A0A087XXL0_POEFO Loading...

Carboxypeptidase Q

AlphaFold DB , UniProt , Accession A0A087XXL0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 486 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	35.1	Very low	23.8	Very low	235 Å²	235	152.3 Å²	152.3	100%	1.158	82%	0.817	S	S	*	*				0	86.5	0	-170.8	176.6	178	0	0	106.7
2	T	25.3	Very low	24.1	Very low	142 Å²	142	149.7 Å²	149.7	87%	0.871	81%	0.814	S	S	*	*			trans	-166	100.3	173.3	19.6	0	0	0	0	105.1
3	L	22.4	Very low	24.4	Very low	165 Å²	165	149 Å²	149	86%	0.864	81%	0.808	S	S	*	*			trans	-81.2	122.4	174.2	-89	99.1	0	0	0	108.5
4	E	21.3	Very low	24.8	Very low	179 Å²	179	149.9 Å²	149.9	84%	0.836	80%	0.801	S	S	*	*			trans	-77.3	119.1	160.6	-77.3	-178.1	148.2	0	0	108.8
5	V	22.7	Very low	25.1	Very low	119 Å²	119	150.1 Å²	150.1	72%	0.721	80%	0.798	S	S	*	*			trans	-92.7	106.2	168.8	179.3	0	0	0	0	107.3	V7	V5-V7 HydrophobicContact CG1-CG2 3.91Å; V5-V7 PolarHBondContact O-N 2.65Å
6	K	21.6	Very low	25.4	Very low	194 Å²	194	150 Å²	150	84%	0.843	79%	0.789	S	S	*	*			trans	-80.7	109.7	164.7	-79.2	-178.6	176.4	178.6	0	108.1
7	V	22.3	Very low	25.5	Very low	101 Å²	101	150.8 Å²	150.8	61%	0.612	79%	0.792	S	S	*	*			trans	-91.4	115	166.1	-171.7	0	0	0	0	107.2	V5 F9	V5-V7 HydrophobicContact CG1-CG2 3.91Å; V5-V7 PolarHBondContact O-N 2.65Å; V7-F9 HydrophobicContact CB-CD2 4.36Å; V7-F9 HydrophobicContact CB-CE2 4.28Å; V7-F9 HydrophobicContact CG1-CD2 3.56Å; V7-F9 HydrophobicContact CG1-CE2 3.35Å; V7-F9 HydrophobicContact CG1-CZ 4.3Å
8	A	21.4	Very low	25.5	Very low	98 Å²	98	151.8 Å²	151.8	81%	0.81	80%	0.797	S	S	*	*			trans	-87.5	115	170.6	0	0	0	0	0	108.2
9	F	23.6	Very low	25.5	Very low	188 Å²	188	149.4 Å²	149.4	83%	0.825	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-100.4	125.4	171.2	-89.5	-89.7	0	0	0	108.6	V7	V7-F9 HydrophobicContact CB-CD2 4.36Å; V7-F9 HydrophobicContact CB-CE2 4.28Å; V7-F9 HydrophobicContact CG1-CD2 3.56Å; V7-F9 HydrophobicContact CG1-CE2 3.35Å; V7-F9 HydrophobicContact CG1-CZ 4.3Å
10	L	22.1	Very low	25.5	Very low	162 Å²	162	150.6 Å²	150.6	85%	0.848	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.7	139.5	168.4	-90.4	104.1	0	0	0	109.7
11	P	24.3	Very low	25.4	Very low	92 Å²	92	146.9 Å²	146.9	60%	0.597	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.3	156.4	170.7	32.1	-32.5	0	0	0	111.1	L13	P11-L13 PolarHBondContact O-N 2.92Å
12	P	26.5	Very low	24.8	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-67.5	118.2	174.1	28.1	-32.1	0	0	0	109.6	F14	P12-F14 PolarHBondContact O-N 3.46Å
13	L	29.2	Very low	24.8	Very low	141 Å²	141	143.4 Å²	143.4	74%	0.738	78%	0.781	S	S	*	*			trans	-90.1	88.6	-175.5	-156.1	89	0	0	0	109.6	P11 M15	P11-L13 PolarHBondContact O-N 2.92Å; L13-M15 HydrophobicContact CD2-CB 4.44Å; L13-M15 HydrophobicContact CD2-SD 4.49Å; L13-M15 HydrophobicContact CG-CB 4.48Å; L13-M15 HydrophobicContact CG-CG 4.47Å; L13-M15 PolarHBondContact O-N 3.38Å
14	F	29	Very low	24.9	Very low	162 Å²	162	140.3 Å²	140.3	71%	0.711	77%	0.773	S	S	*	*			trans	-80.2	106.5	157.4	-97.5	-88.9	0	0	0	107.5	P12	P12-F14 PolarHBondContact O-N 3.46Å
15	M	30.1	Very low	25	Very low	153 Å²	153	140.8 Å²	140.8	75%	0.754	78%	0.775	S	S	*	*			trans	-126.5	115.4	172.8	-108.4	-165.4	-171.4	0	0	111	L13	L13-M15 HydrophobicContact CD2-CB 4.44Å; L13-M15 HydrophobicContact CD2-SD 4.49Å; L13-M15 HydrophobicContact CG-CB 4.48Å; L13-M15 HydrophobicContact CG-CG 4.47Å; L13-M15 PolarHBondContact O-N 3.38Å
16	F	30.2	Very low	25.1	Very low	148 Å²	148	141.4 Å²	141.4	65%	0.649	78%	0.78	S	S	*	*			trans	-70.4	132.1	160.7	-93.2	-88.6	0	0	0	110.2	L18 P194	F16-L18 PolarHBondContact O-N 3.46Å; F16-P194 HydrophobicContact CE1-CB 3.57Å; F16-P194 HydrophobicContact CZ-CB 3.53Å; F16-P194 WeakPolarHBondContact CZ-O 3.47Å
