	S	.	.	H	α-helix	trans	-57.1	-35.9	173.6	170.4	168.5	70.3	179	4.1	113.3	S390 L392 I397 L416	S390-R394 WeakPolarHBondContact O-CB 3.36Å; S390-R394 PolarHBondContact O-N 2.97Å; L392-R394 VanDerWaalsContact C-N 3.33Å; L392-R394 PolarHBondContact O-N 3.47Å; R394-I397 WeakPolarHBondContact O-CB 3.28Å; R394-L416 VanDerWaalsContact CD-CD2 3.48Å; R394-L416 HydrophobicContact CG-CD2 3.85Å
395	H	87.6	Confident	87.1	Confident	19 Å²	19	79.5 Å²	79.5	9%	0.088	41%	0.414	C	S	.	.	H	α-helix	trans	-73	-35.4	178.5	169.5	62.4	0	0	0	112.3	C379 C382 F386 S391 L392 I393 I397 I398 H399	C379-H395 PolarHBondContact SG-CD2 2.81Å; C379-H395 PolarHBondContact SG-NE2 2.86Å; C379-H395 VanDerWaalsContact SG-NE2 3.38Å; C382-H395 PolarHBondContact SG-NE2 3.3Å; F386-H395 HydrophobicContact CE1-CB 4.01Å; F386-H395 HydrophobicContact CE2-CB 3.88Å; F386-H395 AromaticContact CE2-CD2 3.32Å; F386-H395 WeakPolarHBondContact CE2-CD2 3.35Å; F386-H395 AromaticContact CE2-CG 3.63Å; F386-H395 HydrophobicContact CZ-CB 3.48Å; F386-H395 VanDerWaalsContact CZ-CB 3.48Å; F386-H395 AromaticContact CZ-CD2 3.43Å; F386-H395 VanDerWaalsContact CZ-CD2 3.43Å; F386-H395 WeakPolarHBondContact CZ-CD2 3.16Å; F386-H395 AromaticContact CZ-CG 3.26Å; F386-H395 AromaticContact CZ-ND1 3.85Å; S391-H395 WeakPolarHBondContact O-CB 3.33Å; S391-H395 PolarHBondContact O-N 2.97Å; L392-H395 CarbonylContact O-C 3.53Å; L392-H395 WeakPolarHBondContact O-CA 3.26Å; L392-H395 WeakPolarHBondContact O-CB 3.36Å; L392-H395 PolarHBondContact O-N 2.88Å; I393-H395 PolarHBondContact O-N 3.32Å; H395-I397 PolarHBondContact O-N 3.04Å; H395-I398 VanDerWaalsContact O-CB 3.26Å; H395-I398 WeakPolarHBondContact O-CB 3.36Å; H395-I398 WeakPolarHBondContact O-CG1 3.2Å; H395-I398 PolarHBondContact O-N 2.86Å; H395-H399 AromaticContact CD2-NE2 3.49Å; H395-H399 PolarHBondContact CD2-NE2 2.79Å; H395-H399 AromaticContact CE1-NE2 3.06Å; H395-H399 PolarHBondContact CE1-NE2 3.13Å; H395-H399 AromaticContact NE2-CD2 3.73Å; H395-H399 AromaticContact NE2-NE2 2.46Å; H395-H399 PolarHBondContact NE2-NE2 2.91Å
396	K	86.1	Confident	87.1	Confident	71 Å²	71	82 Å²	82	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-61	-27.6	173.4	-68.4	-162.6	173.8	-158.1	0	113.1	D380 L392 I393 I398 H399 T400	D380-K396 IonicContact OD2-NZ 2.69Å; D380-K396 PolarHBondContact OD2-NZ 3.24Å; L392-K396 HydrophobicContact CD1-CG 4.23Å; L392-K396 PolarHBondContact O-N 3.32Å; I393-K396 PolarHBondContact O-N 3.25Å; I393-K396 VanDerWaalsContact O-N 3.16Å; K396-I398 PolarHBondContact O-N 3.48Å; K396-H399 PolarHBondContact O-N 2.89Å; K396-H399 VanDerWaalsContact O-N 3.08Å; K396-T400 PolarHBondContact O-N 3.31Å; K396-T400 PolarHBondContact O-OG1 3.45Å
397	I	86.6	Confident	87.3	Confident	32 Å²	32	79.9 Å²	79.9	16%	0.164	41%	0.409	C	S	.	.	H	α-helix	trans	-61.2	-25.8	171.5	-55.8	174.5	0	0	0	112.3	I393 R394 H395 G401 E402	I393-I397 PolarHBondContact O-N 2.92Å; R394-I397 WeakPolarHBondContact O-CB 3.28Å; H395-I397 PolarHBondContact O-N 3.04Å; I397-G401 PolarHBondContact O-N 2.93Å; I397-G401 VanDerWaalsContact O-N 3.14Å; I397-E402 HydrophobicContact CG2-CB 4.26Å; I397-E402 WeakPolarHBondContact CG2-O 3.21Å
398	I	84.4	Confident	87.2	Confident	121 Å²	121	79.5 Å²	79.5	62%	0.621	41%	0.411	S	S	*	.	H	α-helix	trans	-71.1	-36.9	176.1	-55.4	176.7	0	0	0	110.6	H395 K396	H395-I398 VanDerWaalsContact O-CB 3.26Å; H395-I398 WeakPolarHBondContact O-CB 3.36Å; H395-I398 WeakPolarHBondContact O-CG1 3.2Å; H395-I398 PolarHBondContact O-N 2.86Å; K396-I398 PolarHBondContact O-N 3.48Å
399	H	86.5	Confident	87.3	Confident	79 Å²	79	77.3 Å²	77.3	37%	0.366	41%	0.408	S	S	.	.	H	α-helix	trans	-75.2	-45.9	179.5	-70.3	-66.4	0	0	0	112.4	C379 E381 C382 H395 K396 G401	C379-H399 PolarHBondContact SG-NE2 2.82Å; E381-H399 IonicContact OE1-CG 3.41Å; E381-H399 VanDerWaalsContact OE2-CB 3.26Å; E381-H399 WeakPolarHBondContact OE2-CB 3.11Å; E381-H399 IonicContact OE2-CG 3.96Å; E381-H399 IonicContact OE2-ND1 3.85Å; C382-H399 WeakPolarHBondContact CB-CE1 3.36Å; C382-H399 PolarHBondContact SG-CE1 3.5Å; C382-H399 PolarHBondContact SG-NE2 3.41Å; H395-H399 AromaticContact CD2-NE2 3.49Å; H395-H399 PolarHBondContact CD2-NE2 2.79Å; H395-H399 AromaticContact CE1-NE2 3.06Å; H395-H399 PolarHBondContact CE1-NE2 3.13Å; H395-H399 AromaticContact NE2-CD2 3.73Å; H395-H399 AromaticContact NE2-NE2 2.46Å; H395-H399 PolarHBondContact NE2-NE2 2.91Å; K396-H399 PolarHBondContact O-N 2.89Å; K396-H399 VanDerWaalsContact O-N 3.08Å; H399-G401 PolarHBondContact O-N 2.82Å
400	T	84.6	Confident	87.4	Confident	79 Å²	79	76.8 Å²	76.8	49%	0.485	40%	0.403	S	S	.	.	H	α-helix	trans	-70.5	-16.7	176.8	60.3	0	0	0	0	113.1	K396 E402	K396-T400 PolarHBondContact O-N 3.31Å; K396-T400 PolarHBondContact O-OG1 3.45Å; T400-E402 PolarHBondContact O-N 3.43Å; T400-E402 VanDerWaalsContact O-N 3.14Å
401	G	83.4	Confident	87.5	Confident	47 Å²	47	76.2 Å²	76.2	49%	0.485	41%	0.407	S	S	.	.			trans	68.8	4	-176.4	0	0	0	0	0	114.2	I397 H399	I397-G401 PolarHBondContact O-N 2.93Å; I397-G401 VanDerWaalsContact O-N 3.14Å; H399-G401 PolarHBondContact O-N 2.82Å
402	E	85.8	Confident	87.6	Confident	116 Å²	116	80.9 Å²	80.9	54%	0.542	42%	0.424	S	S	.	.			trans	-60.2	141.2	-178	-75.2	177.9	-175.4	0	0	111.6	I397 T400	I397-E402 HydrophobicContact CG2-CB 4.26Å; I397-E402 WeakPolarHBondContact CG2-O 3.21Å; T400-E402 PolarHBondContact O-N 3.43Å; T400-E402 VanDerWaalsContact O-N 3.14Å
403	K	88	Confident	87.8	Confident	130 Å²	130	81.6 Å²	81.6	57%	0.565	43%	0.433	S	S	*	.			trans	-133.6	75.6	-179.9	-71.7	166.2	179.6	175.3	0	109.7	Y405 A413 F414	K403-Y405 PolarHBondContact O-N 3.41Å; K403-A413 HydrophobicContact CB-CB 3.48Å; K403-A413 VanDerWaalsContact CB-CB 3.48Å; K403-A413 HydrophobicContact CD-CB 4.23Å; K403-A413 HydrophobicContact CG-CB 4.45Å; K403-F414 CarbonylContact C-O 3.59Å; K403-F414 VanDerWaalsContact CA-O 3.32Å; K403-F414 WeakPolarHBondContact CA-O 3.08Å
404	P	86.1	Confident	88	Confident	82 Å²	82	78.4 Å²	78.4	53%	0.532	42%	0.415	S	S	.	.			trans	-67.3	-10.3	-170.1	-21.8	34.9	0	0	0	115.2
405	Y	89.3	Confident	88.1	Confident	93 Å²	93	74 Å²	74	37%	0.365	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	93.4	-171.8	-57.5	-78	0	0	0	110.8	K403 A413 F414 L416 N417	K403-Y405 PolarHBondContact O-N 3.41Å; Y405-A413 CarbonylContact O-C 3.55Å; Y405-A413 WeakPolarHBondContact O-CA 3.49Å; Y405-F414 WeakPolarHBondContact CB-O 3.48Å; Y405-F414 PolarHBondContact N-O 2.66Å; Y405-F414 VanDerWaalsContact N-O 3.11Å; Y405-F414 PolarHBondContact O-N 3.29Å; Y405-L416 VanDerWaalsContact CD2-C 3.41Å; Y405-N417 HydrophobicContact CD1-CB 3.72Å; Y405-N417 VanDerWaalsContact CD2-N 3.27Å; Y405-N417 HydrophobicContact CE1-CB 3.6Å; Y405-N417 HydrophobicContact CE2-CB 4.39Å; Y405-N417 HydrophobicContact CG-CB 4.19Å
406	E	91.4	Very high	88.1	Confident	128 Å²	128	75 Å²	75	60%	0.598	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	140.1	-179.8	-165	177.1	163.5	0	0	113.3	G411	E406-G411 WeakPolarHBondContact OE1-CA 3.1Å
407	C	92.9	Very high	88.2	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	42%	0.417	C	S	.	.			trans	-84	111.5	171.6	-176.6	0	0	0	0	111.1	E409 C410 G411 K412 F414 L420 H427	C407-E409 PolarHBondContact O-N 3.2Å; C407-E409 VanDerWaalsContact O-N 3.07Å; C407-C410 PolarHBondContact O-N 2.86Å; C407-G411 WeakPolarHBondContact O-CA 3.45Å; C407-G411 PolarHBondContact O-N 3.28Å; C407-K412 HydrophobicContact CB-CB 4.48Å; C407-K412 WeakPolarHBondContact CB-O 3.5Å; C407-K412 PolarHBondContact N-O 3.45Å; C407-F414 HydrophobicContact CB-CE2 4.37Å; C407-L420 HydrophobicContact CB-CD1 3.59Å; C407-H427 PolarHBondContact SG-NE2 3.47Å
408	S	89.8	Confident	88.3	Confident	110 Å²	110	77.6 Å²	77.6	77%	0.769	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-22	178.1	52.1	0	0	0	0	115.2
409	E	89.3	Confident	88.5	Confident	114 Å²	114	74.9 Å²	74.9	53%	0.533	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-22	-177.9	-66.4	-173.3	-119.7	0	0	114.1	C407 H427	C407-E409 PolarHBondContact O-N 3.2Å; C407-E409 VanDerWaalsContact O-N 3.07Å; E409-H427 IonicContact OE1-CG 3.93Å; E409-H427 VanDerWaalsContact OE2-CB 3.31Å; E409-H427 WeakPolarHBondContact OE2-CB 3.34Å; E409-H427 IonicContact OE2-CG 3.45Å; E409-H427 IonicContact OE2-ND1 3.93Å
410	C	90.8	Very high	88.7	Confident	47 Å²	47	71.8 Å²	71.8	32%	0.318	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.8	9.4	-175.6	70.4	0	0	0	0	115.7	C407 K412 H423 H427	C407-C410 PolarHBondContact O-N 2.86Å; C410-K412 PolarHBondContact O-N 3.26Å; C410-K412 VanDerWaalsContact O-N 3.1Å; C410-H423 PolarHBondContact SG-NE2 3.26Å; C410-H427 WeakPolarHBondContact CB-CE1 3.3Å; C410-H427 WeakPolarHBondContact CB-NE2 3.26Å; C410-H427 VanDerWaalsContact SG-CE1 3.54Å; C410-H427 PolarHBondContact SG-NE2 2.84Å
411	G	88.7	Confident	88.9	Confident	43 Å²	43	71 Å²	71	44%	0.443	40%	0.401	S	S	.	.			trans	64.7	10.3	179.5	0	0	0	0	0	115	E406 C407 A413	E406-G411 WeakPolarHBondContact OE1-CA 3.1Å; C407-G411 WeakPolarHBondContact O-CA 3.45Å; C407-G411 PolarHBondContact O-N 3.28Å; G411-A413 PolarHBondContact O-N 3.16Å
412	K	90.3	Very high	89.1	Confident	122 Å²	122	71 Å²	71	53%	0.53	39%	0.39	S	S	.	.			trans	-78.9	116.5	-178.7	-73.4	-178.1	-178.2	176	0	110.4	C407 C410 F414	C407-K412 HydrophobicContact CB-CB 4.48Å; C407-K412 WeakPolarHBondContact CB-O 3.5Å; C407-K412 PolarHBondContact N-O 3.45Å; C410-K412 PolarHBondContact O-N 3.26Å; C410-K412 VanDerWaalsContact O-N 3.1Å; K412-F414 HydrophobicContact CB-CE2 3.91Å; K412-F414 HydrophobicContact CB-CZ 4.06Å; K412-F414 WeakPolarHBondContact O-CD2 3.41Å; K412-F414 WeakPolarHBondContact O-CE2 3.49Å
413	A	91.5	Very high	89.3	Confident	37 Å²	37	66.4 Å²	66.4	31%	0.306	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	141.8	177.3	0	0	0	0	0	112.6	K403 Y405 G411	K403-A413 HydrophobicContact CB-CB 3.48Å; K403-A413 VanDerWaalsContact CB-CB 3.48Å; K403-A413 HydrophobicContact CD-CB 4.23Å; K403-A413 HydrophobicContact CG-CB 4.45Å; Y405-A413 CarbonylContact O-C 3.55Å; Y405-A413 WeakPolarHBondContact O-CA 3.49Å; G411-A413 PolarHBondContact O-N 3.16Å
414	F	89.7	Confident	89.4	Confident	44 Å²	44	63.3 Å²	63.3	19%	0.193	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.2	-179.7	-60.4	-87.6	0	0	0	111	K403 Y405 C407 K412 L416 N419 L420 H423	K403-F414 CarbonylContact C-O 3.59Å; K403-F414 VanDerWaalsContact CA-O 3.32Å; K403-F414 WeakPolarHBondContact CA-O 3.08Å; Y405-F414 WeakPolarHBondContact CB-O 3.48Å; Y405-F414 PolarHBondContact N-O 2.66Å; Y405-F414 VanDerWaalsContact N-O 3.11Å; Y405-F414 PolarHBondContact O-N 3.29Å; C407-F414 HydrophobicContact CB-CE2 4.37Å; K412-F414 HydrophobicContact CB-CE2 3.91Å; K412-F414 HydrophobicContact CB-CZ 4.06Å; K412-F414 WeakPolarHBondContact O-CD2 3.41Å; K412-F414 WeakPolarHBondContact O-CE2 3.49Å; F414-L416 PolarHBondContact O-N 2.92Å; F414-N419 HydrophobicContact CB-CB 4.27Å; F414-N419 HydrophobicContact CD1-CB 3.97Å; F414-N419 HydrophobicContact CG-CB 4.33Å; F414-L420 HydrophobicContact CB-CB 4.46Å; F414-L420 HydrophobicContact CD2-CB 3.97Å; F414-L420 HydrophobicContact CD2-CD1 3.97Å; F414-L420 HydrophobicContact CE2-CD1 4.15Å; F414-L420 HydrophobicContact CG-CB 4.42Å; F414-H423 HydrophobicContact CE1-CB 4.1Å; F414-H423 HydrophobicContact CE2-CB 3.81Å; F414-H423 AromaticContact CE2-CD2 3.43Å; F414-H423 VanDerWaalsContact CE2-CD2 3.43Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.41Å; F414-H423 AromaticContact CE2-CG 3.65Å; F414-H423 HydrophobicContact CZ-CB 3.47Å; F414-H423 VanDerWaalsContact CZ-CB 3.47Å; F414-H423 AromaticContact CZ-CD2 3.47Å; F414-H423 VanDerWaalsContact CZ-CD2 3.47Å; F414-H423 WeakPolarHBondContact CZ-CD2 3.22Å; F414-H423 AromaticContact CZ-CG 3.26Å; F414-H423 AromaticContact CZ-ND1 3.82Å