17	I	25.8	Very low	25.2	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	78%	0.783	S	S	*	*			trans	-78.1	114.7	175	-64	175.1	0	0	0	109.1
18	L	25.5	Very low	25.3	Very low	169 Å²	169	140.2 Å²	140.2	89%	0.885	79%	0.786	S	S	*	*			trans	-93.4	114.6	159.8	-86.4	161.1	0	0	0	108.7	F16 L20	F16-L18 PolarHBondContact O-N 3.46Å; L18-L20 PolarHBondContact O-N 3.15Å
19	S	25.4	Very low	25.5	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	79%	0.786	S	S	*	*			trans	-74.5	112.1	172.3	156.7	0	0	0	0	110.8
20	L	25.9	Very low	25.6	Very low	173 Å²	173	146 Å²	146	91%	0.906	79%	0.788	S	S	*	*			trans	-145.7	121.5	156.1	-80.6	175.5	0	0	0	111.3	L18	L18-L20 PolarHBondContact O-N 3.15Å
21	G	22.7	Very low	25.8	Very low	74 Å²	74	148.6 Å²	148.6	76%	0.763	79%	0.793	S	S	*	*			trans	75.8	109.4	134.9	0	0	0	0	0	118.6
22	S	24.4	Very low	25.9	Very low	113 Å²	113	156.4 Å²	156.4	79%	0.79	81%	0.811	S	S	*	*			trans	-46.8	136.8	163	54.6	0	0	0	0	114.4
23	E	23.9	Very low	26.1	Very low	190 Å²	190	155.7 Å²	155.7	89%	0.888	81%	0.809	S	S	*	*				-169.5	135.1	124.6	-105.7	171.2	-163.6	0	0	111.8
24	S	24.1	Very low	26	Very low	100 Å²	100	154.8 Å²	154.8	70%	0.699	81%	0.811	S	S	*	*			trans	-77.8	132.7	-176.3	51.5	0	0	0	0	112.5
25	H	24.6	Very low	26	Very low	190 Å²	190	151.7 Å²	151.7	88%	0.88	82%	0.815	S	S	*	*			trans	-151.5	130.5	145.8	-87.7	-56.5	0	0	0	112
26	T	24.4	Very low	26.1	Very low	132 Å²	132	151.9 Å²	151.9	81%	0.81	82%	0.818	S	S	*	*			trans	-82.4	134	-175.8	39	0	0	0	0	112.1
27	L	23.6	Very low	25.9	Very low	174 Å²	174	155.7 Å²	155.7	91%	0.911	83%	0.828	S	S	*	*			trans	-150.6	94.5	156.8	-94	172.3	0	0	0	111.7
28	S	24.2	Very low	26.3	Very low	96 Å²	96	153.7 Å²	153.7	67%	0.671	82%	0.823	S	S	*	*			trans	32.6	115.4	132	-166.8	0	0	0	0	121.4
29	E	25.6	Very low	26.4	Very low	173 Å²	173	151.3 Å²	151.3	81%	0.808	82%	0.815	S	S	*	*			trans	41.5	111.8	135.6	-61.4	-171.8	155.1	0	0	120.6
30	R	25.9	Very low	26.8	Very low	235 Å²	235	150.5 Å²	150.5	89%	0.887	81%	0.809	S	S	*	*				171.7	112.3	120.7	-94.1	164.2	-165.5	-142.2	4.3	109.4
31	F	26.7	Very low	27.2	Very low	215 Å²	215	149.1 Å²	149.1	94%	0.943	80%	0.803	S	S	*	*			trans	170.5	97.1	142.3	-92.4	-68.7	0	0	0	106.6	S33	F31-S33 PolarHBondContact O-N 3.41Å
32	R	25.8	Very low	28.2	Very low	257 Å²	257	153.1 Å²	153.1	97%	0.97	80%	0.802	S	S	*	*			trans	-83.7	107.6	171	-77	-176.2	177.2	-178.8	-0.6	108.2
33	S	30.4	Very low	29.3	Very low	106 Å²	106	153.2 Å²	153.2	74%	0.741	80%	0.798	S	S	*	*			trans	-78.2	152.1	157.5	-81.2	0	0	0	0	109.7	F31 A35	F31-S33 PolarHBondContact O-N 3.41Å; S33-A35 PolarHBondContact O-N 2.94Å
34	P	28.3	Very low	30.9	Very low	121 Å²	121	148.4 Å²	148.4	79%	0.786	78%	0.782	S	S	*	*			trans	-64.9	123.6	-179.4	26.3	-30.9	0	0	0	109.5	I36	P34-I36 PolarHBondContact O-N 3.29Å; P34-I36 VanDerWaalsContact O-N 3.14Å
35	A	28.5	Very low	32.9	Very low	97 Å²	97	146.9 Å²	146.9	80%	0.802	76%	0.762	S	S	*	*			trans	-61.5	113.8	176.7	0	0	0	0	0	109.7	S33 R37	S33-A35 PolarHBondContact O-N 2.94Å; A35-R37 PolarHBondContact O-N 2.91Å
36	I	32.7	Very low	35.1	Very low	158 Å²	158	145.1 Å²	145.1	81%	0.81	75%	0.752	S	S	*	*			trans	-67.3	111.5	159.3	-63.7	174.7	0	0	0	105.4	P34 V38	P34-I36 PolarHBondContact O-N 3.29Å; P34-I36 VanDerWaalsContact O-N 3.14Å; I36-V38 VanDerWaalsContact C-N 3.33Å; I36-V38 HydrophobicContact CG2-CG2 4.48Å; I36-V38 PolarHBondContact O-N 2.85Å
37	R	25.9	Very low	37.2	Very low	228 Å²	228	141.9 Å²	141.9	86%	0.86	74%	0.739	S	S	*	*			trans	-76.9	87.8	179.7	-154.9	179.2	-170.8	-171.2	1.9	107.7	A35 V39	A35-R37 PolarHBondContact O-N 2.91Å; R37-V39 PolarHBondContact O-N 3.47Å; R37-V39 VanDerWaalsContact O-N 3.17Å
38	V	33.3	Very low	39.3	Very low	121 Å²	121	138.2 Å²	138.2	73%	0.733	73%	0.726	S	S	*	*			trans	-65.6	111.1	165.3	-178.1	0	0	0	0	106.4	I36 S40	I36-V38 VanDerWaalsContact C-N 3.33Å; I36-V38 HydrophobicContact CG2-CG2 4.48Å; I36-V38 PolarHBondContact O-N 2.85Å; V38-S40 PolarHBondContact O-N 2.77Å; V38-S40 VanDerWaalsContact O-N 3.16Å
39	V	28.8	Very low	42.3	Very low	119 Å²	119	137.8 Å²	137.8	72%	0.721	72%	0.716	S	S	*	*			trans	-74.8	101.6	171.1	179.3	0	0	0	0	106.1	R37 N41	R37-V39 PolarHBondContact O-N 3.47Å; R37-V39 VanDerWaalsContact O-N 3.17Å; V39-N41 PolarHBondContact O-N 2.86Å; V39-N41 VanDerWaalsContact O-N 3.08Å
40	S	33.5	Very low	45.4	Very low	88 Å²	88	130.2 Å²	130.2	62%	0.615	68%	0.681	S	S	*	*			trans	-70.6	98.9	172.7	50.6	0	0	0	0	109.2	V38 E42	V38-S40 PolarHBondContact O-N 2.77Å; V38-S40 VanDerWaalsContact O-N 3.16Å; S40-E42 PolarHBondContact O-N 2.6Å
41	N	34.9	Very low	48.6	Very low	144 Å²	144	120.7 Å²	120.7	77%	0.77	65%	0.653	S	S	*	*			trans	-87.6	71.3	163.2	-132.9	22	0	0	0	107.3	V39 T43	V39-N41 PolarHBondContact O-N 2.86Å; V39-N41 VanDerWaalsContact O-N 3.08Å; N41-T43 VanDerWaalsContact C-N 3.26Å; N41-T43 PolarHBondContact O-N 3.27Å
42	E	43.3	Very low	51.8	Low	158 Å²	158	113.6 Å²	113.6	74%	0.738	63%	0.634	S	S	*	*			trans	-78	75.9	175.1	-81.3	-174.5	175.8	0	0	110.3	S40	S40-E42 PolarHBondContact O-N 2.6Å
43	T	47.4	Very low	55.2	Low	115 Å²	115	102.1 Å²	102.1	71%	0.706	59%	0.591	S	S	*	*			trans	-91	81.3	152.5	34.8	0	0	0	0	108.5	N41 K45	N41-T43 VanDerWaalsContact C-N 3.26Å; N41-T43 PolarHBondContact O-N 3.27Å; T43-K45 PolarHBondContact O-N 2.75Å
44	T	58.1	Low	58.4	Low	90 Å²	90	97.1 Å²	97.1	55%	0.552	56%	0.556	S	S	*	*			trans	-68.2	111.9	171	41.2	0	0	0	0	109.1	A393	T44-A393 HydrophobicContact CG2-CB 4.43Å
45	K	64.9	Low	61.7	Low	67 Å²	67	93.2 Å²	93.2	29%	0.291	54%	0.538	S	S	.	.			trans	-56.2	138.4	171.7	-83.4	175.4	166.1	167.6	0	109.7	T43 V50 E53 E479 D480	T43-K45 PolarHBondContact O-N 2.75Å; K45-V50 HydrophobicContact CB-CG2 3.93Å; K45-E53 IonicContact NZ-OE1 3.76Å; K45-E53 IonicContact NZ-OE2 2.76Å; K45-E53 PolarHBondContact NZ-OE2 2.8Å; K45-E479 IonicContact NZ-OE2 2.86Å; K45-E479 PolarHBondContact NZ-OE2 3.08Å; K45-D480 WeakPolarHBondContact CE-OD2 3.48Å; K45-D480 IonicContact NZ-OD2 3.72Å; K45-D480 PolarHBondContact NZ-OD2 2.99Å
46	K	71	Confident	65	Low	153 Å²	153	95.5 Å²	95.5	67%	0.665	53%	0.526	S	S	*	.			trans	-72	151.8	177.8	-64.9	179.7	179.3	174.7	0	109.4	P48 D49 V50	K46-P48 VanDerWaalsContact C-CD 3.46Å; K46-P48 VanDerWaalsContact C-N 3.35Å; K46-D49 WeakPolarHBondContact O-CA 3.03Å; K46-D49 WeakPolarHBondContact O-CB 3.2Å; K46-D49 PolarHBondContact O-N 3.35Å; K46-V50 PolarHBondContact O-N 2.99Å; K46-V50 VanDerWaalsContact O-N 3.12Å
47	A	67.4	Low	68.1	Low	64 Å²	64	88.7 Å²	88.7	53%	0.529	49%	0.49	S	S	.	.	H	α-helix	trans	-53.1	-39.7	-178.7	0	0	0	0	0	114.9	D49 V50 A51	A47-D49 VanDerWaalsContact C-N 3.27Å; A47-D49 PolarHBondContact O-N 3.15Å; A47-V50 PolarHBondContact O-N 2.82Å; A47-A51 PolarHBondContact O-N 3.29Å
48	P	69.3	Low	71.6	Confident	98 Å²	98	82.6 Å²	82.6	64%	0.636	47%	0.471	S	S	*	.	H	α-helix	trans	-62.3	-32.1	173.9	-24	35.6	0	0	0	113.9	K46 A52	K46-P48 VanDerWaalsContact C-CD 3.46Å; K46-P48 VanDerWaalsContact C-N 3.35Å; P48-A52 WeakPolarHBondContact O-CB 3.5Å; P48-A52 PolarHBondContact O-N 2.86Å
49	D	87.2	Confident	74.7	Confident	87 Å²	87	82.3 Å²	82.3	47%	0.465	47%	0.466	S	S	.	.	H	α-helix	trans	-74.5	-38.2	179.3	-56	-30.4	0	0	0	110.5	K46 A47 A52 E53	K46-D49 WeakPolarHBondContact O-CA 3.03Å; K46-D49 WeakPolarHBondContact O-CB 3.2Å; K46-D49 PolarHBondContact O-N 3.35Å; A47-D49 VanDerWaalsContact C-N 3.27Å; A47-D49 PolarHBondContact O-N 3.15Å; D49-A52 PolarHBondContact O-N 2.93Å; D49-E53 WeakPolarHBondContact O-CB 3.33Å; D49-E53 PolarHBondContact O-N 2.92Å