415	S	88.3	Confident	89.6	Confident	40 Å²	40	62.3 Å²	62.3	28%	0.28	34%	0.341	S	S	.	.	S	Bend	trans	-74.4	-11.4	173.8	51.5	0	0	0	0	113.7
416	L	87.2	Confident	89.5	Confident	41 Å²	41	63.4 Å²	63.4	22%	0.215	35%	0.352	C	S	.	.			trans	-141.1	134.6	-177	-64.6	174.6	0	0	0	112.3	R394 Y405 F414 S418 N419 L420	R394-L416 VanDerWaalsContact CD-CD2 3.48Å; R394-L416 HydrophobicContact CG-CD2 3.85Å; Y405-L416 VanDerWaalsContact CD2-C 3.41Å; F414-L416 PolarHBondContact O-N 2.92Å; L416-S418 PolarHBondContact O-N 3.22Å; L416-N419 HydrophobicContact CB-CB 4.34Å; L416-N419 WeakPolarHBondContact O-CB 3.43Å; L416-N419 PolarHBondContact O-N 2.88Å; L416-L420 PolarHBondContact O-N 3.47Å; L416-L420 VanDerWaalsContact O-N 3.15Å
417	N	88.1	Confident	89.4	Confident	83 Å²	83	61 Å²	61	44%	0.444	34%	0.341	S	S	.	.	H	α-helix	trans	-56.1	-38.4	173.9	-167.7	43.5	0	0	0	112.7	Y405 N419 L420 V421	Y405-N417 HydrophobicContact CD1-CB 3.72Å; Y405-N417 VanDerWaalsContact CD2-N 3.27Å; Y405-N417 HydrophobicContact CE1-CB 3.6Å; Y405-N417 HydrophobicContact CE2-CB 4.39Å; Y405-N417 HydrophobicContact CG-CB 4.19Å; N417-N419 PolarHBondContact O-N 3.34Å; N417-L420 PolarHBondContact O-N 2.98Å; N417-L420 VanDerWaalsContact O-N 3.16Å; N417-V421 WeakPolarHBondContact O-CG2 3.36Å; N417-V421 PolarHBondContact O-N 3.23Å
418	S	87.5	Confident	89.1	Confident	73 Å²	73	64.8 Å²	64.8	51%	0.51	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-33.9	176.8	57.6	0	0	0	0	112.6	L416 L422	L416-S418 PolarHBondContact O-N 3.22Å; S418-L422 WeakPolarHBondContact O-CB 3.35Å; S418-L422 PolarHBondContact O-N 3.44Å; S418-L422 VanDerWaalsContact O-N 3.13Å
419	N	88.8	Confident	89	Confident	65 Å²	65	61.8 Å²	61.8	35%	0.348	35%	0.35	S	S	.	.	H	α-helix	trans	-79.3	-34.6	179.3	-63.1	-2	0	0	0	110.8	F414 L416 N417 L422 H423	F414-N419 HydrophobicContact CB-CB 4.27Å; F414-N419 HydrophobicContact CD1-CB 3.97Å; F414-N419 HydrophobicContact CG-CB 4.33Å; L416-N419 HydrophobicContact CB-CB 4.34Å; L416-N419 WeakPolarHBondContact O-CB 3.43Å; L416-N419 PolarHBondContact O-N 2.88Å; N417-N419 PolarHBondContact O-N 3.34Å; N419-L422 PolarHBondContact O-N 2.8Å; N419-H423 WeakPolarHBondContact O-CB 3.37Å; N419-H423 PolarHBondContact O-N 2.86Å
420	L	90.9	Very high	89	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-51	171	172.3	60.2	0	0	0	111.5	C407 F414 L416 N417 L422 H423 Q424	C407-L420 HydrophobicContact CB-CD1 3.59Å; F414-L420 HydrophobicContact CB-CB 4.46Å; F414-L420 HydrophobicContact CD2-CB 3.97Å; F414-L420 HydrophobicContact CD2-CD1 3.97Å; F414-L420 HydrophobicContact CE2-CD1 4.15Å; F414-L420 HydrophobicContact CG-CB 4.42Å; L416-L420 PolarHBondContact O-N 3.47Å; L416-L420 VanDerWaalsContact O-N 3.15Å; N417-L420 PolarHBondContact O-N 2.98Å; N417-L420 VanDerWaalsContact O-N 3.16Å; L420-L422 VanDerWaalsContact C-N 3.27Å; L420-L422 PolarHBondContact O-N 2.85Å; L420-H423 CarbonylContact O-C 3.59Å; L420-H423 WeakPolarHBondContact O-CA 3.3Å; L420-H423 WeakPolarHBondContact O-CB 3.5Å; L420-H423 PolarHBondContact O-N 2.9Å; L420-Q424 HydrophobicContact CD1-CG 4.26Å; L420-Q424 WeakPolarHBondContact O-CG 3.27Å; L420-Q424 PolarHBondContact O-N 2.82Å
421	V	88.8	Confident	89	Confident	63 Å²	63	65.4 Å²	65.4	38%	0.382	36%	0.361	S	S	.	.	H	α-helix	trans	-59.2	-39.8	177.6	172.5	0	0	0	0	111.3	N417 H423 Q424	N417-V421 WeakPolarHBondContact O-CG2 3.36Å; N417-V421 PolarHBondContact O-N 3.23Å; V421-H423 VanDerWaalsContact C-N 3.35Å; V421-Q424 PolarHBondContact O-N 3.37Å
422	L	88.2	Confident	89.1	Confident	46 Å²	46	66.8 Å²	66.8	24%	0.241	36%	0.362	C	S	.	.	H	α-helix	trans	-69.8	-32.9	176.8	-167.5	57.1	0	0	0	112.5	S418 N419 L420 R425 H444	S418-L422 WeakPolarHBondContact O-CB 3.35Å; S418-L422 PolarHBondContact O-N 3.44Å; S418-L422 VanDerWaalsContact O-N 3.13Å; N419-L422 PolarHBondContact O-N 2.8Å; L420-L422 VanDerWaalsContact C-N 3.27Å; L420-L422 PolarHBondContact O-N 2.85Å; L422-R425 WeakPolarHBondContact O-CB 3.47Å; L422-H444 VanDerWaalsContact CD2-CE1 3.43Å; L422-H444 WeakPolarHBondContact CD2-CE1 3.42Å; L422-H444 WeakPolarHBondContact CD2-NE2 3.34Å; L422-H444 WeakPolarHBondContact CG-NE2 3.41Å
423	H	89.6	Confident	89.1	Confident	20 Å²	20	63.7 Å²	63.7	9%	0.093	35%	0.349	C	S	.	.	H	α-helix	trans	-70.7	-37.9	173	175.9	62	0	0	0	112.7	C410 F414 N419 L420 V421 R425 I426 H427	C410-H423 PolarHBondContact SG-NE2 3.26Å; F414-H423 HydrophobicContact CE1-CB 4.1Å; F414-H423 HydrophobicContact CE2-CB 3.81Å; F414-H423 AromaticContact CE2-CD2 3.43Å; F414-H423 VanDerWaalsContact CE2-CD2 3.43Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.41Å; F414-H423 AromaticContact CE2-CG 3.65Å; F414-H423 HydrophobicContact CZ-CB 3.47Å; F414-H423 VanDerWaalsContact CZ-CB 3.47Å; F414-H423 AromaticContact CZ-CD2 3.47Å; F414-H423 VanDerWaalsContact CZ-CD2 3.47Å; F414-H423 WeakPolarHBondContact CZ-CD2 3.22Å; F414-H423 AromaticContact CZ-CG 3.26Å; F414-H423 AromaticContact CZ-ND1 3.82Å; N419-H423 WeakPolarHBondContact O-CB 3.37Å; N419-H423 PolarHBondContact O-N 2.86Å; L420-H423 CarbonylContact O-C 3.59Å; L420-H423 WeakPolarHBondContact O-CA 3.3Å; L420-H423 WeakPolarHBondContact O-CB 3.5Å; L420-H423 PolarHBondContact O-N 2.9Å; V421-H423 VanDerWaalsContact C-N 3.35Å; H423-R425 PolarHBondContact O-N 3.42Å; H423-I426 VanDerWaalsContact O-CB 3.23Å; H423-I426 WeakPolarHBondContact O-CB 3.22Å; H423-I426 WeakPolarHBondContact O-CG1 3.19Å; H423-I426 PolarHBondContact O-N 3.29Å; H423-H427 AromaticContact CD2-NE2 3.51Å; H423-H427 AromaticContact CE1-NE2 3.63Å; H423-H427 AromaticContact NE2-NE2 2.77Å; H423-H427 PolarHBondContact NE2-NE2 3.03Å
424	Q	89.2	Confident	89.1	Confident	64 Å²	64	67.3 Å²	67.3	30%	0.299	36%	0.36	S	S	.	.	H	α-helix	trans	-57.3	-30.2	175.5	-76.2	169.7	-28	0	0	112.4	L420 V421 I426 H427 T428	L420-Q424 HydrophobicContact CD1-CG 4.26Å; L420-Q424 WeakPolarHBondContact O-CG 3.27Å; L420-Q424 PolarHBondContact O-N 2.82Å; V421-Q424 PolarHBondContact O-N 3.37Å; Q424-I426 PolarHBondContact O-N 2.92Å; Q424-I426 VanDerWaalsContact O-N 3.13Å; Q424-H427 WeakPolarHBondContact O-CB 3.19Å; Q424-H427 PolarHBondContact O-N 2.99Å; Q424-T428 PolarHBondContact O-N 3.26Å; Q424-T428 PolarHBondContact O-OG1 3.08Å
425	R	90.3	Very high	89.3	Confident	61 Å²	61	65.2 Å²	65.2	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-60.8	-18.9	172	-61.4	-173.9	-178.4	167.2	-1.1	114.7	L422 H423 G429 E430 S443	L422-R425 WeakPolarHBondContact O-CB 3.47Å; H423-R425 PolarHBondContact O-N 3.42Å; R425-G429 CarbonylContact O-C 3.56Å; R425-G429 VanDerWaalsContact O-CA 3.32Å; R425-G429 WeakPolarHBondContact O-CA 3.43Å; R425-G429 PolarHBondContact O-N 3.1Å; R425-E430 HydrophobicContact CB-CB 4.32Å; R425-E430 HydrophobicContact CG-CB 4.12Å; R425-E430 PolarHBondContact O-N 3.35Å; R425-S443 PolarHBondContact NH1-O 3.15Å
426	I	87.8	Confident	89.4	Confident	116 Å²	116	70.9 Å²	70.9	60%	0.595	38%	0.378	S	S	*	.	H	α-helix	trans	-72.6	-34.8	173.3	-56.3	-178.1	0	0	0	110.4	H423 Q424	H423-I426 VanDerWaalsContact O-CB 3.23Å; H423-I426 WeakPolarHBondContact O-CB 3.22Å; H423-I426 WeakPolarHBondContact O-CG1 3.19Å; H423-I426 PolarHBondContact O-N 3.29Å; Q424-I426 PolarHBondContact O-N 2.92Å; Q424-I426 VanDerWaalsContact O-N 3.13Å
427	H	89.2	Confident	89.6	Confident	78 Å²	78	75 Å²	75	36%	0.361	40%	0.396	S	S	.	.	H	α-helix	trans	-80.2	-48.8	178.6	-64.6	-70.8	0	0	0	111.9	C407 E409 C410 H423 Q424 G429	C407-H427 PolarHBondContact SG-NE2 3.47Å; E409-H427 IonicContact OE1-CG 3.93Å; E409-H427 VanDerWaalsContact OE2-CB 3.31Å; E409-H427 WeakPolarHBondContact OE2-CB 3.34Å; E409-H427 IonicContact OE2-CG 3.45Å; E409-H427 IonicContact OE2-ND1 3.93Å; C410-H427 WeakPolarHBondContact CB-CE1 3.3Å; C410-H427 WeakPolarHBondContact CB-NE2 3.26Å; C410-H427 VanDerWaalsContact SG-CE1 3.54Å; C410-H427 PolarHBondContact SG-NE2 2.84Å; H423-H427 AromaticContact CD2-NE2 3.51Å; H423-H427 AromaticContact CE1-NE2 3.63Å; H423-H427 AromaticContact NE2-NE2 2.77Å; H423-H427 PolarHBondContact NE2-NE2 3.03Å; Q424-H427 WeakPolarHBondContact O-CB 3.19Å; Q424-H427 PolarHBondContact O-N 2.99Å; H427-G429 PolarHBondContact O-N 2.95Å
428	T	87.8	Confident	89.7	Confident	80 Å²	80	73.2 Å²	73.2	49%	0.491	39%	0.39	S	S	.	.	H	α-helix	trans	-73.3	-16.1	178.3	63.7	0	0	0	0	113.5	Q424 E430	Q424-T428 PolarHBondContact O-N 3.26Å; Q424-T428 PolarHBondContact O-OG1 3.08Å; T428-E430 PolarHBondContact O-N 3.47Å; T428-E430 WeakPolarHBondContact OG1-CG 3.44Å; T428-E430 PolarHBondContact OG1-N 3.41Å
429	G	87.4	Confident	89.8	Confident	46 Å²	46	71.9 Å²	71.9	47%	0.474	39%	0.387	S	S	.	.			trans	72.9	4.9	-175	0	0	0	0	0	114.4	R425 H427 K431	R425-G429 CarbonylContact O-C 3.56Å; R425-G429 VanDerWaalsContact O-CA 3.32Å; R425-G429 WeakPolarHBondContact O-CA 3.43Å; R425-G429 PolarHBondContact O-N 3.1Å; H427-G429 PolarHBondContact O-N 2.95Å; G429-K431 PolarHBondContact O-N 3.35Å
430	E	89.5	Confident	89.9	Confident	109 Å²	109	74.4 Å²	74.4	51%	0.509	40%	0.395	S	S	.	.			trans	-58.9	127.9	-177	-81.1	179.3	-165.9	0	0	113	R425 T428	R425-E430 HydrophobicContact CB-CB 4.32Å; R425-E430 HydrophobicContact CG-CB 4.12Å; R425-E430 PolarHBondContact O-N 3.35Å; T428-E430 PolarHBondContact O-N 3.47Å; T428-E430 WeakPolarHBondContact OG1-CG 3.44Å; T428-E430 PolarHBondContact OG1-N 3.41Å
431	K	90.6	Very high	89.9	Confident	128 Å²	128	75.4 Å²	75.4	56%	0.557	41%	0.405	S	S	*	.			trans	-132	78.5	-179.7	-73	161.4	172.3	-174.4	0	110.4	G429 H433 A441 F442	G429-K431 PolarHBondContact O-N 3.35Å; K431-H433 PolarHBondContact O-N 2.92Å; K431-H433 VanDerWaalsContact O-N 3.1Å; K431-A441 HydrophobicContact CB-CB 3.53Å; K431-A441 HydrophobicContact CD-CB 4.27Å; K431-A441 WeakPolarHBondContact CD-O 3.32Å; K431-A441 HydrophobicContact CG-CB 4.48Å; K431-F442 CarbonylContact C-O 3.18Å; K431-F442 VanDerWaalsContact C-O 3.27Å; K431-F442 WeakPolarHBondContact CA-O 3.32Å
432	P	89.5	Confident	89.9	Confident	73 Å²	73	74.6 Å²	74.6	47%	0.474	40%	0.396	S	S	.	.			trans	-69.7	-6.5	-172.2	-21.5	35.3	0	0	0	115.5
433	H	91.4	Very high	90	Very high	56 Å²	56	73.8 Å²	73.8	26%	0.259	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	92.5	-173.1	-56.4	-65.5	0	0	0	110.6	K431 A441 F442 H444 S445 L448	K431-H433 PolarHBondContact O-N 2.92Å; K431-H433 VanDerWaalsContact O-N 3.1Å; H433-A441 CarbonylContact O-C 3.51Å; H433-A441 WeakPolarHBondContact O-CA 3.33Å; H433-F442 HydrophobicContact CB-CB 4.43Å; H433-F442 WeakPolarHBondContact CB-O 3.41Å; H433-F442 PolarHBondContact N-O 2.8Å; H433-F442 VanDerWaalsContact N-O 3.12Å; H433-F442 PolarHBondContact O-N 2.85Å; H433-H444 VanDerWaalsContact CD2-C 3.41Å; H433-S445 PolarHBondContact CD2-N 3.2Å; H433-L448 HydrophobicContact CB-CB 4.12Å; H433-L448 HydrophobicContact CB-CD2 3.89Å