50	V	89.7	Confident	78	Confident	13 Å²	13	77.9 Å²	77.9	8%	0.079	44%	0.438	C	S	.	.	H	α-helix	trans	-63.2	-49.4	175.5	173.6	0	0	0	0	111.3	K45 K46 A47 A52 E53 V54 V397 E400	K45-V50 HydrophobicContact CB-CG2 3.93Å; K46-V50 PolarHBondContact O-N 2.99Å; K46-V50 VanDerWaalsContact O-N 3.12Å; A47-V50 PolarHBondContact O-N 2.82Å; V50-A52 VanDerWaalsContact C-N 3.33Å; V50-A52 PolarHBondContact O-N 3.4Å; V50-E53 PolarHBondContact O-N 2.86Å; V50-V54 HydrophobicContact CG1-CG2 4.38Å; V50-V54 WeakPolarHBondContact O-CB 3.43Å; V50-V54 WeakPolarHBondContact O-CG2 3.3Å; V50-V54 PolarHBondContact O-N 2.85Å; V50-V397 HydrophobicContact CG1-CB 4.15Å; V50-V397 HydrophobicContact CG1-CG1 4.31Å; V50-V397 HydrophobicContact CG1-CG2 3.83Å; V50-V397 HydrophobicContact CG2-CG2 4.21Å; V50-E400 HydrophobicContact CG1-CG 4.13Å
51	A	92.9	Very high	81.1	Confident	35 Å²	35	73.7 Å²	73.7	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-62.7	-40.1	179.5	0	0	0	0	0	112	A47 G55 E400	A47-A51 PolarHBondContact O-N 3.29Å; A51-G55 PolarHBondContact O-N 3.03Å; A51-E400 HydrophobicContact CB-CG 4.14Å
52	A	95.3	Very high	84.1	Confident	67 Å²	67	70.2 Å²	70.2	55%	0.554	39%	0.387	S	S	*	.	H	α-helix	trans	-65.8	-42	176.1	0	0	0	0	0	112.2	P48 D49 V50 R56	P48-A52 WeakPolarHBondContact O-CB 3.5Å; P48-A52 PolarHBondContact O-N 2.86Å; D49-A52 PolarHBondContact O-N 2.93Å; V50-A52 VanDerWaalsContact C-N 3.33Å; V50-A52 PolarHBondContact O-N 3.4Å; A52-R56 WeakPolarHBondContact O-CG 3.44Å
53	E	96.8	Very high	86.8	Confident	15 Å²	15	67.9 Å²	67.9	7%	0.07	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-51.5	176.5	170.2	165	-155	0	0	111.8	K45 D49 V50 G55 R56 L478 E479	K45-E53 IonicContact NZ-OE1 3.76Å; K45-E53 IonicContact NZ-OE2 2.76Å; K45-E53 PolarHBondContact NZ-OE2 2.8Å; D49-E53 WeakPolarHBondContact O-CB 3.33Å; D49-E53 PolarHBondContact O-N 2.92Å; V50-E53 PolarHBondContact O-N 2.86Å; E53-G55 VanDerWaalsContact C-N 3.32Å; E53-G55 PolarHBondContact O-N 2.89Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 2.82Å; E53-R56 IonicContact OE1-NH2 3.23Å; E53-L478 HydrophobicContact CG-CD2 3.83Å; E53-E479 VanDerWaalsContact OE1-CB 3.31Å; E53-E479 WeakPolarHBondContact OE1-CB 3.37Å; E53-E479 VanDerWaalsContact OE1-CG 3.3Å; E53-E479 WeakPolarHBondContact OE1-CG 3.37Å; E53-E479 PolarHBondContact OE1-N 3.24Å
54	V	97.4	Very high	89.2	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-37.7	-179.1	174.6	0	0	0	0	111.3	V50 R56 Y57 E400 V401 L404 L478	V50-V54 HydrophobicContact CG1-CG2 4.38Å; V50-V54 WeakPolarHBondContact O-CB 3.43Å; V50-V54 WeakPolarHBondContact O-CG2 3.3Å; V50-V54 PolarHBondContact O-N 2.85Å; V54-R56 PolarHBondContact O-N 3.04Å; V54-R56 VanDerWaalsContact O-N 3.11Å; V54-Y57 WeakPolarHBondContact O-CB 3.07Å; V54-Y57 WeakPolarHBondContact O-CD2 2.79Å; V54-Y57 PolarHBondContact O-N 3.23Å; V54-E400 HydrophobicContact CB-CB 3.97Å; V54-E400 HydrophobicContact CG1-CB 3.94Å; V54-E400 HydrophobicContact CG2-CB 4.05Å; V54-V401 HydrophobicContact CG1-CG2 4.19Å; V54-V401 HydrophobicContact CG2-CG2 4.18Å; V54-L404 HydrophobicContact CG1-CD1 3.87Å; V54-L404 HydrophobicContact CG1-CD2 4.48Å; V54-L404 HydrophobicContact CG1-CG 4.18Å; V54-L478 HydrophobicContact CG2-CD2 4.14Å
55	G	97.3	Very high	91.2	Very high	38 Å²	38	58.3 Å²	58.3	39%	0.392	31%	0.313	S	S	.	.	H	α-helix	trans	-58.4	-24.3	177	0	0	0	0	0	114.1	A51 E53 Y57 E58	A51-G55 PolarHBondContact O-N 3.03Å; E53-G55 VanDerWaalsContact C-N 3.32Å; E53-G55 PolarHBondContact O-N 2.89Å; G55-Y57 PolarHBondContact O-N 3.48Å; G55-E58 WeakPolarHBondContact O-CB 3.38Å; G55-E58 PolarHBondContact O-N 2.98Å
56	R	97.4	Very high	92.8	Very high	145 Å²	145	60.5 Å²	60.5	55%	0.547	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.9	174.5	-61	-175.5	-65.8	-169.1	-0.3	113.3	A52 E53 V54 E479	A52-R56 WeakPolarHBondContact O-CG 3.44Å; E53-R56 WeakPolarHBondContact O-CB 3.49Å; E53-R56 PolarHBondContact O-N 2.82Å; E53-R56 IonicContact OE1-NH2 3.23Å; V54-R56 PolarHBondContact O-N 3.04Å; V54-R56 VanDerWaalsContact O-N 3.11Å; R56-E479 IonicContact CZ-OE1 2.83Å; R56-E479 IonicContact NH1-OE1 3.8Å; R56-E479 IonicContact NH2-OE1 3.64Å; R56-E479 PolarHBondContact NH2-OE1 3.49Å
57	Y	98.6	Very high	94.1	Very high	16 Å²	16	54.6 Å²	54.6	6%	0.063	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.9	179.6	-63	-78.9	0	0	0	113.8	V54 G55 D59 V60 A61 Y473 V474 D477 L478	V54-Y57 WeakPolarHBondContact O-CB 3.07Å; V54-Y57 WeakPolarHBondContact O-CD2 2.79Å; V54-Y57 PolarHBondContact O-N 3.23Å; G55-Y57 PolarHBondContact O-N 3.48Å; Y57-D59 VanDerWaalsContact C-N 3.34Å; Y57-D59 PolarHBondContact O-N 3.22Å; Y57-V60 PolarHBondContact O-N 2.99Å; Y57-V60 VanDerWaalsContact O-N 3.09Å; Y57-A61 WeakPolarHBondContact O-CB 2.96Å; Y57-A61 PolarHBondContact O-N 3.2Å; Y57-Y473 HydrophobicContact CD1-CE1 4.07Å; Y57-Y473 HydrophobicContact CE1-CE1 4.12Å; Y57-V474 HydrophobicContact CD1-CG2 4.36Å; Y57-V474 HydrophobicContact CD2-CG1 3.95Å; Y57-V474 HydrophobicContact CE2-CG1 4.42Å; Y57-V474 HydrophobicContact CG-CG1 4.17Å; Y57-V474 HydrophobicContact CG-CG2 4.04Å; Y57-D477 HydrophobicContact CE1-CB 3.86Å; Y57-D477 WeakPolarHBondContact CE1-OD2 2.99Å; Y57-D477 PolarHBondContact OH-O 3.05Å; Y57-L478 HydrophobicContact CE2-CD2 4.19Å
58	E	98.4	Very high	95.6	Very high	100 Å²	100	51.6 Å²	51.6	47%	0.467	28%	0.275	S	S	.	.	H	α-helix	trans	-54.8	-46.8	-178.3	-169.5	-177.2	164.5	0	0	112.7	G55 V60 A61 K62 L404	G55-E58 WeakPolarHBondContact O-CB 3.38Å; G55-E58 PolarHBondContact O-N 2.98Å; E58-V60 PolarHBondContact O-N 3.37Å; E58-A61 PolarHBondContact O-N 3.47Å; E58-K62 HydrophobicContact CG-CD 4.46Å; E58-K62 WeakPolarHBondContact O-CB 3.3Å; E58-K62 VanDerWaalsContact O-CG 3.32Å; E58-K62 WeakPolarHBondContact O-CG 3.42Å; E58-K62 PolarHBondContact O-N 2.86Å; E58-K62 WeakPolarHBondContact OE1-CE 3.45Å; E58-K62 IonicContact OE1-NZ 3.82Å; E58-K62 PolarHBondContact OE1-NZ 2.62Å; E58-L404 HydrophobicContact CB-CD2 4.32Å
59	D	98.4	Very high	97	Very high	115 Å²	115	47 Å²	47	62%	0.615	25%	0.245	S	C	*	.	H	α-helix	trans	-68.9	-34.2	178.7	-69.8	-21	0	0	0	112.4	Y57 R63	Y57-D59 VanDerWaalsContact C-N 3.34Å; Y57-D59 PolarHBondContact O-N 3.22Å; D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.15Å; D59-R63 PolarHBondContact O-N 3.37Å
60	V	98.7	Very high	97.5	Very high	25 Å²	25	49.6 Å²	49.6	15%	0.152	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-45.9	176.9	176.2	0	0	0	0	110.4	Y57 E58 K62 R63 I64 L335 Y473	Y57-V60 PolarHBondContact O-N 2.99Å; Y57-V60 VanDerWaalsContact O-N 3.09Å; E58-V60 PolarHBondContact O-N 3.37Å; V60-K62 VanDerWaalsContact C-N 3.35Å; V60-K62 PolarHBondContact O-N 3.15Å; V60-R63 PolarHBondContact O-N 3.35Å; V60-I64 HydrophobicContact CG1-CD1 3.97Å; V60-I64 WeakPolarHBondContact O-CG1 3.47Å; V60-I64 PolarHBondContact O-N 3.37Å; V60-L335 HydrophobicContact CG1-CD1 3.68Å; V60-L335 HydrophobicContact CG1-CD2 4.34Å; V60-Y473 HydrophobicContact CG1-CD1 3.83Å; V60-Y473 HydrophobicContact CG1-CE1 3.61Å
61	A	98.8	Very high	97.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-44.5	177	0	0	0	0	0	111.4	Y57 E58 R63 I64 I65 L404 V470	Y57-A61 WeakPolarHBondContact O-CB 2.96Å; Y57-A61 PolarHBondContact O-N 3.2Å; E58-A61 PolarHBondContact O-N 3.47Å; A61-R63 PolarHBondContact O-N 3.09Å; A61-I64 PolarHBondContact O-N 3.08Å; A61-I65 WeakPolarHBondContact O-CB 3.36Å; A61-I65 VanDerWaalsContact O-CG1 3.29Å; A61-I65 WeakPolarHBondContact O-CG1 3.2Å; A61-I65 PolarHBondContact O-N 3.47Å; A61-L404 HydrophobicContact CB-CB 3.83Å; A61-L404 HydrophobicContact CB-CD1 4.3Å; A61-V470 HydrophobicContact CB-CG1 3.84Å; A61-V470 HydrophobicContact CB-CG2 4.1Å