434	E	92.3	Very high	89.9	Confident	114 Å²	114	76 Å²	76	53%	0.533	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.8	-179.7	-166.5	171.9	169.4	0	0	112.9	G439 A441 L448	E434-G439 WeakPolarHBondContact OE1-CA 3.22Å; E434-A441 HydrophobicContact CB-CB 4.45Å; E434-A441 HydrophobicContact CG-CB 4.48Å; E434-L448 WeakPolarHBondContact O-CD2 3.27Å
435	C	93.1	Very high	89.9	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.413	C	S	.	.			trans	-88.6	109.7	171.2	-178.2	0	0	0	0	110.5	E437 C438 G439 K440 F442 L448 H455	C435-E437 PolarHBondContact O-N 3.18Å; C435-C438 PolarHBondContact O-N 3.49Å; C435-G439 WeakPolarHBondContact O-CA 3.4Å; C435-G439 PolarHBondContact O-N 3.33Å; C435-K440 WeakPolarHBondContact CB-O 3.36Å; C435-K440 PolarHBondContact N-O 3.44Å; C435-F442 HydrophobicContact CB-CE2 4.49Å; C435-L448 HydrophobicContact CB-CD1 3.58Å; C435-H455 PolarHBondContact SG-NE2 3.2Å
436	N	91.2	Very high	89.9	Confident	158 Å²	158	76.1 Å²	76.1	85%	0.845	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.8	-179.4	-61.8	-12.7	0	0	0	114.3
437	E	89.6	Confident	90	Very high	127 Å²	127	73.8 Å²	73.8	59%	0.593	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-25.4	-176.2	-64.5	177.4	-121.5	0	0	113.8	C435 H455	C435-E437 PolarHBondContact O-N 3.18Å; E437-H455 WeakPolarHBondContact OE2-CB 3.45Å; E437-H455 IonicContact OE2-CD2 3.27Å; E437-H455 IonicContact OE2-CG 2.85Å; E437-H455 IonicContact OE2-ND1 2.79Å
438	C	90.9	Very high	90.2	Very high	47 Å²	47	71.1 Å²	71.1	32%	0.318	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142	8.8	-175.6	73.2	0	0	0	0	115.5	C435 K440 H451 H455	C435-C438 PolarHBondContact O-N 3.49Å; C438-K440 PolarHBondContact O-N 3.11Å; C438-K440 VanDerWaalsContact O-N 3.12Å; C438-K440 VanDerWaalsContact SG-CG 3.58Å; C438-H451 PolarHBondContact SG-NE2 2.97Å; C438-H455 WeakPolarHBondContact CB-CE1 3.14Å; C438-H455 PolarHBondContact SG-CE1 2.82Å; C438-H455 PolarHBondContact SG-NE2 2.88Å
439	G	89.1	Confident	90.3	Very high	44 Å²	44	71.8 Å²	71.8	45%	0.454	40%	0.399	S	S	.	.			trans	65	10.6	179.1	0	0	0	0	0	115	E434 C435 A441	E434-G439 WeakPolarHBondContact OE1-CA 3.22Å; C435-G439 WeakPolarHBondContact O-CA 3.4Å; C435-G439 PolarHBondContact O-N 3.33Å; G439-A441 PolarHBondContact O-N 3.22Å
440	K	91	Very high	90.5	Very high	119 Å²	119	71.9 Å²	71.9	52%	0.517	39%	0.388	S	S	.	.			trans	-78.7	119	-179.5	-73.4	178.4	-173.9	166.4	0	110.3	C435 C438 F442	C435-K440 WeakPolarHBondContact CB-O 3.36Å; C435-K440 PolarHBondContact N-O 3.44Å; C438-K440 PolarHBondContact O-N 3.11Å; C438-K440 VanDerWaalsContact O-N 3.12Å; C438-K440 VanDerWaalsContact SG-CG 3.58Å; K440-F442 HydrophobicContact CB-CE2 3.9Å; K440-F442 HydrophobicContact CB-CZ 4.11Å; K440-F442 WeakPolarHBondContact O-CD2 3.5Å; K440-F442 WeakPolarHBondContact O-CE2 3.39Å
441	A	91	Very high	90.6	Very high	34 Å²	34	67.4 Å²	67.4	28%	0.281	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	141.6	179.1	0	0	0	0	0	113.1	K431 H433 E434 G439	K431-A441 HydrophobicContact CB-CB 3.53Å; K431-A441 HydrophobicContact CD-CB 4.27Å; K431-A441 WeakPolarHBondContact CD-O 3.32Å; K431-A441 HydrophobicContact CG-CB 4.48Å; H433-A441 CarbonylContact O-C 3.51Å; H433-A441 WeakPolarHBondContact O-CA 3.33Å; E434-A441 HydrophobicContact CB-CB 4.45Å; E434-A441 HydrophobicContact CG-CB 4.48Å; G439-A441 PolarHBondContact O-N 3.22Å
442	F	90	Very high	90.6	Very high	46 Å²	46	64.7 Å²	64.7	20%	0.202	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	148.2	-177.4	-60.1	-89.9	0	0	0	111.5	K431 H433 C435 K440 N447 L448 H451	K431-F442 CarbonylContact C-O 3.18Å; K431-F442 VanDerWaalsContact C-O 3.27Å; K431-F442 WeakPolarHBondContact CA-O 3.32Å; H433-F442 HydrophobicContact CB-CB 4.43Å; H433-F442 WeakPolarHBondContact CB-O 3.41Å; H433-F442 PolarHBondContact N-O 2.8Å; H433-F442 VanDerWaalsContact N-O 3.12Å; H433-F442 PolarHBondContact O-N 2.85Å; C435-F442 HydrophobicContact CB-CE2 4.49Å; K440-F442 HydrophobicContact CB-CE2 3.9Å; K440-F442 HydrophobicContact CB-CZ 4.11Å; K440-F442 WeakPolarHBondContact O-CD2 3.5Å; K440-F442 WeakPolarHBondContact O-CE2 3.39Å; F442-N447 HydrophobicContact CB-CB 4.29Å; F442-N447 HydrophobicContact CD1-CB 3.91Å; F442-N447 HydrophobicContact CG-CB 4.33Å; F442-L448 HydrophobicContact CB-CB 4.46Å; F442-L448 HydrophobicContact CD2-CB 4.02Å; F442-L448 HydrophobicContact CD2-CD1 4.01Å; F442-L448 HydrophobicContact CE2-CD1 4.21Å; F442-L448 HydrophobicContact CG-CB 4.43Å; F442-H451 HydrophobicContact CE1-CB 4.1Å; F442-H451 HydrophobicContact CE2-CB 3.79Å; F442-H451 AromaticContact CE2-CD2 3.35Å; F442-H451 WeakPolarHBondContact CE2-CD2 3.24Å; F442-H451 AromaticContact CE2-CG 3.65Å; F442-H451 HydrophobicContact CZ-CB 3.46Å; F442-H451 VanDerWaalsContact CZ-CB 3.46Å; F442-H451 AromaticContact CZ-CD2 3.43Å; F442-H451 VanDerWaalsContact CZ-CD2 3.43Å; F442-H451 WeakPolarHBondContact CZ-CD2 3.45Å; F442-H451 AromaticContact CZ-CG 3.3Å
443	S	88.9	Confident	90.7	Very high	30 Å²	30	63.9 Å²	63.9	21%	0.21	34%	0.344	C	S	.	.	S	Bend	trans	-79.4	-18.4	176.5	50.9	0	0	0	0	113.6	R425	R425-S443 PolarHBondContact NH1-O 3.15Å
444	H	88.4	Confident	90.6	Very high	66 Å²	66	66.6 Å²	66.6	31%	0.306	36%	0.36	S	S	.	.	S	Bend	trans	-124.7	138.2	178.2	-63.4	-151.5	0	0	0	110.1	L422 H433 S446 N447 L448	L422-H444 VanDerWaalsContact CD2-CE1 3.43Å; L422-H444 WeakPolarHBondContact CD2-CE1 3.42Å; L422-H444 WeakPolarHBondContact CD2-NE2 3.34Å; L422-H444 WeakPolarHBondContact CG-NE2 3.41Å; H433-H444 VanDerWaalsContact CD2-C 3.41Å; H444-S446 VanDerWaalsContact C-N 3.34Å; H444-S446 PolarHBondContact O-N 2.91Å; H444-N447 HydrophobicContact CB-CB 4.27Å; H444-N447 PolarHBondContact O-N 3.46Å; H444-L448 PolarHBondContact O-N 3.16Å
445	S	89.8	Confident	90.5	Very high	65 Å²	65	64.9 Å²	64.9	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-35.6	174.2	54.6	0	0	0	0	113.1	H433 N447 L448 I449	H433-S445 PolarHBondContact CD2-N 3.2Å; S445-N447 PolarHBondContact O-N 2.76Å; S445-L448 WeakPolarHBondContact O-CB 3.33Å; S445-L448 PolarHBondContact O-N 3.41Å; S445-L448 VanDerWaalsContact O-N 3.15Å; S445-I449 WeakPolarHBondContact O-CG1 3.32Å; S445-I449 PolarHBondContact O-N 3.06Å
446	S	89.3	Confident	90.3	Very high	63 Å²	63	68.3 Å²	68.3	44%	0.441	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-35.8	174.6	58.3	0	0	0	0	112.7	H444 L450	H444-S446 VanDerWaalsContact C-N 3.34Å; H444-S446 PolarHBondContact O-N 2.91Å; S446-L450 WeakPolarHBondContact O-CB 3.34Å; S446-L450 PolarHBondContact O-N 3.21Å
447	N	91	Very high	90.2	Very high	66 Å²	66	63 Å²	63	35%	0.353	36%	0.358	S	S	.	.	H	α-helix	trans	-77.6	-31.4	-178.7	-61.9	-1.2	0	0	0	111	F442 H444 S445 H451	F442-N447 HydrophobicContact CB-CB 4.29Å; F442-N447 HydrophobicContact CD1-CB 3.91Å; F442-N447 HydrophobicContact CG-CB 4.33Å; H444-N447 HydrophobicContact CB-CB 4.27Å; H444-N447 PolarHBondContact O-N 3.46Å; S445-N447 PolarHBondContact O-N 2.76Å; N447-H451 WeakPolarHBondContact O-CB 3.39Å; N447-H451 PolarHBondContact O-N 3.18Å
448	L	92.5	Very high	90.3	Very high	22 Å²	22	62 Å²	62	12%	0.115	35%	0.353	C	S	.	.	H	α-helix	trans	-65.1	-47.3	169.5	172.9	61	0	0	0	111.3	H433 E434 C435 F442 H444 S445 L450 H451 Q452	H433-L448 HydrophobicContact CB-CB 4.12Å; H433-L448 HydrophobicContact CB-CD2 3.89Å; E434-L448 WeakPolarHBondContact O-CD2 3.27Å; C435-L448 HydrophobicContact CB-CD1 3.58Å; F442-L448 HydrophobicContact CB-CB 4.46Å; F442-L448 HydrophobicContact CD2-CB 4.02Å; F442-L448 HydrophobicContact CD2-CD1 4.01Å; F442-L448 HydrophobicContact CE2-CD1 4.21Å; F442-L448 HydrophobicContact CG-CB 4.43Å; H444-L448 PolarHBondContact O-N 3.16Å; S445-L448 WeakPolarHBondContact O-CB 3.33Å; S445-L448 PolarHBondContact O-N 3.41Å; S445-L448 VanDerWaalsContact O-N 3.15Å; L448-L450 VanDerWaalsContact C-N 3.35Å; L448-L450 PolarHBondContact O-N 2.96Å; L448-H451 CarbonylContact O-C 3.27Å; L448-H451 WeakPolarHBondContact O-CA 3.49Å; L448-H451 WeakPolarHBondContact O-CB 3.22Å; L448-H451 PolarHBondContact O-N 3.31Å; L448-Q452 HydrophobicContact CD1-CG 4.25Å; L448-Q452 WeakPolarHBondContact O-CG 3.48Å; L448-Q452 PolarHBondContact O-N 3.4Å
449	I	90.9	Very high	90.4	Very high	95 Å²	95	64 Å²	64	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-45.4	177.8	-65.2	165.2	0	0	0	110.7	S445 H451 Q452 R453	S445-I449 WeakPolarHBondContact O-CG1 3.32Å; S445-I449 PolarHBondContact O-N 3.06Å; I449-H451 VanDerWaalsContact C-N 3.29Å; I449-H451 PolarHBondContact O-N 2.81Å; I449-Q452 PolarHBondContact O-N 3.22Å; I449-R453 PolarHBondContact O-N 3.04Å
450	L	90.9	Very high	90.5	Very high	47 Å²	47	65.2 Å²	65.2	25%	0.246	36%	0.356	C	S	.	.	H	α-helix	trans	-61.6	-38.2	174	173	59.1	0	0	0	112.1	S446 L448 R453 Q472	S446-L450 WeakPolarHBondContact O-CB 3.34Å; S446-L450 PolarHBondContact O-N 3.21Å; L448-L450 VanDerWaalsContact C-N 3.35Å; L448-L450 PolarHBondContact O-N 2.96Å; L450-R453 WeakPolarHBondContact O-CB 3.46Å; L450-R453 PolarHBondContact O-N 3.24Å; L450-Q472 HydrophobicContact CD1-CG 3.39Å; L450-Q472 HydrophobicContact CD2-CG 4.01Å; L450-Q472 HydrophobicContact CG-CG 4.35Å
451	H	91.4	Very high	90.7	Very high	15 Å²	15	62.5 Å²	62.5	7%	0.069	34%	0.343	C	S	.	.	H	α-helix	trans	-67.3	-37.4	176.6	176.6	50.6	0	0	0	112.6	C438 F442 N447 L448 I449 R453 I454 H455	C438-H451 PolarHBondContact SG-NE2 2.97Å; F442-H451 HydrophobicContact CE1-CB 4.1Å; F442-H451 HydrophobicContact CE2-CB 3.79Å; F442-H451 AromaticContact CE2-CD2 3.35Å; F442-H451 WeakPolarHBondContact CE2-CD2 3.24Å; F442-H451 AromaticContact CE2-CG 3.65Å; F442-H451 HydrophobicContact CZ-CB 3.46Å; F442-H451 VanDerWaalsContact CZ-CB 3.46Å; F442-H451 AromaticContact CZ-CD2 3.43Å; F442-H451 VanDerWaalsContact CZ-CD2 3.43Å; F442-H451 WeakPolarHBondContact CZ-CD2 3.45Å; F442-H451 AromaticContact CZ-CG 3.3Å; N447-H451 WeakPolarHBondContact O-CB 3.39Å; N447-H451 PolarHBondContact O-N 3.18Å; L448-H451 CarbonylContact O-C 3.27Å; L448-H451 WeakPolarHBondContact O-CA 3.49Å; L448-H451 WeakPolarHBondContact O-CB 3.22Å; L448-H451 PolarHBondContact O-N 3.31Å; I449-H451 VanDerWaalsContact C-N 3.29Å; I449-H451 PolarHBondContact O-N 2.81Å; H451-R453 PolarHBondContact O-N 3.34Å; H451-I454 VanDerWaalsContact O-CB 3.25Å; H451-I454 WeakPolarHBondContact O-CB 3.42Å; H451-I454 WeakPolarHBondContact O-CG1 3.48Å; H451-I454 PolarHBondContact O-N 2.82Å; H451-H455 AromaticContact CD2-NE2 3.44Å; H451-H455 PolarHBondContact CD2-NE2 3.47Å; H451-H455 AromaticContact CE1-NE2 3.4Å; H451-H455 PolarHBondContact CE1-NE2 3.16Å; H451-H455 AromaticContact NE2-NE2 2.68Å; H451-H455 PolarHBondContact NE2-NE2 2.93Å