62	K	98.7	Very high	98.1	Very high	70 Å²	70	53.5 Å²	53.5	30%	0.304	29%	0.289	S	S	.	.	H	α-helix	trans	-57.6	-45.7	173.6	-75.5	172.6	-173.7	161.8	0	112	E58 V60 I64 I65 E66	E58-K62 HydrophobicContact CG-CD 4.46Å; E58-K62 WeakPolarHBondContact O-CB 3.3Å; E58-K62 VanDerWaalsContact O-CG 3.32Å; E58-K62 WeakPolarHBondContact O-CG 3.42Å; E58-K62 PolarHBondContact O-N 2.86Å; E58-K62 WeakPolarHBondContact OE1-CE 3.45Å; E58-K62 IonicContact OE1-NZ 3.82Å; E58-K62 PolarHBondContact OE1-NZ 2.62Å; V60-K62 VanDerWaalsContact C-N 3.35Å; V60-K62 PolarHBondContact O-N 3.15Å; K62-I64 PolarHBondContact O-N 3.41Å; K62-I65 PolarHBondContact O-N 3.35Å; K62-E66 VanDerWaalsContact O-CB 3.28Å; K62-E66 WeakPolarHBondContact O-CB 3.35Å; K62-E66 VanDerWaalsContact O-CG 3.25Å; K62-E66 WeakPolarHBondContact O-CG 3.5Å; K62-E66 PolarHBondContact O-N 3.33Å
63	R	98.8	Very high	98.3	Very high	109 Å²	109	50.3 Å²	50.3	41%	0.411	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-38.8	178.2	-74	172.6	64	-152.1	-5.7	113	D59 V60 A61 L67 L333	D59-R63 VanDerWaalsContact O-CG 3.26Å; D59-R63 WeakPolarHBondContact O-CG 3.15Å; D59-R63 PolarHBondContact O-N 3.37Å; V60-R63 PolarHBondContact O-N 3.35Å; A61-R63 PolarHBondContact O-N 3.09Å; R63-L67 WeakPolarHBondContact O-CB 3.48Å; R63-L67 PolarHBondContact O-N 2.88Å; R63-L333 HydrophobicContact CB-CD1 4.3Å; R63-L333 HydrophobicContact CB-CD2 4.41Å; R63-L333 PolarHBondContact NH2-O 2.94Å
64	I	98.9	Very high	98.3	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-50.4	175.2	-67.5	164.3	0	0	0	110	V60 A61 K62 E66 L67 A68 I330 L333 L335 A469 V470 Y473	V60-I64 HydrophobicContact CG1-CD1 3.97Å; V60-I64 WeakPolarHBondContact O-CG1 3.47Å; V60-I64 PolarHBondContact O-N 3.37Å; A61-I64 PolarHBondContact O-N 3.08Å; K62-I64 PolarHBondContact O-N 3.41Å; I64-E66 PolarHBondContact O-N 3.03Å; I64-L67 PolarHBondContact O-N 3.21Å; I64-A68 WeakPolarHBondContact O-CB 3.43Å; I64-A68 PolarHBondContact O-N 3.38Å; I64-I330 HydrophobicContact CD1-CD1 3.46Å; I64-I330 VanDerWaalsContact CD1-CD1 3.46Å; I64-I330 HydrophobicContact CG1-CD1 3.94Å; I64-L333 HydrophobicContact CB-CD1 4.29Å; I64-L333 HydrophobicContact CG1-CD1 3.56Å; I64-L335 HydrophobicContact CD1-CD1 4.27Å; I64-L335 HydrophobicContact CG1-CD1 4.26Å; I64-A469 HydrophobicContact CG2-CB 3.6Å; I64-V470 HydrophobicContact CB-CG2 3.91Å; I64-V470 HydrophobicContact CD1-CG2 4.21Å; I64-V470 HydrophobicContact CG2-CG2 3.74Å; I64-Y473 HydrophobicContact CD1-CG 4.43Å
65	I	98.9	Very high	98.4	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-47.2	178.1	-69.6	166.6	0	0	0	110.9	A61 K62 L67 A68 V69 F70 L405 P407 I408 A466 V470	A61-I65 WeakPolarHBondContact O-CB 3.36Å; A61-I65 VanDerWaalsContact O-CG1 3.29Å; A61-I65 WeakPolarHBondContact O-CG1 3.2Å; A61-I65 PolarHBondContact O-N 3.47Å; K62-I65 PolarHBondContact O-N 3.35Å; I65-L67 PolarHBondContact O-N 2.98Å; I65-A68 PolarHBondContact O-N 3.36Å; I65-V69 HydrophobicContact CG2-CG2 4.32Å; I65-V69 WeakPolarHBondContact O-CB 3.4Å; I65-V69 WeakPolarHBondContact O-CG2 3.49Å; I65-V69 PolarHBondContact O-N 3.01Å; I65-F70 HydrophobicContact CG2-CE2 4.5Å; I65-L405 HydrophobicContact CD1-CD2 4.44Å; I65-P407 HydrophobicContact CD1-CB 4.27Å; I65-P407 HydrophobicContact CD1-CG 4.24Å; I65-I408 HydrophobicContact CG2-CG2 3.51Å; I65-A466 HydrophobicContact CG1-CB 4.22Å; I65-V470 HydrophobicContact CD1-CG2 4.48Å; I65-V470 HydrophobicContact CG1-CG2 4.11Å
66	E	98.8	Very high	98.5	Very high	113 Å²	113	56 Å²	56	53%	0.528	28%	0.279	S	S	.	.	I	π-helix	trans	-59.4	-46.3	178.5	-78.5	174.3	-176.6	0	0	111.4	K62 I64 F70 G71	K62-E66 VanDerWaalsContact O-CB 3.28Å; K62-E66 WeakPolarHBondContact O-CB 3.35Å; K62-E66 VanDerWaalsContact O-CG 3.25Å; K62-E66 WeakPolarHBondContact O-CG 3.5Å; K62-E66 PolarHBondContact O-N 3.33Å; I64-E66 PolarHBondContact O-N 3.03Å; E66-F70 CarbonylContact O-C 3.53Å; E66-F70 WeakPolarHBondContact O-CA 3.19Å; E66-F70 PolarHBondContact O-N 2.97Å; E66-G71 WeakPolarHBondContact O-CA 3.44Å; E66-G71 PolarHBondContact O-N 3.48Å