452	Q	90.2	Very high	90.8	Very high	72 Å²	72	66.3 Å²	66.3	34%	0.336	36%	0.355	S	S	.	.	H	α-helix	trans	-59.3	-30.7	176.7	-75.5	169.3	-40.9	0	0	112.5	L448 I449 I454 H455 S456	L448-Q452 HydrophobicContact CD1-CG 4.25Å; L448-Q452 WeakPolarHBondContact O-CG 3.48Å; L448-Q452 PolarHBondContact O-N 3.4Å; I449-Q452 PolarHBondContact O-N 3.22Å; Q452-I454 PolarHBondContact O-N 2.84Å; Q452-I454 VanDerWaalsContact O-N 3.15Å; Q452-H455 PolarHBondContact O-N 3.27Å; Q452-S456 PolarHBondContact O-N 3.45Å; Q452-S456 PolarHBondContact O-OG 3.15Å
453	R	92.2	Very high	91	Very high	55 Å²	55	64.1 Å²	64.1	21%	0.208	35%	0.345	C	S	.	.	H	α-helix	trans	-61	-20.2	172.1	-62.1	-171.9	176.2	148.1	5.7	114.6	I449 L450 H451 H455 G457 E458 S471	I449-R453 PolarHBondContact O-N 3.04Å; L450-R453 WeakPolarHBondContact O-CB 3.46Å; L450-R453 PolarHBondContact O-N 3.24Å; H451-R453 PolarHBondContact O-N 3.34Å; R453-H455 VanDerWaalsContact C-N 3.31Å; R453-G457 CarbonylContact O-C 3.3Å; R453-G457 WeakPolarHBondContact O-CA 3.39Å; R453-G457 PolarHBondContact O-N 2.82Å; R453-E458 HydrophobicContact CB-CB 4.22Å; R453-E458 HydrophobicContact CG-CB 3.99Å; R453-E458 IonicContact NE-OE2 3.7Å; R453-E458 PolarHBondContact O-N 3.08Å; R453-S471 PolarHBondContact NH1-O 3.42Å
454	I	90.1	Very high	91.2	Very high	114 Å²	114	70.2 Å²	70.2	59%	0.585	38%	0.376	S	S	*	.	H	α-helix	trans	-73	-29.1	173.9	-57.2	179.3	0	0	0	110.6	H451 Q452	H451-I454 VanDerWaalsContact O-CB 3.25Å; H451-I454 WeakPolarHBondContact O-CB 3.42Å; H451-I454 WeakPolarHBondContact O-CG1 3.48Å; H451-I454 PolarHBondContact O-N 2.82Å; Q452-I454 PolarHBondContact O-N 2.84Å; Q452-I454 VanDerWaalsContact O-N 3.15Å
455	H	89.6	Confident	91.3	Very high	78 Å²	78	72.3 Å²	72.3	36%	0.361	39%	0.386	S	S	.	.	H	α-helix	trans	-86.7	-45.6	177.5	-60.1	-69	0	0	0	112.1	C435 E437 C438 H451 Q452 R453 G457	C435-H455 PolarHBondContact SG-NE2 3.2Å; E437-H455 WeakPolarHBondContact OE2-CB 3.45Å; E437-H455 IonicContact OE2-CD2 3.27Å; E437-H455 IonicContact OE2-CG 2.85Å; E437-H455 IonicContact OE2-ND1 2.79Å; C438-H455 WeakPolarHBondContact CB-CE1 3.14Å; C438-H455 PolarHBondContact SG-CE1 2.82Å; C438-H455 PolarHBondContact SG-NE2 2.88Å; H451-H455 AromaticContact CD2-NE2 3.44Å; H451-H455 PolarHBondContact CD2-NE2 3.47Å; H451-H455 AromaticContact CE1-NE2 3.4Å; H451-H455 PolarHBondContact CE1-NE2 3.16Å; H451-H455 AromaticContact NE2-NE2 2.68Å; H451-H455 PolarHBondContact NE2-NE2 2.93Å; Q452-H455 PolarHBondContact O-N 3.27Å; R453-H455 VanDerWaalsContact C-N 3.31Å; H455-G457 VanDerWaalsContact C-N 3.26Å; H455-G457 PolarHBondContact O-N 3.14Å
456	S	89.4	Confident	91.4	Very high	72 Å²	72	71.4 Å²	71.4	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-74.8	-13.5	177.6	64.8	0	0	0	0	114.2	Q452 E458	Q452-S456 PolarHBondContact O-N 3.45Å; Q452-S456 PolarHBondContact O-OG 3.15Å; S456-E458 PolarHBondContact O-N 3.42Å; S456-E458 WeakPolarHBondContact OG-CG 3.43Å
457	G	89.1	Confident	91.4	Very high	46 Å²	46	70.5 Å²	70.5	47%	0.474	38%	0.379	S	S	.	.			trans	73.1	2.7	-175	0	0	0	0	0	114.5	R453 H455 K459	R453-G457 CarbonylContact O-C 3.3Å; R453-G457 WeakPolarHBondContact O-CA 3.39Å; R453-G457 PolarHBondContact O-N 2.82Å; H455-G457 VanDerWaalsContact C-N 3.26Å; H455-G457 PolarHBondContact O-N 3.14Å; G457-K459 PolarHBondContact O-N 3.01Å
458	E	90.9	Very high	91.5	Very high	107 Å²	107	71.9 Å²	71.9	50%	0.5	38%	0.382	S	S	.	.			trans	-56.6	119.2	-177.7	-81.5	175.3	-152.8	0	0	112.8	R453 S456 P460	R453-E458 HydrophobicContact CB-CB 4.22Å; R453-E458 HydrophobicContact CG-CB 3.99Å; R453-E458 IonicContact NE-OE2 3.7Å; R453-E458 PolarHBondContact O-N 3.08Å; S456-E458 PolarHBondContact O-N 3.42Å; S456-E458 WeakPolarHBondContact OG-CG 3.43Å; E458-P460 WeakPolarHBondContact O-CD 3.31Å
459	K	92.1	Very high	91.5	Very high	88 Å²	88	72.3 Å²	72.3	38%	0.383	39%	0.389	S	S	.	.			trans	-122.6	76.5	175.3	-70.9	165.2	166.6	-172.7	0	110.6	G457 Y461 A469 F470	G457-K459 PolarHBondContact O-N 3.01Å; K459-Y461 PolarHBondContact O-N 3.47Å; K459-Y461 VanDerWaalsContact O-N 3.08Å; K459-A469 HydrophobicContact CB-CB 3.57Å; K459-A469 HydrophobicContact CD-CB 4.11Å; K459-A469 WeakPolarHBondContact CD-O 3.24Å; K459-A469 HydrophobicContact CG-CB 4.43Å; K459-F470 CarbonylContact C-O 3.26Å; K459-F470 VanDerWaalsContact CA-O 3.29Å; K459-F470 WeakPolarHBondContact CA-O 3.5Å
460	P	91.9	Very high	91.5	Very high	69 Å²	69	70 Å²	70	45%	0.448	38%	0.376	S	S	.	.			trans	-71.6	-2.7	-171.3	-19.3	33.7	0	0	0	116	E458	E458-P460 WeakPolarHBondContact O-CD 3.31Å
461	Y	94.4	Very high	91.6	Very high	62 Å²	62	69.4 Å²	69.4	24%	0.243	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	93.5	-171.6	-56.6	-78.1	0	0	0	110.3	L360 K459 A469 F470	L360-Y461 HydrophobicContact CD1-CE1 4.49Å; K459-Y461 PolarHBondContact O-N 3.47Å; K459-Y461 VanDerWaalsContact O-N 3.08Å; Y461-A469 CarbonylContact O-C 3.57Å; Y461-A469 WeakPolarHBondContact O-CA 3.5Å; Y461-F470 WeakPolarHBondContact CD2-O 3.32Å; Y461-F470 PolarHBondContact N-O 2.88Å; Y461-F470 VanDerWaalsContact N-O 3.11Å; Y461-F470 PolarHBondContact O-N 3.23Å
462	E	94.1	Very high	91.6	Very high	114 Å²	114	71.7 Å²	71.7	53%	0.533	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	146.5	-178.9	-162.6	173.1	158	0	0	112.6	G467 A469 L476	E462-G467 WeakPolarHBondContact OE1-CA 3.47Å; E462-A469 HydrophobicContact CG-CB 4.42Å; E462-L476 WeakPolarHBondContact O-CD2 3.36Å
463	C	94.3	Very high	91.7	Very high	0 Å²	0	71 Å²	71	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	104.4	172	-173.8	0	0	0	0	110.3	E465 C466 G467 K468 F470 L476 H479 H483	C463-E465 PolarHBondContact O-N 2.77Å; C463-C466 PolarHBondContact O-N 3.21Å; C463-G467 WeakPolarHBondContact O-CA 3.46Å; C463-G467 PolarHBondContact O-N 2.98Å; C463-K468 HydrophobicContact CB-CB 4.43Å; C463-K468 WeakPolarHBondContact CB-O 3.31Å; C463-K468 PolarHBondContact N-O 3.48Å; C463-F470 HydrophobicContact CB-CE2 4.4Å; C463-L476 HydrophobicContact CB-CD1 3.53Å; C463-H479 VanDerWaalsContact SG-CD2 3.59Å; C463-H483 PolarHBondContact SG-NE2 2.97Å
464	N	92.7	Very high	91.7	Very high	159 Å²	159	68.7 Å²	68.7	85%	0.85	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-28	-179.9	-59.2	-4.3	0	0	0	113.9
465	E	90.8	Very high	91.8	Very high	110 Å²	110	65.3 Å²	65.3	51%	0.514	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.8	-178	-61.7	171.9	-108.6	0	0	114.2	C463 H483	C463-E465 PolarHBondContact O-N 2.77Å; E465-H483 IonicContact OE1-CD2 3.93Å; E465-H483 WeakPolarHBondContact OE2-CB 3.41Å; E465-H483 IonicContact OE2-CD2 3.47Å; E465-H483 IonicContact OE2-CG 3.82Å
466	C	91.8	Very high	92	Very high	45 Å²	45	62.6 Å²	62.6	30%	0.304	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.1	17.8	-178.3	74.6	0	0	0	0	115.6	C463 K468 H479 H483	C463-C466 PolarHBondContact O-N 3.21Å; C466-K468 PolarHBondContact O-N 3Å; C466-H479 PolarHBondContact SG-NE2 2.99Å; C466-H483 WeakPolarHBondContact CB-CE1 3.49Å; C466-H483 PolarHBondContact SG-CE1 3.45Å; C466-H483 PolarHBondContact SG-NE2 3.14Å
467	G	90.1	Very high	92.1	Very high	44 Å²	44	62.7 Å²	62.7	45%	0.454	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	6.6	179.2	0	0	0	0	0	116	E462 C463 A469	E462-G467 WeakPolarHBondContact OE1-CA 3.47Å; C463-G467 WeakPolarHBondContact O-CA 3.46Å; C463-G467 PolarHBondContact O-N 2.98Å; G467-A469 PolarHBondContact O-N 3.22Å
468	K	92.1	Very high	92.1	Very high	95 Å²	95	63.8 Å²	63.8	41%	0.413	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	116.7	-173.2	-75.2	179.4	-174.8	170	0	110.9	C463 C466 F470	C463-K468 HydrophobicContact CB-CB 4.43Å; C463-K468 WeakPolarHBondContact CB-O 3.31Å; C463-K468 PolarHBondContact N-O 3.48Å; C466-K468 PolarHBondContact O-N 3Å; K468-F470 HydrophobicContact CB-CE2 3.96Å; K468-F470 HydrophobicContact CB-CZ 4.15Å; K468-F470 VanDerWaalsContact O-CD2 3.32Å; K468-F470 WeakPolarHBondContact O-CD2 3.38Å; K468-F470 WeakPolarHBondContact O-CE2 3.35Å
469	A	92.9	Very high	92.2	Very high	31 Å²	31	59.5 Å²	59.5	26%	0.256	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	139.1	-179	0	0	0	0	0	113.4	K459 Y461 E462 G467	K459-A469 HydrophobicContact CB-CB 3.57Å; K459-A469 HydrophobicContact CD-CB 4.11Å; K459-A469 WeakPolarHBondContact CD-O 3.24Å; K459-A469 HydrophobicContact CG-CB 4.43Å; Y461-A469 CarbonylContact O-C 3.57Å; Y461-A469 WeakPolarHBondContact O-CA 3.5Å; E462-A469 HydrophobicContact CG-CB 4.42Å; G467-A469 PolarHBondContact O-N 3.22Å
470	F	91.6	Very high	92.1	Very high	48 Å²	48	58.6 Å²	58.6	21%	0.211	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	150.7	-177.4	-60.2	-88.3	0	0	0	111.4	K459 Y461 C463 K468 Q472 D475 L476 H479	K459-F470 CarbonylContact C-O 3.26Å; K459-F470 VanDerWaalsContact CA-O 3.29Å; K459-F470 WeakPolarHBondContact CA-O 3.5Å; Y461-F470 WeakPolarHBondContact CD2-O 3.32Å; Y461-F470 PolarHBondContact N-O 2.88Å; Y461-F470 VanDerWaalsContact N-O 3.11Å; Y461-F470 PolarHBondContact O-N 3.23Å; C463-F470 HydrophobicContact CB-CE2 4.4Å; K468-F470 HydrophobicContact CB-CE2 3.96Å; K468-F470 HydrophobicContact CB-CZ 4.15Å; K468-F470 VanDerWaalsContact O-CD2 3.32Å; K468-F470 WeakPolarHBondContact O-CD2 3.38Å; K468-F470 WeakPolarHBondContact O-CE2 3.35Å; F470-Q472 VanDerWaalsContact C-N 3.31Å; F470-D475 HydrophobicContact CD1-CB 4.08Å; F470-L476 HydrophobicContact CB-CB 4.46Å; F470-L476 HydrophobicContact CD2-CB 3.89Å; F470-L476 HydrophobicContact CD2-CD1 4.06Å; F470-L476 HydrophobicContact CE2-CD1 4.18Å; F470-L476 HydrophobicContact CG-CB 4.35Å; F470-H479 HydrophobicContact CE1-CB 4.17Å; F470-H479 HydrophobicContact CE2-CB 3.94Å; F470-H479 AromaticContact CE2-CD2 3.32Å; F470-H479 WeakPolarHBondContact CE2-CD2 3.32Å; F470-H479 AromaticContact CE2-CG 3.7Å; F470-H479 HydrophobicContact CZ-CB 3.55Å; F470-H479 AromaticContact CZ-CD2 3.41Å; F470-H479 VanDerWaalsContact CZ-CD2 3.41Å; F470-H479 WeakPolarHBondContact CZ-CD2 3.47Å; F470-H479 AromaticContact CZ-CG 3.33Å; F470-H479 AromaticContact CZ-ND1 3.96Å
471	S	91.3	Very high	92.1	Very high	34 Å²	34	57.9 Å²	57.9	24%	0.238	31%	0.307	C	S	.	.	S	Bend	trans	-81.2	-9.2	175.4	59.8	0	0	0	0	113.9	R453	R453-S471 PolarHBondContact NH1-O 3.42Å
472	Q	92.4	Very high	91.9	Very high	63 Å²	63	59.4 Å²	59.4	29%	0.294	32%	0.319	S	S	.	.	S	Bend	trans	-136.6	135.1	177.5	-62.1	-178.4	86.3	0	0	111.8	L450 F470 S474 D475 L476	L450-Q472 HydrophobicContact CD1-CG 3.39Å; L450-Q472 HydrophobicContact CD2-CG 4.01Å; L450-Q472 HydrophobicContact CG-CG 4.35Å; F470-Q472 VanDerWaalsContact C-N 3.31Å; Q472-S474 PolarHBondContact O-N 3.05Å; Q472-S474 VanDerWaalsContact O-N 3.16Å; Q472-D475 HydrophobicContact CB-CB 4.43Å; Q472-D475 PolarHBondContact NE2-OD2 3.35Å; Q472-D475 PolarHBondContact O-N 3.39Å; Q472-L476 PolarHBondContact O-N 2.78Å
473	S	93	Very high	91.7	Very high	58 Å²	58	57.8 Å²	57.8	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-55.1	-32.8	171.8	54.1	0	0	0	0	112.7	D475 L476 T477	S473-D475 VanDerWaalsContact C-N 3.26Å; S473-D475 PolarHBondContact O-N 3.16Å; S473-L476 WeakPolarHBondContact O-CB 3.48Å; S473-L476 PolarHBondContact O-N 3.49Å; S473-T477 PolarHBondContact O-N 3.42Å; S473-T477 PolarHBondContact O-OG1 2.92Å