67	L	98.9	Very high	98.5	Very high	29 Å²	29	49 Å²	49	15%	0.152	25%	0.253	C	S	.	.	I	π-helix	trans	-62.3	-46.1	179.1	178.6	60	0	0	0	111.9	R63 I64 I65 G71 A72 A73 L329 D332 L333	R63-L67 WeakPolarHBondContact O-CB 3.48Å; R63-L67 PolarHBondContact O-N 2.88Å; I64-L67 PolarHBondContact O-N 3.21Å; I65-L67 PolarHBondContact O-N 2.98Å; L67-G71 CarbonylContact O-C 3.51Å; L67-G71 WeakPolarHBondContact O-CA 3.43Å; L67-G71 PolarHBondContact O-N 2.92Å; L67-A72 HydrophobicContact CD1-CB 4.33Å; L67-A73 HydrophobicContact CD1-CB 4.11Å; L67-A73 HydrophobicContact CG-CB 3.95Å; L67-A73 WeakPolarHBondContact O-CB 3.28Å; L67-A73 PolarHBondContact O-N 2.91Å; L67-L329 HydrophobicContact CB-CD2 4.37Å; L67-L329 HydrophobicContact CD2-CD2 3.78Å; L67-L329 HydrophobicContact CG-CD2 3.76Å; L67-D332 HydrophobicContact CD2-CB 3.84Å; L67-L333 HydrophobicContact CB-CD2 4.43Å; L67-L333 HydrophobicContact CD2-CD1 4.28Å; L67-L333 HydrophobicContact CD2-CD2 3.88Å; L67-L333 HydrophobicContact CD2-CG 3.72Å
68	A	98.8	Very high	98.5	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.008	26%	0.26	C	S	.	.	I	π-helix	trans	-71.8	-46.6	-175.6	0	0	0	0	0	112.9	I64 I65 Q74 L329 A466	I64-A68 WeakPolarHBondContact O-CB 3.43Å; I64-A68 PolarHBondContact O-N 3.38Å; I65-A68 PolarHBondContact O-N 3.36Å; A68-Q74 VanDerWaalsContact O-CA 3.29Å; A68-Q74 WeakPolarHBondContact O-CA 3.2Å; A68-Q74 PolarHBondContact O-N 3.35Å; A68-L329 HydrophobicContact CB-CD1 3.75Å; A68-L329 HydrophobicContact CB-CD2 3.97Å; A68-A466 HydrophobicContact CB-CB 3.92Å
69	V	98.6	Very high	98.6	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	26%	0.262	C	S	.	.	I	π-helix	trans	-96.6	-30.6	-168	-174.1	0	0	0	0	112.6	I65 Q74 I408 D462 L463 A466	I65-V69 HydrophobicContact CG2-CG2 4.32Å; I65-V69 WeakPolarHBondContact O-CB 3.4Å; I65-V69 WeakPolarHBondContact O-CG2 3.49Å; I65-V69 PolarHBondContact O-N 3.01Å; V69-Q74 WeakPolarHBondContact O-CG 3.36Å; V69-Q74 PolarHBondContact O-NE2 3.08Å; V69-I408 HydrophobicContact CG2-CG2 4.35Å; V69-D462 HydrophobicContact CG2-CB 4.47Å; V69-L463 HydrophobicContact CG1-CD2 4.13Å; V69-L463 HydrophobicContact CG2-CD2 4.08Å; V69-A466 HydrophobicContact CG2-CB 3.95Å
70	F	97.1	Very high	98.6	Very high	143 Å²	143	48.4 Å²	48.4	63%	0.627	24%	0.238	S	C	*	.	I	π-helix	trans	-126.6	-7.4	-172.1	-52.8	-66.2	0	0	0	113.7	I65 E66	I65-F70 HydrophobicContact CG2-CE2 4.5Å; E66-F70 CarbonylContact O-C 3.53Å; E66-F70 WeakPolarHBondContact O-CA 3.19Å; E66-F70 PolarHBondContact O-N 2.97Å
71	G	97.7	Very high	98.6	Very high	32 Å²	32	47.2 Å²	47.2	33%	0.33	23%	0.23	S	C	.	.	S	Bend	trans	-107.7	-158.5	-167.7	0	0	0	0	0	113.3	E66 L67 A73 Q74	E66-G71 WeakPolarHBondContact O-CA 3.44Å; E66-G71 PolarHBondContact O-N 3.48Å; L67-G71 CarbonylContact O-C 3.51Å; L67-G71 WeakPolarHBondContact O-CA 3.43Å; L67-G71 PolarHBondContact O-N 2.92Å; G71-A73 PolarHBondContact O-N 3.26Å; G71-Q74 WeakPolarHBondContact O-CB 3.47Å; G71-Q74 PolarHBondContact O-N 3.2Å
72	A	97.9	Very high	98.6	Very high	97 Å²	97	47.9 Å²	47.9	80%	0.802	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18	-176.2	0	0	0	0	0	114	L67	L67-A72 HydrophobicContact CD1-CB 4.33Å
73	A	98.6	Very high	98.5	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	1.2	177.8	0	0	0	0	0	113.4	L67 G71 N75 R76 L329	L67-A73 HydrophobicContact CD1-CB 4.11Å; L67-A73 HydrophobicContact CG-CB 3.95Å; L67-A73 WeakPolarHBondContact O-CB 3.28Å; L67-A73 PolarHBondContact O-N 2.91Å; G71-A73 PolarHBondContact O-N 3.26Å; A73-N75 PolarHBondContact O-N 3.38Å; A73-R76 WeakPolarHBondContact O-CB 3.35Å; A73-R76 PolarHBondContact O-N 3.38Å; A73-L329 HydrophobicContact CB-CD2 3.53Å