474	S	91.1	Very high	91.5	Very high	5 Å²	5	61.6 Å²	61.6	4%	0.035	33%	0.334	C	S	.	.	H	α-helix	trans	-64.3	-30.9	178.5	64.4	0	0	0	0	114.6	R290 Q472 K478	R290-S474 PolarHBondContact NH2-OG 3.02Å; Q472-S474 PolarHBondContact O-N 3.05Å; Q472-S474 VanDerWaalsContact O-N 3.16Å; S474-K478 WeakPolarHBondContact O-CD 3.29Å; S474-K478 WeakPolarHBondContact O-CG 3.37Å; S474-K478 PolarHBondContact O-N 2.89Å; S474-K478 VanDerWaalsContact O-N 3.12Å
475	D	91.9	Very high	91.3	Very high	43 Å²	43	56.3 Å²	56.3	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-87.3	-30.8	-175.1	-59.9	-21.4	0	0	0	109.2	F470 Q472 S473 K478 H479	F470-D475 HydrophobicContact CD1-CB 4.08Å; Q472-D475 HydrophobicContact CB-CB 4.43Å; Q472-D475 PolarHBondContact NE2-OD2 3.35Å; Q472-D475 PolarHBondContact O-N 3.39Å; S473-D475 VanDerWaalsContact C-N 3.26Å; S473-D475 PolarHBondContact O-N 3.16Å; D475-K478 IonicContact OD1-NZ 3.73Å; D475-K478 PolarHBondContact OD1-NZ 3.31Å; D475-H479 WeakPolarHBondContact O-CB 3.34Å; D475-H479 PolarHBondContact O-N 2.9Å
476	L	93.8	Very high	91.3	Very high	22 Å²	22	55.6 Å²	55.6	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-53.2	160.4	174.9	60.5	0	0	0	111.9	E462 C463 F470 Q472 S473 K478 H479 Q480	E462-L476 WeakPolarHBondContact O-CD2 3.36Å; C463-L476 HydrophobicContact CB-CD1 3.53Å; F470-L476 HydrophobicContact CB-CB 4.46Å; F470-L476 HydrophobicContact CD2-CB 3.89Å; F470-L476 HydrophobicContact CD2-CD1 4.06Å; F470-L476 HydrophobicContact CE2-CD1 4.18Å; F470-L476 HydrophobicContact CG-CB 4.35Å; Q472-L476 PolarHBondContact O-N 2.78Å; S473-L476 WeakPolarHBondContact O-CB 3.48Å; S473-L476 PolarHBondContact O-N 3.49Å; L476-K478 VanDerWaalsContact C-N 3.31Å; L476-K478 PolarHBondContact O-N 3.1Å; L476-H479 CarbonylContact O-C 3.21Å; L476-H479 WeakPolarHBondContact O-CA 3.45Å; L476-H479 WeakPolarHBondContact O-CB 3.44Å; L476-H479 PolarHBondContact O-N 2.9Å; L476-Q480 HydrophobicContact CD1-CG 4.03Å; L476-Q480 HydrophobicContact CG-CG 4.44Å; L476-Q480 WeakPolarHBondContact O-CG 3.43Å; L476-Q480 PolarHBondContact O-N 3.44Å
477	T	92	Very high	91.3	Very high	74 Å²	74	59.6 Å²	59.6	45%	0.454	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-38.5	178.8	-49	0	0	0	0	112.7	S473 H479	S473-T477 PolarHBondContact O-N 3.42Å; S473-T477 PolarHBondContact O-OG1 2.92Å; T477-H479 PolarHBondContact O-N 3Å
478	K	89.8	Confident	91.4	Very high	69 Å²	69	61 Å²	61	30%	0.3	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-20.5	173.4	-69.8	165.6	-160.7	161.5	0	113.2	S474 D475 L476	S474-K478 WeakPolarHBondContact O-CD 3.29Å; S474-K478 WeakPolarHBondContact O-CG 3.37Å; S474-K478 PolarHBondContact O-N 2.89Å; S474-K478 VanDerWaalsContact O-N 3.12Å; D475-K478 IonicContact OD1-NZ 3.73Å; D475-K478 PolarHBondContact OD1-NZ 3.31Å; L476-K478 VanDerWaalsContact C-N 3.31Å; L476-K478 PolarHBondContact O-N 3.1Å
479	H	91.7	Very high	91.5	Very high	16 Å²	16	60.2 Å²	60.2	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-86.9	-39.9	178.2	168.5	61.2	0	0	0	111.6	C463 C466 F470 D475 L476 T477 R481 I482 H483	C463-H479 VanDerWaalsContact SG-CD2 3.59Å; C466-H479 PolarHBondContact SG-NE2 2.99Å; F470-H479 HydrophobicContact CE1-CB 4.17Å; F470-H479 HydrophobicContact CE2-CB 3.94Å; F470-H479 AromaticContact CE2-CD2 3.32Å; F470-H479 WeakPolarHBondContact CE2-CD2 3.32Å; F470-H479 AromaticContact CE2-CG 3.7Å; F470-H479 HydrophobicContact CZ-CB 3.55Å; F470-H479 AromaticContact CZ-CD2 3.41Å; F470-H479 VanDerWaalsContact CZ-CD2 3.41Å; F470-H479 WeakPolarHBondContact CZ-CD2 3.47Å; F470-H479 AromaticContact CZ-CG 3.33Å; F470-H479 AromaticContact CZ-ND1 3.96Å; D475-H479 WeakPolarHBondContact O-CB 3.34Å; D475-H479 PolarHBondContact O-N 2.9Å; L476-H479 CarbonylContact O-C 3.21Å; L476-H479 WeakPolarHBondContact O-CA 3.45Å; L476-H479 WeakPolarHBondContact O-CB 3.44Å; L476-H479 PolarHBondContact O-N 2.9Å; T477-H479 PolarHBondContact O-N 3Å; H479-R481 PolarHBondContact O-N 3.43Å; H479-I482 WeakPolarHBondContact O-CB 3.48Å; H479-I482 VanDerWaalsContact O-CG1 3.32Å; H479-I482 WeakPolarHBondContact O-CG1 3.28Å; H479-I482 PolarHBondContact O-N 3.42Å; H479-H483 AromaticContact CD2-NE2 3.57Å; H479-H483 AromaticContact CE1-NE2 3.3Å; H479-H483 PolarHBondContact CE1-NE2 2.89Å; H479-H483 VanDerWaalsContact CE1-NE2 3.3Å; H479-H483 AromaticContact NE2-NE2 2.7Å; H479-H483 PolarHBondContact NE2-NE2 3.1Å
480	Q	90.9	Very high	91.5	Very high	70 Å²	70	64.8 Å²	64.8	33%	0.327	34%	0.338	S	S	.	.	H	α-helix	trans	-55.1	-33.8	175.5	-72.7	172	-59.8	0	0	112.5	L476 I482 H483 T484	L476-Q480 HydrophobicContact CD1-CG 4.03Å; L476-Q480 HydrophobicContact CG-CG 4.44Å; L476-Q480 WeakPolarHBondContact O-CG 3.43Å; L476-Q480 PolarHBondContact O-N 3.44Å; Q480-I482 PolarHBondContact O-N 2.94Å; Q480-H483 PolarHBondContact O-N 2.92Å; Q480-T484 PolarHBondContact O-N 3.04Å
481	R	91.9	Very high	91.6	Very high	54 Å²	54	62.5 Å²	62.5	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-58.5	-13.3	171	-64.9	-179.3	178.2	-165	-6.6	115.6	H479 G485 E486 N499	H479-R481 PolarHBondContact O-N 3.43Å; R481-G485 PolarHBondContact O-N 3.22Å; R481-E486 HydrophobicContact CB-CB 4.22Å; R481-E486 HydrophobicContact CG-CB 4.07Å; R481-E486 IonicContact NE-OE2 3.71Å; R481-E486 PolarHBondContact O-N 2.99Å; R481-N499 HydrophobicContact CB-CB 4.4Å; R481-N499 PolarHBondContact NH1-O 3.41Å
482	I	89.8	Confident	91.7	Very high	94 Å²	94	66 Å²	66	48%	0.482	35%	0.353	S	S	.	.	H	α-helix	trans	-78.3	-37.4	172.9	-58.6	177.4	0	0	0	109.7	H479 Q480	H479-I482 WeakPolarHBondContact O-CB 3.48Å; H479-I482 VanDerWaalsContact O-CG1 3.32Å; H479-I482 WeakPolarHBondContact O-CG1 3.28Å; H479-I482 PolarHBondContact O-N 3.42Å; Q480-I482 PolarHBondContact O-N 2.94Å
483	H	90	Very high	91.6	Very high	80 Å²	80	67 Å²	67	37%	0.37	36%	0.357	S	S	.	.	H	α-helix	trans	-79.5	-46.5	177.9	-55	-61.8	0	0	0	111.8	C463 E465 C466 H479 Q480 G485	C463-H483 PolarHBondContact SG-NE2 2.97Å; E465-H483 IonicContact OE1-CD2 3.93Å; E465-H483 WeakPolarHBondContact OE2-CB 3.41Å; E465-H483 IonicContact OE2-CD2 3.47Å; E465-H483 IonicContact OE2-CG 3.82Å; C466-H483 WeakPolarHBondContact CB-CE1 3.49Å; C466-H483 PolarHBondContact SG-CE1 3.45Å; C466-H483 PolarHBondContact SG-NE2 3.14Å; H479-H483 AromaticContact CD2-NE2 3.57Å; H479-H483 AromaticContact CE1-NE2 3.3Å; H479-H483 PolarHBondContact CE1-NE2 2.89Å; H479-H483 VanDerWaalsContact CE1-NE2 3.3Å; H479-H483 AromaticContact NE2-NE2 2.7Å; H479-H483 PolarHBondContact NE2-NE2 3.1Å; Q480-H483 PolarHBondContact O-N 2.92Å; H483-G485 PolarHBondContact O-N 3.4Å; H483-G485 VanDerWaalsContact O-N 3.16Å
484	T	89.1	Confident	91.5	Very high	80 Å²	80	66.5 Å²	66.5	49%	0.491	35%	0.353	S	S	.	.	S	Bend	trans	-70.5	-9.2	176.8	68.5	0	0	0	0	113.7	Q480 E486	Q480-T484 PolarHBondContact O-N 3.04Å; T484-E486 PolarHBondContact O-N 3.26Å; T484-E486 VanDerWaalsContact O-N 3.1Å; T484-E486 WeakPolarHBondContact OG1-CG 3.31Å; T484-E486 PolarHBondContact OG1-OE1 2.91Å
485	G	89	Confident	91.4	Very high	47 Å²	47	68.3 Å²	68.3	49%	0.485	37%	0.373	S	S	.	.			trans	68.4	1.7	-176.7	0	0	0	0	0	115	R481 H483 K487	R481-G485 PolarHBondContact O-N 3.22Å; H483-G485 PolarHBondContact O-N 3.4Å; H483-G485 VanDerWaalsContact O-N 3.16Å; G485-K487 PolarHBondContact O-N 3.26Å
486	E	91.4	Very high	91.4	Very high	95 Å²	95	72.3 Å²	72.3	44%	0.444	39%	0.388	S	S	.	.			trans	-53.8	126	-176.9	-86.9	175.1	-138.4	0	0	113.1	R481 T484 P488 N499	R481-E486 HydrophobicContact CB-CB 4.22Å; R481-E486 HydrophobicContact CG-CB 4.07Å; R481-E486 IonicContact NE-OE2 3.71Å; R481-E486 PolarHBondContact O-N 2.99Å; T484-E486 PolarHBondContact O-N 3.26Å; T484-E486 VanDerWaalsContact O-N 3.1Å; T484-E486 WeakPolarHBondContact OG1-CG 3.31Å; T484-E486 PolarHBondContact OG1-OE1 2.91Å; E486-P488 HydrophobicContact CB-CG 4.44Å; E486-N499 VanDerWaalsContact O-CB 3.29Å; E486-N499 WeakPolarHBondContact O-CB 3.4Å
487	K	92	Very high	91.4	Very high	130 Å²	130	73 Å²	73	57%	0.565	40%	0.397	S	S	*	.			trans	-125.4	70.8	176.2	-70.5	163.5	-178.6	174.6	0	111.7	G485 Y489 A497 F498	G485-K487 PolarHBondContact O-N 3.26Å; K487-Y489 PolarHBondContact O-N 3.37Å; K487-A497 HydrophobicContact CB-CB 3.63Å; K487-A497 HydrophobicContact CD-CB 4.3Å; K487-F498 CarbonylContact C-O 3.52Å; K487-F498 VanDerWaalsContact C-O 3.26Å; K487-F498 WeakPolarHBondContact CA-O 3.37Å
488	P	91.5	Very high	91.3	Very high	72 Å²	72	71.7 Å²	71.7	47%	0.468	39%	0.385	S	S	.	.			trans	-71.2	0.8	-172	-20.2	35.9	0	0	0	115.5	E486	E486-P488 HydrophobicContact CB-CG 4.44Å
489	Y	93.6	Very high	91.3	Very high	80 Å²	80	70.2 Å²	70.2	31%	0.314	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	91.9	-174.4	-54.9	-73.4	0	0	0	110.4	K487 F498 R500 N501	K487-Y489 PolarHBondContact O-N 3.37Å; Y489-F498 WeakPolarHBondContact CB-O 3.29Å; Y489-F498 WeakPolarHBondContact CD2-O 3.11Å; Y489-F498 PolarHBondContact N-O 3.04Å; Y489-F498 VanDerWaalsContact N-O 3.16Å; Y489-F498 PolarHBondContact O-N 3.08Å; Y489-R500 VanDerWaalsContact CD2-C 3.4Å; Y489-N501 HydrophobicContact CD1-CB 3.82Å; Y489-N501 HydrophobicContact CD2-CB 4.37Å; Y489-N501 HydrophobicContact CE1-CB 3.7Å; Y489-N501 HydrophobicContact CE2-CB 4.24Å; Y489-N501 VanDerWaalsContact CE2-N 3.33Å; Y489-N501 HydrophobicContact CG-CB 4.15Å
490	E	94.1	Very high	91.2	Very high	126 Å²	126	73.4 Å²	73.4	59%	0.589	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	145	180	-162.1	179.4	151.5	0	0	113.1	G495 A497 L504	E490-G495 WeakPolarHBondContact OE1-CA 3.45Å; E490-A497 HydrophobicContact CB-CB 4.47Å; E490-A497 HydrophobicContact CG-CB 4.35Å; E490-L504 WeakPolarHBondContact O-CD2 3.38Å
491	C	93.9	Very high	91.2	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	39%	0.391	C	S	.	.			trans	-88.3	105.7	171.9	-170.1	0	0	0	0	111	E493 C494 G495 K496 F498 L504 H507 H511	C491-E493 PolarHBondContact O-N 3.13Å; C491-C494 PolarHBondContact O-N 2.86Å; C491-C494 VanDerWaalsContact SG-SG 3.64Å; C491-G495 WeakPolarHBondContact O-CA 3.08Å; C491-G495 PolarHBondContact O-N 3.09Å; C491-K496 WeakPolarHBondContact CB-O 3.26Å; C491-K496 PolarHBondContact N-O 3.39Å; C491-F498 HydrophobicContact CB-CE2 4.46Å; C491-L504 HydrophobicContact CB-CD1 3.58Å; C491-H507 VanDerWaalsContact SG-CD2 3.58Å; C491-H511 PolarHBondContact SG-NE2 2.84Å
492	S	92.1	Very high	91.1	Very high	109 Å²	109	73.7 Å²	73.7	76%	0.762	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-16.7	176.8	58.6	0	0	0	0	115.1
493	E	90.3	Very high	91.1	Very high	84 Å²	84	74.2 Å²	74.2	39%	0.393	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-15.8	-177.8	-64	164.5	-130.9	0	0	112.7	C491 R508 H511	C491-E493 PolarHBondContact O-N 3.13Å; E493-R508 IonicContact OE1-CZ 2.78Å; E493-R508 VanDerWaalsContact OE1-CZ 3.27Å; E493-R508 IonicContact OE1-NE 3.75Å; E493-R508 PolarHBondContact OE1-NE 3.11Å; E493-R508 IonicContact OE1-NH2 3.9Å; E493-R508 PolarHBondContact OE1-NH2 3.43Å; E493-H511 WeakPolarHBondContact OE2-CB 3.32Å; E493-H511 IonicContact OE2-CD2 3.89Å; E493-H511 PolarHBondContact OE2-CD2 2.67Å; E493-H511 IonicContact OE2-CG 2.84Å
494	C	91.4	Very high	91.3	Very high	47 Å²	47	71.4 Å²	71.4	32%	0.318	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155	9.4	-177.1	68.8	0	0	0	0	116.3	C491 K496 H507 H511	C491-C494 PolarHBondContact O-N 2.86Å; C491-C494 VanDerWaalsContact SG-SG 3.64Å; C494-K496 PolarHBondContact O-N 2.97Å; C494-K496 VanDerWaalsContact O-N 3.08Å; C494-H507 PolarHBondContact SG-NE2 3.11Å; C494-H511 WeakPolarHBondContact CB-CE1 3.43Å; C494-H511 WeakPolarHBondContact CB-NE2 3.2Å; C494-H511 VanDerWaalsContact SG-CE1 3.5Å; C494-H511 PolarHBondContact SG-NE2 3.12Å
495	G	89.9	Confident	91.3	Very high	43 Å²	43	71.7 Å²	71.7	44%	0.443	39%	0.387	S	S	.	.			trans	68.3	0.7	-179.8	0	0	0	0	0	115.8	E490 C491 A497	E490-G495 WeakPolarHBondContact OE1-CA 3.45Å; C491-G495 WeakPolarHBondContact O-CA 3.08Å; C491-G495 PolarHBondContact O-N 3.09Å; G495-A497 PolarHBondContact O-N 3.39Å
496	K	91.6	Very high	91.3	Very high	126 Å²	126	71.6 Å²	71.6	55%	0.548	38%	0.376	S	S	.	.			trans	-74.5	119	-177.6	-69.7	-171.6	177.2	-172.6	0	111.1	C491 C494 F498	C491-K496 WeakPolarHBondContact CB-O 3.26Å; C491-K496 PolarHBondContact N-O 3.39Å; C494-K496 PolarHBondContact O-N 2.97Å; C494-K496 VanDerWaalsContact O-N 3.08Å; K496-F498 HydrophobicContact CB-CE2 4Å; K496-F498 HydrophobicContact CB-CZ 4.12Å; K496-F498 WeakPolarHBondContact O-CD2 3.49Å; K496-F498 WeakPolarHBondContact O-CE2 3.39Å
497	A	92.8	Very high	91.2	Very high	38 Å²	38	68.1 Å²	68.1	31%	0.314	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142.5	-179.9	0	0	0	0	0	113.4	K487 E490 G495	K487-A497 HydrophobicContact CB-CB 3.63Å; K487-A497 HydrophobicContact CD-CB 4.3Å; E490-A497 HydrophobicContact CB-CB 4.47Å; E490-A497 HydrophobicContact CG-CB 4.35Å; G495-A497 PolarHBondContact O-N 3.39Å
498	F	91	Very high	91.1	Very high	46 Å²	46	67.5 Å²	67.5	20%	0.202	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.9	-176.6	-59.2	-87.9	0	0	0	111.7	K487 Y489 C491 K496 R500 L504 H507	K487-F498 CarbonylContact C-O 3.52Å; K487-F498 VanDerWaalsContact C-O 3.26Å; K487-F498 WeakPolarHBondContact CA-O 3.37Å; Y489-F498 WeakPolarHBondContact CB-O 3.29Å; Y489-F498 WeakPolarHBondContact CD2-O 3.11Å; Y489-F498 PolarHBondContact N-O 3.04Å; Y489-F498 VanDerWaalsContact N-O 3.16Å; Y489-F498 PolarHBondContact O-N 3.08Å; C491-F498 HydrophobicContact CB-CE2 4.46Å; K496-F498 HydrophobicContact CB-CE2 4Å; K496-F498 HydrophobicContact CB-CZ 4.12Å; K496-F498 WeakPolarHBondContact O-CD2 3.49Å; K496-F498 WeakPolarHBondContact O-CE2 3.39Å; F498-R500 VanDerWaalsContact C-N 3.31Å; F498-R500 PolarHBondContact O-N 3.2Å; F498-L504 HydrophobicContact CD2-CB 3.97Å; F498-L504 HydrophobicContact CD2-CD1 4.05Å; F498-L504 HydrophobicContact CE2-CD1 4.21Å; F498-L504 HydrophobicContact CG-CB 4.46Å; F498-H507 HydrophobicContact CE1-CB 4.2Å; F498-H507 HydrophobicContact CE2-CB 3.81Å; F498-H507 AromaticContact CE2-CD2 3.58Å; F498-H507 AromaticContact CE2-CG 3.67Å; F498-H507 HydrophobicContact CZ-CB 3.5Å; F498-H507 AromaticContact CZ-CD2 3.65Å; F498-H507 AromaticContact CZ-CG 3.32Å; F498-H507 AromaticContact CZ-ND1 3.77Å
499	N	89.6	Confident	90.9	Very high	38 Å²	38	66.5 Å²	66.5	20%	0.203	34%	0.34	C	S	.	.	S	Bend	trans	-77.9	-12.8	176.1	61	12.9	0	0	0	114	R481 E486	R481-N499 HydrophobicContact CB-CB 4.4Å; R481-N499 PolarHBondContact NH1-O 3.41Å; E486-N499 VanDerWaalsContact O-CB 3.29Å; E486-N499 WeakPolarHBondContact O-CB 3.4Å
500	R	89.9	Confident	90.6	Very high	82 Å²	82	66.9 Å²	66.9	31%	0.309	35%	0.347	S	S	.	.	S	Bend	trans	-135.8	131.1	-179.2	-65.9	175.8	-176.8	-175.8	-3	111.8	Y489 F498 S502 Y503 L504	Y489-R500 VanDerWaalsContact CD2-C 3.4Å; F498-R500 VanDerWaalsContact C-N 3.31Å; F498-R500 PolarHBondContact O-N 3.2Å; R500-S502 PolarHBondContact O-N 3.04Å; R500-Y503 HydrophobicContact CB-CD2 3.96Å; R500-Y503 HydrophobicContact CB-CE2 4.33Å; R500-Y503 HydrophobicContact CB-CG 4.16Å; R500-Y503 HydrophobicContact CG-CD2 4.47Å; R500-Y503 HydrophobicContact CG-CE2 4.39Å; R500-Y503 PolarHBondContact NH1-OH 3.37Å; R500-Y503 WeakPolarHBondContact O-CB 3.48Å; R500-Y503 PolarHBondContact O-N 3.4Å; R500-L504 PolarHBondContact O-N 2.96Å
501	N	91.1	Very high	90.2	Very high	59 Å²	59	64.9 Å²	64.9	32%	0.316	34%	0.337	S	S	.	.	H	α-helix	trans	-55.9	-37.2	176.8	-174	31.4	0	0	0	113	Y489 Y503 L504 I505	Y489-N501 HydrophobicContact CD1-CB 3.82Å; Y489-N501 HydrophobicContact CD2-CB 4.37Å; Y489-N501 HydrophobicContact CE1-CB 3.7Å; Y489-N501 HydrophobicContact CE2-CB 4.24Å; Y489-N501 VanDerWaalsContact CE2-N 3.33Å; Y489-N501 HydrophobicContact CG-CB 4.15Å; N501-Y503 PolarHBondContact O-N 3.09Å; N501-L504 WeakPolarHBondContact O-CB 3.42Å; N501-L504 PolarHBondContact O-N 3.48Å; N501-L504 VanDerWaalsContact O-N 3.16Å; N501-I505 WeakPolarHBondContact O-CG1 3.48Å; N501-I505 PolarHBondContact O-N 3.09Å
502	S	89.7	Confident	89.7	Confident	72 Å²	72	68.4 Å²	68.4	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-27.8	177.2	55	0	0	0	0	113.5	R500 L506	R500-S502 PolarHBondContact O-N 3.04Å; S502-L506 WeakPolarHBondContact O-CB 3.28Å; S502-L506 PolarHBondContact O-N 2.91Å; S502-L506 VanDerWaalsContact O-N 3.15Å
503	Y	90.1	Very high	89.3	Confident	104 Å²	104	73.5 Å²	73.5	41%	0.408	36%	0.361	S	S	.	.	H	α-helix	trans	-78.2	-38.9	173.5	-62	-15.8	0	0	0	111.4	R500 N501 L506 H507	R500-Y503 HydrophobicContact CB-CD2 3.96Å; R500-Y503 HydrophobicContact CB-CE2 4.33Å; R500-Y503 HydrophobicContact CB-CG 4.16Å; R500-Y503 HydrophobicContact CG-CD2 4.47Å; R500-Y503 HydrophobicContact CG-CE2 4.39Å; R500-Y503 PolarHBondContact NH1-OH 3.37Å; R500-Y503 WeakPolarHBondContact O-CB 3.48Å; R500-Y503 PolarHBondContact O-N 3.4Å; N501-Y503 PolarHBondContact O-N 3.09Å; Y503-L506 PolarHBondContact O-N 3.01Å; Y503-H507 VanDerWaalsContact O-CB 3.28Å; Y503-H507 WeakPolarHBondContact O-CB 3.48Å; Y503-H507 PolarHBondContact O-N 2.93Å
504	L	92.6	Very high	89	Confident	21 Å²	21	73.7 Å²	73.7	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-48.9	170.3	172.9	60.7	0	0	0	111.6	E490 C491 F498 R500 N501 L506 H507 R508	E490-L504 WeakPolarHBondContact O-CD2 3.38Å; C491-L504 HydrophobicContact CB-CD1 3.58Å; F498-L504 HydrophobicContact CD2-CB 3.97Å; F498-L504 HydrophobicContact CD2-CD1 4.05Å; F498-L504 HydrophobicContact CE2-CD1 4.21Å; F498-L504 HydrophobicContact CG-CB 4.46Å; R500-L504 PolarHBondContact O-N 2.96Å; N501-L504 WeakPolarHBondContact O-CB 3.42Å; N501-L504 PolarHBondContact O-N 3.48Å; N501-L504 VanDerWaalsContact O-N 3.16Å; L504-L506 VanDerWaalsContact C-N 3.28Å; L504-L506 PolarHBondContact O-N 3.16Å; L504-H507 WeakPolarHBondContact O-CB 3.47Å; L504-H507 PolarHBondContact O-N 3.03Å; L504-H507 VanDerWaalsContact O-N 3.13Å; L504-R508 HydrophobicContact CD1-CG 4.14Å; L504-R508 WeakPolarHBondContact O-CG 3.37Å; L504-R508 PolarHBondContact O-N 2.93Å
505	I	89.9	Confident	88.7	Confident	86 Å²	86	77 Å²	77	44%	0.441	37%	0.371	S	S	.	.	H	α-helix	trans	-60.2	-38.1	177.8	-68.4	168.1	0	0	0	111.6	N501	N501-I505 WeakPolarHBondContact O-CG1 3.48Å; N501-I505 PolarHBondContact O-N 3.09Å
506	L	88.8	Confident	88.6	Confident	46 Å²	46	78.3 Å²	78.3	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-68	-44.2	174.3	175.1	58.4	0	0	0	111.3	S502 Y503 L504 R508 R509 R528	S502-L506 WeakPolarHBondContact O-CB 3.28Å; S502-L506 PolarHBondContact O-N 2.91Å; S502-L506 VanDerWaalsContact O-N 3.15Å; Y503-L506 PolarHBondContact O-N 3.01Å; L504-L506 VanDerWaalsContact C-N 3.28Å; L504-L506 PolarHBondContact O-N 3.16Å; L506-R508 PolarHBondContact O-N 3.46Å; L506-R509 VanDerWaalsContact O-CB 3.27Å; L506-R509 WeakPolarHBondContact O-CB 3.43Å; L506-R509 PolarHBondContact O-N 3.43Å; L506-R509 VanDerWaalsContact O-N 3.09Å; L506-R528 HydrophobicContact CD1-CG 3.54Å; L506-R528 HydrophobicContact CD2-CG 4.15Å
507	H	90.1	Very high	88.5	Confident	22 Å²	22	76 Å²	76	10%	0.102	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-40.6	179.4	176.3	66.9	0	0	0	112.4	C491 C494 F498 Y503 L504 R509 I510 H511	C491-H507 VanDerWaalsContact SG-CD2 3.58Å; C494-H507 PolarHBondContact SG-NE2 3.11Å; F498-H507 HydrophobicContact CE1-CB 4.2Å; F498-H507 HydrophobicContact CE2-CB 3.81Å; F498-H507 AromaticContact CE2-CD2 3.58Å; F498-H507 AromaticContact CE2-CG 3.67Å; F498-H507 HydrophobicContact CZ-CB 3.5Å; F498-H507 AromaticContact CZ-CD2 3.65Å; F498-H507 AromaticContact CZ-CG 3.32Å; F498-H507 AromaticContact CZ-ND1 3.77Å; Y503-H507 VanDerWaalsContact O-CB 3.28Å; Y503-H507 WeakPolarHBondContact O-CB 3.48Å; Y503-H507 PolarHBondContact O-N 2.93Å; L504-H507 WeakPolarHBondContact O-CB 3.47Å; L504-H507 PolarHBondContact O-N 3.03Å; L504-H507 VanDerWaalsContact O-N 3.13Å; H507-R509 PolarHBondContact O-N 3.01Å; H507-I510 VanDerWaalsContact O-CB 3.24Å; H507-I510 WeakPolarHBondContact O-CB 3.25Å; H507-I510 WeakPolarHBondContact O-CG1 3.47Å; H507-I510 PolarHBondContact O-N 3.39Å; H507-H511 AromaticContact CD2-NE2 3.73Å; H507-H511 AromaticContact CE1-NE2 3.99Å; H507-H511 AromaticContact NE2-NE2 3.03Å; H507-H511 PolarHBondContact NE2-NE2 3.35Å
508	R	88.8	Confident	88.4	Confident	116 Å²	116	81.3 Å²	81.3	44%	0.438	38%	0.376	S	S	.	.	H	α-helix	trans	-61.3	-16	175	-68.7	-172	71	-152.2	-1.6	114.4	E493 L504 L506 I510 T512	E493-R508 IonicContact OE1-CZ 2.78Å; E493-R508 VanDerWaalsContact OE1-CZ 3.27Å; E493-R508 IonicContact OE1-NE 3.75Å; E493-R508 PolarHBondContact OE1-NE 3.11Å; E493-R508 IonicContact OE1-NH2 3.9Å; E493-R508 PolarHBondContact OE1-NH2 3.43Å; L504-R508 HydrophobicContact CD1-CG 4.14Å; L504-R508 WeakPolarHBondContact O-CG 3.37Å; L504-R508 PolarHBondContact O-N 2.93Å; L506-R508 PolarHBondContact O-N 3.46Å; R508-I510 PolarHBondContact O-N 3.33Å; R508-T512 PolarHBondContact O-N 2.98Å; R508-T512 PolarHBondContact O-OG1 3Å
509	R	87.9	Confident	88.4	Confident	52 Å²	52	79.2 Å²	79.2	20%	0.196	37%	0.367	C	S	.	.	H	α-helix	trans	-72.3	-18	171.2	-58.4	-178.2	-175.8	-169.1	-4.9	113.4	L506 H507 T512 R513 E514 T527	L506-R509 VanDerWaalsContact O-CB 3.27Å; L506-R509 WeakPolarHBondContact O-CB 3.43Å; L506-R509 PolarHBondContact O-N 3.43Å; L506-R509 VanDerWaalsContact O-N 3.09Å; H507-R509 PolarHBondContact O-N 3.01Å; R509-T512 WeakPolarHBondContact CA-OG1 3.3Å; R509-R513 CarbonylContact O-C 3.58Å; R509-R513 VanDerWaalsContact O-CA 3.26Å; R509-R513 WeakPolarHBondContact O-CA 3.44Å; R509-R513 PolarHBondContact O-N 2.95Å; R509-E514 PolarHBondContact O-N 3.17Å; R509-T527 PolarHBondContact NH1-O 3.41Å
510	I	86	Confident	88.4	Confident	88 Å²	88	83.9 Å²	83.9	45%	0.451	40%	0.397	S	S	.	.	H	α-helix	trans	-71.1	-49.1	175.6	-57.3	176.9	0	0	0	109.1	H507 R508 R513	H507-I510 VanDerWaalsContact O-CB 3.24Å; H507-I510 WeakPolarHBondContact O-CB 3.25Å; H507-I510 WeakPolarHBondContact O-CG1 3.47Å; H507-I510 PolarHBondContact O-N 3.39Å; R508-I510 PolarHBondContact O-N 3.33Å; I510-R513 WeakPolarHBondContact O-CG 3.23Å; I510-R513 PolarHBondContact O-N 3.45Å
511	H	86.9	Confident	88.2	Confident	84 Å²	84	85.2 Å²	85.2	39%	0.389	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-49.7	178.4	-59.3	-44.5	0	0	0	112.5	C491 E493 C494 H507 R513	C491-H511 PolarHBondContact SG-NE2 2.84Å; E493-H511 WeakPolarHBondContact OE2-CB 3.32Å; E493-H511 IonicContact OE2-CD2 3.89Å; E493-H511 PolarHBondContact OE2-CD2 2.67Å; E493-H511 IonicContact OE2-CG 2.84Å; C494-H511 WeakPolarHBondContact CB-CE1 3.43Å; C494-H511 WeakPolarHBondContact CB-NE2 3.2Å; C494-H511 VanDerWaalsContact SG-CE1 3.5Å; C494-H511 PolarHBondContact SG-NE2 3.12Å; H507-H511 AromaticContact CD2-NE2 3.73Å; H507-H511 AromaticContact CE1-NE2 3.99Å; H507-H511 AromaticContact NE2-NE2 3.03Å; H507-H511 PolarHBondContact NE2-NE2 3.35Å; H511-R513 PolarHBondContact O-N 2.99Å
512	T	83.9	Confident	88.2	Confident	73 Å²	73	84.9 Å²	84.9	45%	0.448	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.1	177.3	54.3	0	0	0	0	113.9	R508 R509 E514	R508-T512 PolarHBondContact O-N 2.98Å; R508-T512 PolarHBondContact O-OG1 3Å; R509-T512 WeakPolarHBondContact CA-OG1 3.3Å; T512-E514 PolarHBondContact O-N 3.49Å
513	R	83.3	Confident	88	Confident	216 Å²	216	84.1 Å²	84.1	82%	0.815	41%	0.41	S	S	*	.			trans	51.2	21.1	-172.6	-61.2	-178	174.9	-178.7	-1.1	114.3	R509 I510 H511 K515	R509-R513 CarbonylContact O-C 3.58Å; R509-R513 VanDerWaalsContact O-CA 3.26Å; R509-R513 WeakPolarHBondContact O-CA 3.44Å; R509-R513 PolarHBondContact O-N 2.95Å; I510-R513 WeakPolarHBondContact O-CG 3.23Å; I510-R513 PolarHBondContact O-N 3.45Å; H511-R513 PolarHBondContact O-N 2.99Å; R513-K515 PolarHBondContact O-N 3.33Å
514	E	83.9	Confident	87.9	Confident	88 Å²	88	85.5 Å²	85.5	41%	0.411	42%	0.419	S	S	.	.			trans	-63.9	123.3	-180	-79.6	-169.2	177.3	0	0	111.1	R509 T512 P516	R509-E514 PolarHBondContact O-N 3.17Å; T512-E514 PolarHBondContact O-N 3.49Å; E514-P516 WeakPolarHBondContact O-CD 3.44Å
515	K	85.5	Confident	87.8	Confident	118 Å²	118	86 Å²	86	51%	0.513	43%	0.426	S	S	.	.			trans	-119.7	76.5	173.3	-69.4	176	173.1	-173.2	0	110.2	R513 Y517 A525 F526 T527	R513-K515 PolarHBondContact O-N 3.33Å; K515-Y517 VanDerWaalsContact C-N 3.25Å; K515-Y517 PolarHBondContact O-N 3.41Å; K515-A525 HydrophobicContact CB-CB 3.67Å; K515-A525 HydrophobicContact CD-CB 4.27Å; K515-F526 CarbonylContact C-O 3.56Å; K515-F526 VanDerWaalsContact C-O 3.3Å; K515-F526 WeakPolarHBondContact CA-O 3.39Å; K515-T527 HydrophobicContact CG-CG2 3.93Å
516	P	87.4	Confident	87.6	Confident	70 Å²	70	83.9 Å²	83.9	46%	0.455	41%	0.414	S	S	.	.			trans	-67.5	-23.9	-172	-20.7	34.2	0	0	0	113.9	E514 K518	E514-P516 WeakPolarHBondContact O-CD 3.44Å; P516-K518 PolarHBondContact O-N 2.72Å
517	Y	89.4	Confident	87.5	Confident	78 Å²	78	83.5 Å²	83.5	31%	0.306	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	93.9	-171.4	-55.3	-73.7	0	0	0	110.3	K515 A525 F526 T527 R528 S529	K515-Y517 VanDerWaalsContact C-N 3.25Å; K515-Y517 PolarHBondContact O-N 3.41Å; Y517-A525 CarbonylContact O-C 3.59Å; Y517-F526 PolarHBondContact N-O 2.92Å; Y517-F526 VanDerWaalsContact N-O 3.16Å; Y517-F526 PolarHBondContact O-N 3Å; Y517-T527 WeakPolarHBondContact CE2-O 3.31Å; Y517-R528 VanDerWaalsContact CE2-C 3.49Å; Y517-S529 VanDerWaalsContact CD2-N 3.32Å; Y517-S529 VanDerWaalsContact CE2-N 3.27Å
518	K	89.5	Confident	87.3	Confident	149 Å²	149	86.1 Å²	86.1	65%	0.648	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.3	177.6	-61.6	-172.9	178.6	-177	0	111.3	P516 T520 A525	P516-K518 PolarHBondContact O-N 2.72Å; K518-T520 PolarHBondContact O-N 3.31Å; K518-A525 HydrophobicContact CG-CB 3.94Å
519	C	92.8	Very high	87.3	Confident	2 Å²	2	83.6 Å²	83.6	1%	0.014	42%	0.422	C	S	.	.			trans	-74.4	120.8	170.2	-174.3	0	0	0	0	110	K521 C522 G523 K524 F526 L532	C519-K521 PolarHBondContact O-N 3.47Å; C519-C522 VanDerWaalsContact SG-SG 3.64Å; C519-G523 VanDerWaalsContact O-CA 3.29Å; C519-G523 WeakPolarHBondContact O-CA 3.41Å; C519-G523 PolarHBondContact O-N 3.11Å; C519-K524 WeakPolarHBondContact CB-O 3.5Å; C519-K524 PolarHBondContact N-O 3.13Å; C519-F526 HydrophobicContact CB-CE2 4.31Å; C519-L532 HydrophobicContact CB-CD1 3.6Å
520	T	89.4	Confident	87.4	Confident	135 Å²	135	84 Å²	84	83%	0.828	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.3	178.6	50.3	0	0	0	0	113.9	K518	K518-T520 PolarHBondContact O-N 3.31Å
521	K	85.8	Confident	87.6	Confident	110 Å²	110	82.2 Å²	82.2	48%	0.478	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-34.4	-178.2	-71.6	-176.5	168.9	-171.1	0	114.5	C519 H539	C519-K521 PolarHBondContact O-N 3.47Å; K521-H539 HydrophobicContact CD-CB 3.48Å; K521-H539 VanDerWaalsContact CD-CB 3.48Å; K521-H539 PolarHBondContact NZ-O 3.3Å
522	C	90.3	Very high	87.8	Confident	53 Å²	53	79.1 Å²	79.1	36%	0.358	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.7	9.8	-174.2	66.5	0	0	0	0	114.5	C519 K524 H535 H539	C519-C522 VanDerWaalsContact SG-SG 3.64Å; C522-K524 PolarHBondContact O-N 3.03Å; C522-H535 PolarHBondContact SG-NE2 3.33Å; C522-H539 PolarHBondContact SG-NE2 3.29Å; C522-H539 VanDerWaalsContact SG-NE2 3.41Å
523	G	86.1	Confident	88.1	Confident	55 Å²	55	79.5 Å²	79.5	57%	0.567	42%	0.415	S	S	*	.			trans	70.1	-16.1	179.5	0	0	0	0	0	116.2	C519 A525	C519-G523 VanDerWaalsContact O-CA 3.29Å; C519-G523 WeakPolarHBondContact O-CA 3.41Å; C519-G523 PolarHBondContact O-N 3.11Å; G523-A525 PolarHBondContact O-N 3.24Å
524	K	87.4	Confident	88.4	Confident	134 Å²	134	74.2 Å²	74.2	58%	0.583	40%	0.402	S	S	*	.			trans	-56.3	129.3	-176.5	-68	-173.1	178.7	-174.8	0	111.6	C519 C522 F526	C519-K524 WeakPolarHBondContact CB-O 3.5Å; C519-K524 PolarHBondContact N-O 3.13Å; C522-K524 PolarHBondContact O-N 3.03Å; K524-F526 HydrophobicContact CB-CE2 3.96Å; K524-F526 HydrophobicContact CB-CZ 4.06Å; K524-F526 WeakPolarHBondContact O-CD2 3.23Å; K524-F526 VanDerWaalsContact O-CE2 3.31Å; K524-F526 WeakPolarHBondContact O-CE2 3.48Å
525	A	90	Very high	88.6	Confident	32 Å²	32	71.2 Å²	71.2	26%	0.264	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.9	-175.7	0	0	0	0	0	111.9	K515 Y517 K518 G523	K515-A525 HydrophobicContact CB-CB 3.67Å; K515-A525 HydrophobicContact CD-CB 4.27Å; Y517-A525 CarbonylContact O-C 3.59Å; K518-A525 HydrophobicContact CG-CB 3.94Å; G523-A525 PolarHBondContact O-N 3.24Å
526	F	86.5	Confident	88.7	Confident	41 Å²	41	68.7 Å²	68.7	18%	0.18	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.5	-174.8	-58	-89.5	0	0	0	111.6	K515 Y517 C519 K524 L532 H535	K515-F526 CarbonylContact C-O 3.56Å; K515-F526 VanDerWaalsContact C-O 3.3Å; K515-F526 WeakPolarHBondContact CA-O 3.39Å; Y517-F526 PolarHBondContact N-O 2.92Å; Y517-F526 VanDerWaalsContact N-O 3.16Å; Y517-F526 PolarHBondContact O-N 3Å; C519-F526 HydrophobicContact CB-CE2 4.31Å; K524-F526 HydrophobicContact CB-CE2 3.96Å; K524-F526 HydrophobicContact CB-CZ 4.06Å; K524-F526 WeakPolarHBondContact O-CD2 3.23Å; K524-F526 VanDerWaalsContact O-CE2 3.31Å; K524-F526 WeakPolarHBondContact O-CE2 3.48Å; F526-L532 HydrophobicContact CB-CB 4.41Å; F526-L532 HydrophobicContact CD2-CB 3.95Å; F526-L532 HydrophobicContact CD2-CD1 3.78Å; F526-L532 HydrophobicContact CD2-CG 4.44Å; F526-L532 HydrophobicContact CE2-CD1 3.85Å; F526-L532 HydrophobicContact CG-CB 4.32Å; F526-H535 HydrophobicContact CE1-CB 4.23Å; F526-H535 HydrophobicContact CE2-CB 4.1Å; F526-H535 AromaticContact CE2-CD2 3.56Å; F526-H535 AromaticContact CE2-CG 3.86Å; F526-H535 HydrophobicContact CZ-CB 3.66Å; F526-H535 AromaticContact CZ-CD2 3.52Å; F526-H535 AromaticContact CZ-CG 3.39Å; F526-H535 AromaticContact CZ-ND1 3.9Å
527	T	85.9	Confident	88.7	Confident	38 Å²	38	72.8 Å²	72.8	23%	0.233	38%	0.384	C	S	.	.	S	Bend	trans	-75.9	-25.6	177	52.5	0	0	0	0	112.9	R509 K515 Y517	R509-T527 PolarHBondContact NH1-O 3.41Å; K515-T527 HydrophobicContact CG-CG2 3.93Å; Y517-T527 WeakPolarHBondContact CE2-O 3.31Å
528	R	87.1	Confident	88.6	Confident	77 Å²	77	73.1 Å²	73.1	29%	0.291	39%	0.39	S	S	.	.	S	Bend	trans	-123.8	146.7	-175.6	-62.5	168.3	71.6	159.7	1.6	111.2	L506 Y517 T531 L532	L506-R528 HydrophobicContact CD1-CG 3.54Å; L506-R528 HydrophobicContact CD2-CG 4.15Å; Y517-R528 VanDerWaalsContact CE2-C 3.49Å; R528-T531 HydrophobicContact CB-CG2 4.38Å; R528-T531 PolarHBondContact O-OG1 2.9Å; R528-L532 PolarHBondContact O-N 3.48Å
529	S	89.3	Confident	88.3	Confident	62 Å²	62	67 Å²	67	43%	0.434	36%	0.364	S	S	.	.	H	α-helix	trans	-69.1	-37.6	173.3	51.9	0	0	0	0	111.7	Y517 T531 L532 T533	Y517-S529 VanDerWaalsContact CD2-N 3.32Å; Y517-S529 VanDerWaalsContact CE2-N 3.27Å; S529-T531 VanDerWaalsContact C-N 3.32Å; S529-T531 PolarHBondContact O-N 3.45Å; S529-L532 WeakPolarHBondContact O-CB 3.3Å; S529-L532 PolarHBondContact O-N 2.86Å; S529-L532 VanDerWaalsContact O-N 3.16Å; S529-T533 PolarHBondContact O-N 3.19Å; S529-T533 PolarHBondContact O-OG1 3.19Å; S529-T533 VanDerWaalsContact O-OG1 3.1Å
530	S	89.3	Confident	87.7	Confident	61 Å²	61	69.8 Å²	69.8	43%	0.427	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-37.4	-179.7	58	0	0	0	0	113.2	T533 L534	S530-T533 PolarHBondContact O-N 3.48Å; S530-L534 PolarHBondContact O-N 2.89Å
531	T	89.1	Confident	86.7	Confident	50 Å²	50	72.8 Å²	72.8	31%	0.307	38%	0.383	S	S	.	.	H	α-helix	trans	-73.1	-36.1	176.3	50.9	0	0	0	0	111.4	R528 S529 L534 H535	R528-T531 HydrophobicContact CB-CG2 4.38Å; R528-T531 PolarHBondContact O-OG1 2.9Å; S529-T531 VanDerWaalsContact C-N 3.32Å; S529-T531 PolarHBondContact O-N 3.45Å; T531-L534 PolarHBondContact O-N 3.08Å; T531-H535 VanDerWaalsContact O-CB 3.28Å; T531-H535 WeakPolarHBondContact O-CB 3.47Å; T531-H535 PolarHBondContact O-N 3.15Å
532	L	91.3	Very high	85.5	Confident	20 Å²	20	72.2 Å²	72.2	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-63.1	-43.7	169.3	176.2	61.3	0	0	0	112	C519 F526 R528 S529 L534 H535 H536	C519-L532 HydrophobicContact CB-CD1 3.6Å; F526-L532 HydrophobicContact CB-CB 4.41Å; F526-L532 HydrophobicContact CD2-CB 3.95Å; F526-L532 HydrophobicContact CD2-CD1 3.78Å; F526-L532 HydrophobicContact CD2-CG 4.44Å; F526-L532 HydrophobicContact CE2-CD1 3.85Å; F526-L532 HydrophobicContact CG-CB 4.32Å; R528-L532 PolarHBondContact O-N 3.48Å; S529-L532 WeakPolarHBondContact O-CB 3.3Å; S529-L532 PolarHBondContact O-N 2.86Å; S529-L532 VanDerWaalsContact O-N 3.16Å; L532-L534 VanDerWaalsContact C-N 3.34Å; L532-L534 PolarHBondContact O-N 3.17Å; L532-H535 WeakPolarHBondContact O-CB 3.33Å; L532-H535 PolarHBondContact O-N 3.08Å; L532-H536 WeakPolarHBondContact CD1-NE2 3.36Å; L532-H536 PolarHBondContact O-CD2 3.31Å; L532-H536 VanDerWaalsContact O-CD2 3.27Å; L532-H536 PolarHBondContact O-N 2.74Å
533	T	90.4	Very high	83.8	Confident	80 Å²	80	78.1 Å²	78.1	49%	0.491	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-39.6	176.5	-56.2	0	0	0	0	112	S529 S530	S529-T533 PolarHBondContact O-N 3.19Å; S529-T533 PolarHBondContact O-OG1 3.19Å; S529-T533 VanDerWaalsContact O-OG1 3.1Å; S530-T533 PolarHBondContact O-N 3.48Å
534	L	89.2	Confident	82.3	Confident	106 Å²	106	79 Å²	79	56%	0.555	40%	0.399	S	S	*	.	H	α-helix	trans	-64.1	-45.4	172.5	179.6	59.5	0	0	0	111	S530 T531 L532 H536 R537	S530-L534 PolarHBondContact O-N 2.89Å; T531-L534 PolarHBondContact O-N 3.08Å; L532-L534 VanDerWaalsContact C-N 3.34Å; L532-L534 PolarHBondContact O-N 3.17Å; L534-H536 VanDerWaalsContact C-N 3.33Å; L534-H536 PolarHBondContact O-N 3.34Å; L534-R537 VanDerWaalsContact O-CB 3.29Å; L534-R537 WeakPolarHBondContact O-CB 3.3Å; L534-R537 PolarHBondContact O-N 2.98Å
535	H	88.9	Confident	80.8	Confident	24 Å²	24	77.4 Å²	77.4	11%	0.111	41%	0.405	C	S	.	.	H	α-helix	trans	-61.1	-37.8	177.7	179	64.3	0	0	0	112.9	C522 F526 T531 L532 R537 I538 H539	C522-H535 PolarHBondContact SG-NE2 3.33Å; F526-H535 HydrophobicContact CE1-CB 4.23Å; F526-H535 HydrophobicContact CE2-CB 4.1Å; F526-H535 AromaticContact CE2-CD2 3.56Å; F526-H535 AromaticContact CE2-CG 3.86Å; F526-H535 HydrophobicContact CZ-CB 3.66Å; F526-H535 AromaticContact CZ-CD2 3.52Å; F526-H535 AromaticContact CZ-CG 3.39Å; F526-H535 AromaticContact CZ-ND1 3.9Å; T531-H535 VanDerWaalsContact O-CB 3.28Å; T531-H535 WeakPolarHBondContact O-CB 3.47Å; T531-H535 PolarHBondContact O-N 3.15Å; L532-H535 WeakPolarHBondContact O-CB 3.33Å; L532-H535 PolarHBondContact O-N 3.08Å; H535-R537 PolarHBondContact O-N 3.34Å; H535-R537 VanDerWaalsContact O-N 3.14Å; H535-I538 VanDerWaalsContact O-CB 3.31Å; H535-I538 WeakPolarHBondContact O-CB 3.45Å; H535-I538 PolarHBondContact O-N 2.82Å; H535-H539 AromaticContact CD2-CD2 3.87Å; H535-H539 AromaticContact CD2-NE2 3.67Å; H535-H539 AromaticContact CE1-NE2 3.43Å; H535-H539 PolarHBondContact CE1-NE2 3.13Å; H535-H539 AromaticContact NE2-CD2 3.57Å; H535-H539 AromaticContact NE2-NE2 2.92Å; H535-H539 PolarHBondContact NE2-NE2 2.9Å; H535-H539 PolarHBondContact O-CD2 3.4Å
536	H	86.8	Confident	78.9	Confident	66 Å²	66	83.4 Å²	83.4	31%	0.306	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-21.2	173.7	-79.7	-54.3	0	0	0	113.9	L532 L534 I538 A540	L532-H536 WeakPolarHBondContact CD1-NE2 3.36Å; L532-H536 PolarHBondContact O-CD2 3.31Å; L532-H536 VanDerWaalsContact O-CD2 3.27Å; L532-H536 PolarHBondContact O-N 2.74Å; L534-H536 VanDerWaalsContact C-N 3.33Å; L534-H536 PolarHBondContact O-N 3.34Å; H536-I538 VanDerWaalsContact C-N 3.31Å; H536-A540 PolarHBondContact O-N 3.32Å
537	R	88.4	Confident	77.1	Confident	156 Å²	156	91.2 Å²	91.2	59%	0.589	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-24.2	173.7	-58	179.1	-178.7	175	-3.2	112.8	L534 H535 A540 R541	L534-R537 VanDerWaalsContact O-CB 3.29Å; L534-R537 WeakPolarHBondContact O-CB 3.3Å; L534-R537 PolarHBondContact O-N 2.98Å; H535-R537 PolarHBondContact O-N 3.34Å; H535-R537 VanDerWaalsContact O-N 3.14Å; R537-A540 PolarHBondContact O-N 2.76Å; R537-R541 WeakPolarHBondContact O-CG 3.35Å; R537-R541 PolarHBondContact O-N 3.01Å
538	I	86.4	Confident	75	Confident	84 Å²	84	92.4 Å²	92.4	43%	0.431	47%	0.467	S	S	.	.	H	α-helix	trans	-67	-53	174.3	-54.8	176.6	0	0	0	108.4	H535 H536 A540 R541 E542	H535-I538 VanDerWaalsContact O-CB 3.31Å; H535-I538 WeakPolarHBondContact O-CB 3.45Å; H535-I538 PolarHBondContact O-N 2.82Å; H536-I538 VanDerWaalsContact C-N 3.31Å; I538-A540 PolarHBondContact O-N 3.11Å; I538-R541 WeakPolarHBondContact O-CB 3.39Å; I538-R541 PolarHBondContact O-N 3.09Å; I538-E542 WeakPolarHBondContact CG2-OE1 3.37Å; I538-E542 PolarHBondContact O-N 3.15Å; I538-E542 VanDerWaalsContact O-N 3.09Å
539	H	84.1	Confident	73.1	Confident	21 Å²	21	93.7 Å²	93.7	10%	0.097	49%	0.485	C	S	.	.	H	α-helix	trans	-59.3	-13.8	172.5	-67.8	-74.6	0	0	0	116.1	K521 C522 H535 E542	K521-H539 HydrophobicContact CD-CB 3.48Å; K521-H539 VanDerWaalsContact CD-CB 3.48Å; K521-H539 PolarHBondContact NZ-O 3.3Å; C522-H539 PolarHBondContact SG-NE2 3.29Å; C522-H539 VanDerWaalsContact SG-NE2 3.41Å; H535-H539 AromaticContact CD2-CD2 3.87Å; H535-H539 AromaticContact CD2-NE2 3.67Å; H535-H539 AromaticContact CE1-NE2 3.43Å; H535-H539 PolarHBondContact CE1-NE2 3.13Å; H535-H539 AromaticContact NE2-CD2 3.57Å; H535-H539 AromaticContact NE2-NE2 2.92Å; H535-H539 PolarHBondContact NE2-NE2 2.9Å; H535-H539 PolarHBondContact O-CD2 3.4Å; H539-E542 WeakPolarHBondContact CA-OE2 3.47Å; H539-E542 IonicContact ND1-OE2 3.69Å
540	A	79.2	Confident	71.1	Confident	60 Å²	60	94.6 Å²	94.6	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-90.9	-26.3	174.8	0	0	0	0	0	111.7	H536 R537 I538	H536-A540 PolarHBondContact O-N 3.32Å; R537-A540 PolarHBondContact O-N 2.76Å; I538-A540 PolarHBondContact O-N 3.11Å
541	R	68.8	Low	69.1	Low	199 Å²	199	95 Å²	95	75%	0.751	50%	0.499	S	S	*	.	H	α-helix	trans	-80.7	-42.6	175.3	-70.2	171.4	173.8	-169.3	-5.5	111.5	R537 I538 R543 A544 S545	R537-R541 WeakPolarHBondContact O-CG 3.35Å; R537-R541 PolarHBondContact O-N 3.01Å; I538-R541 WeakPolarHBondContact O-CB 3.39Å; I538-R541 PolarHBondContact O-N 3.09Å; R541-R543 VanDerWaalsContact C-N 3.28Å; R541-R543 PolarHBondContact O-N 3.09Å; R541-A544 WeakPolarHBondContact O-CB 3.46Å; R541-A544 PolarHBondContact O-N 2.77Å; R541-S545 PolarHBondContact O-N 3.44Å
542	E	60.6	Low	67.1	Low	97 Å²	97	98.6 Å²	98.6	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-58.1	-39.9	176.2	-68	161.3	172.1	0	0	111.9	I538 H539 A544 S545	I538-E542 WeakPolarHBondContact CG2-OE1 3.37Å; I538-E542 PolarHBondContact O-N 3.15Å; I538-E542 VanDerWaalsContact O-N 3.09Å; H539-E542 WeakPolarHBondContact CA-OE2 3.47Å; H539-E542 IonicContact ND1-OE2 3.69Å; E542-A544 PolarHBondContact O-N 2.88Å; E542-S545 PolarHBondContact O-N 3.17Å; E542-S545 PolarHBondContact O-OG 3.2Å
543	R	55.2	Low	65	Low	177 Å²	177	103.9 Å²	103.9	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-71	-16.9	176.2	-156.6	-177.6	-168.5	86.4	-6.1	113.9	R541	R541-R543 VanDerWaalsContact C-N 3.28Å; R541-R543 PolarHBondContact O-N 3.09Å
544	A	55	Low	62.9	Low	75 Å²	75	103.4 Å²	103.4	62%	0.62	55%	0.548	S	S	*	.	H	α-helix	trans	-85.9	-25.3	177	0	0	0	0	0	112.2	R541 E542	R541-A544 WeakPolarHBondContact O-CB 3.46Å; R541-A544 PolarHBondContact O-N 2.77Å; E542-A544 PolarHBondContact O-N 2.88Å
545	S	54.3	Low	60.5	Low	100 Å²	100	104.8 Å²	104.8	70%	0.699	55%	0.55	S	S	*	*	H	α-helix	trans	-75.5	-22.2	171.9	36.9	0	0	0	0	113.9	R541 E542	R541-S545 PolarHBondContact O-N 3.44Å; E542-S545 PolarHBondContact O-N 3.17Å; E542-S545 PolarHBondContact O-OG 3.2Å
546	E	50.4	Low	58.3	Low	157 Å²	157	105.3 Å²	105.3	73%	0.734	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-0.1	-177.3	-68.9	178.2	154.1	0	0	114.4
547	Y	50	Low	56.3	Low	205 Å²	205	105.2 Å²	105.2	80%	0.804	57%	0.573	S	S	*	*	S	Bend	trans	-142.5	71.1	-172.4	-141.1	-84.6	0	0	0	115
548	S	41.9	Very low	54	Low	63 Å²	63	104.5 Å²	104.5	44%	0.441	57%	0.574	S	S	.	*			trans	-160.6	88.1	150.3	-172.6	0	0	0	0	113.3	A550 S551	S548-A550 VanDerWaalsContact C-N 3.3Å; S548-S551 WeakPolarHBondContact OG-CB 3.43Å; S548-S551 PolarHBondContact OG-N 2.8Å; S548-S551 PolarHBondContact OG-OG 3.42Å
549	P	47.4	Very low	51.8	Low	104 Å²	104	105 Å²	105	68%	0.675	58%	0.578	S	S	*	*	S	Bend	trans	-72.3	-25.4	161.6	-16.7	32	0	0	0	112.3	S551	P549-S551 PolarHBondContact O-N 3.44Å
550	A	47.4	Very low	49.8	Very low	81 Å²	81	112.6 Å²	112.6	67%	0.669	61%	0.61	S	S	*	*	H	α-helix	trans	-81.3	-10.8	-166.9	0	0	0	0	0	115.6	S548	S548-A550 VanDerWaalsContact C-N 3.3Å
551	S	45.8	Very low	48	Very low	69 Å²	69	114.4 Å²	114.4	48%	0.483	62%	0.619	S	S	.	*	H	α-helix	trans	-90.8	-15.5	179.6	54.9	0	0	0	0	114.2	S548 P549	S548-S551 WeakPolarHBondContact OG-CB 3.43Å; S548-S551 PolarHBondContact OG-N 2.8Å; S548-S551 PolarHBondContact OG-OG 3.42Å; P549-S551 PolarHBondContact O-N 3.44Å
552	L	48.5	Very low	46.6	Very low	127 Å²	127	109.4 Å²	109.4	67%	0.665	61%	0.613	S	S	*	*	H	α-helix	trans	-76.9	-37.6	-179.7	-79.2	162.6	0	0	0	112.1	A554 F555 G556	L552-A554 VanDerWaalsContact C-N 3.33Å; L552-A554 PolarHBondContact O-N 2.93Å; L552-F555 PolarHBondContact O-N 3.26Å; L552-G556 PolarHBondContact O-N 3.41Å
553	D	46	Very low	45.6	Very low	131 Å²	131	113.6 Å²	113.6	70%	0.701	65%	0.645	S	S	*	*	H	α-helix	trans	-63.2	-37.9	177.6	-67.4	-31.1	0	0	0	112.5	G556 A557	D553-G556 PolarHBondContact O-N 2.94Å; D553-A557 WeakPolarHBondContact O-CB 3.37Å; D553-A557 PolarHBondContact O-N 3.47Å
554	A	45.8	Very low	45.1	Very low	69 Å²	69	110.5 Å²	110.5	57%	0.57	64%	0.644	S	S	*	*	H	α-helix	trans	-66.6	-37.2	177.3	0	0	0	0	0	112.6	L552 F558	L552-A554 VanDerWaalsContact C-N 3.33Å; L552-A554 PolarHBondContact O-N 2.93Å; A554-F558 PolarHBondContact O-N 3.31Å
555	F	40.6	Very low	44.6	Very low	136 Å²	136	112.3 Å²	112.3	60%	0.596	65%	0.646	S	S	*	*	H	α-helix	trans	-75.7	-37.2	177.6	-154.6	-99.7	0	0	0	111.7	L552 A557 F558 L559	L552-F555 PolarHBondContact O-N 3.26Å; F555-A557 VanDerWaalsContact C-N 3.35Å; F555-F558 PolarHBondContact O-N 3.18Å; F555-L559 HydrophobicContact CD1-CD1 3.96Å; F555-L559 HydrophobicContact CD1-CG 4.45Å; F555-L559 HydrophobicContact CE1-CD1 3.92Å; F555-L559 HydrophobicContact CE1-CG 4.39Å; F555-L559 PolarHBondContact O-N 3.25Å
556	G	41.5	Very low	44	Very low	35 Å²	35	113 Å²	113	36%	0.361	64%	0.643	S	S	.	*	H	α-helix	trans	-65.3	-33.7	173	0	0	0	0	0	113.7	L552 D553 K560	L552-G556 PolarHBondContact O-N 3.41Å; D553-G556 PolarHBondContact O-N 2.94Å; G556-K560 PolarHBondContact O-N 3.1Å
557	A	45.8	Very low	43.6	Very low	64 Å²	64	110.4 Å²	110.4	53%	0.529	64%	0.637	S	S	.	*	H	α-helix	trans	-69.1	-37.7	173.1	0	0	0	0	0	112.6	D553 F555	D553-A557 WeakPolarHBondContact O-CB 3.37Å; D553-A557 PolarHBondContact O-N 3.47Å; F555-A557 VanDerWaalsContact C-N 3.35Å
558	F	40.2	Very low	43.3	Very low	140 Å²	140	104.5 Å²	104.5	61%	0.614	63%	0.627	S	S	*	*	H	α-helix	trans	-64.5	-46.5	177.5	-173	-101.9	0	0	0	111.9	A554 F555 K560 S561	A554-F558 PolarHBondContact O-N 3.31Å; F555-F558 PolarHBondContact O-N 3.18Å; F558-K560 VanDerWaalsContact C-N 3.32Å; F558-K560 PolarHBondContact O-N 3.36Å; F558-S561 PolarHBondContact O-N 3.39Å; F558-S561 VanDerWaalsContact O-N 3.1Å
559	L	39	Very low	43.3	Very low	96 Å²	96	107.3 Å²	107.3	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-66.5	-29.7	-179.4	-67.7	174	0	0	0	113.6	F555 S561 C562	F555-L559 HydrophobicContact CD1-CD1 3.96Å; F555-L559 HydrophobicContact CD1-CG 4.45Å; F555-L559 HydrophobicContact CE1-CD1 3.92Å; F555-L559 HydrophobicContact CE1-CG 4.39Å; F555-L559 PolarHBondContact O-N 3.25Å; L559-S561 PolarHBondContact O-N 3.34Å; L559-C562 PolarHBondContact O-N 3.33Å
560	K	43.4	Very low	43	Very low	180 Å²	180	107.5 Å²	107.5	78%	0.783	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-7	174	-76.2	-178.5	177.6	179.9	0	114.5	G556 F558	G556-K560 PolarHBondContact O-N 3.1Å; F558-K560 VanDerWaalsContact C-N 3.32Å; F558-K560 PolarHBondContact O-N 3.36Å
561	S	40.3	Very low	42.7	Very low	98 Å²	98	109.5 Å²	109.5	69%	0.685	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	0.8	174.7	-170.9	0	0	0	0	113	F558 L559	F558-S561 PolarHBondContact O-N 3.39Å; F558-S561 VanDerWaalsContact O-N 3.1Å; L559-S561 PolarHBondContact O-N 3.34Å
562	C	39.7	Very low	42.5	Very low	93 Å²	93	112.9 Å²	112.9	63%	0.628	65%	0.647	S	S	*	*			trans	-119.3	14.6	-177.5	-62.7	0	0	0	0	113.3	L559	L559-C562 PolarHBondContact O-N 3.33Å
563	V	38.8	Very low	41.9	Very low	186 Å²	186	111.6 Å²	111.6	100%	1.127	65%	0.645	S	S	*	*			trans	-124.9	0	169.6	-177.1	0	0	0	0	107.4

Retrieved 563 of 563 residues in 315.9 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).