74	Q	98.7	Very high	98.5	Very high	80 Å²	80	44 Å²	44	37%	0.374	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	134.2	176.8	-165.9	-173.9	51.6	0	0	111.8	A68 V69 G71 R76 R79 D462	A68-Q74 VanDerWaalsContact O-CA 3.29Å; A68-Q74 WeakPolarHBondContact O-CA 3.2Å; A68-Q74 PolarHBondContact O-N 3.35Å; V69-Q74 WeakPolarHBondContact O-CG 3.36Å; V69-Q74 PolarHBondContact O-NE2 3.08Å; G71-Q74 WeakPolarHBondContact O-CB 3.47Å; G71-Q74 PolarHBondContact O-N 3.2Å; Q74-R76 PolarHBondContact O-N 2.89Å; Q74-R76 VanDerWaalsContact O-N 3.13Å; Q74-R79 PolarHBondContact O-NH2 2.83Å; Q74-R79 VanDerWaalsContact O-NH2 3.08Å; Q74-D462 WeakPolarHBondContact CG-OD2 3.4Å
75	N	98.7	Very high	98.5	Very high	51 Å²	51	44 Å²	44	27%	0.273	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	18.5	-175	-50.7	-57	0	0	0	114.2	A73 R79 P458 D462	A73-N75 PolarHBondContact O-N 3.38Å; N75-R79 WeakPolarHBondContact O-CB 3.23Å; N75-R79 VanDerWaalsContact O-CG 3.31Å; N75-R79 WeakPolarHBondContact O-CG 3.49Å; N75-R79 PolarHBondContact O-N 3.28Å; N75-R79 VanDerWaalsContact O-N 3.09Å; N75-R79 PolarHBondContact O-NE 2.86Å; N75-R79 VanDerWaalsContact O-NE 3.1Å; N75-P458 HydrophobicContact CB-CB 4.28Å; N75-P458 WeakPolarHBondContact OD1-CB 3.47Å; N75-D462 VanDerWaalsContact CA-OD1 3.29Å; N75-D462 WeakPolarHBondContact CA-OD1 3.31Å; N75-D462 VanDerWaalsContact N-CG 3.25Å; N75-D462 PolarHBondContact N-OD1 2.92Å; N75-D462 PolarHBondContact N-OD2 2.91Å; N75-D462 PolarHBondContact OD1-OD2 3.29Å
76	R	98.7	Very high	98.5	Very high	42 Å²	42	49.3 Å²	49.3	16%	0.158	26%	0.255	C	S	.	.	H	α-helix	trans	-71.9	-44.9	-176.8	-177.1	170.2	66.1	-177.2	-7.2	111.4	A73 Q74 R79 R80 E325 D332	A73-R76 WeakPolarHBondContact O-CB 3.35Å; A73-R76 PolarHBondContact O-N 3.38Å; Q74-R76 PolarHBondContact O-N 2.89Å; Q74-R76 VanDerWaalsContact O-N 3.13Å; R76-R79 PolarHBondContact O-N 3.1Å; R76-R80 HydrophobicContact CG-CG 4.4Å; R76-R80 WeakPolarHBondContact O-CB 3.24Å; R76-R80 VanDerWaalsContact O-CG 3.25Å; R76-R80 WeakPolarHBondContact O-CG 3.47Å; R76-R80 PolarHBondContact O-N 3.42Å; R76-E325 IonicContact CZ-OE1 3.19Å; R76-E325 IonicContact CZ-OE2 3.73Å; R76-E325 VanDerWaalsContact NE-CD 3.31Å; R76-E325 IonicContact NE-OE1 3.81Å; R76-E325 PolarHBondContact NE-OE1 3.26Å; R76-E325 IonicContact NE-OE2 2.94Å; R76-E325 PolarHBondContact NE-OE2 3.32Å; R76-E325 IonicContact NH2-OE1 3.78Å; R76-E325 PolarHBondContact NH2-OE1 2.65Å; R76-E325 IonicContact NH2-OE2 3.25Å; R76-D332 IonicContact CZ-OD2 2.67Å; R76-D332 IonicContact NH1-OD2 2.85Å; R76-D332 PolarHBondContact NH1-OD2 2.9Å; R76-D332 IonicContact NH2-OD2 3.6Å; R76-D332 PolarHBondContact NH2-OD2 3.19Å
77	S	98.4	Very high	98.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-43.4	176.8	52.7	0	0	0	0	111.7	R80 L81 S465	S77-R80 WeakPolarHBondContact O-CB 3.25Å; S77-R80 PolarHBondContact O-N 3.09Å; S77-L81 WeakPolarHBondContact O-CB 3.38Å; S77-L81 PolarHBondContact O-N 3.31Å; S77-S465 PolarHBondContact OG-OG 2.92Å
78	Y	98.8	Very high	98.4	Very high	55 Å²	55	48 Å²	48	22%	0.216	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-47.8	174.5	-177.9	-86.4	0	0	0	112.7	R80 L81 A82 M453 Q456 P458 M461	Y78-R80 VanDerWaalsContact C-N 3.35Å; Y78-R80 PolarHBondContact O-N 3Å; Y78-L81 PolarHBondContact O-N 2.86Å; Y78-A82 WeakPolarHBondContact O-CB 3.34Å; Y78-A82 PolarHBondContact O-N 3.34Å; Y78-M453 HydrophobicContact CD1-CE 4.17Å; Y78-M453 HydrophobicContact CD2-CE 3.73Å; Y78-M453 HydrophobicContact CE1-CE 3.78Å; Y78-M453 HydrophobicContact CE2-CE 3.3Å; Y78-M453 HydrophobicContact CG-CE 4.15Å; Y78-Q456 HydrophobicContact CD2-CB 4.14Å; Y78-Q456 HydrophobicContact CE2-CB 3.76Å; Y78-P458 HydrophobicContact CD1-CB 4.18Å; Y78-P458 HydrophobicContact CD1-CG 3.82Å; Y78-P458 HydrophobicContact CD2-CB 3.94Å; Y78-P458 HydrophobicContact CD2-CG 3.63Å; Y78-P458 HydrophobicContact CE1-CG 3.89Å; Y78-P458 HydrophobicContact CE2-CB 4.49Å; Y78-P458 HydrophobicContact CE2-CG 3.68Å; Y78-P458 HydrophobicContact CG-CB 3.76Å; Y78-P458 HydrophobicContact CG-CG 3.7Å; Y78-M461 HydrophobicContact CD2-SD 3.82Å; Y78-M461 HydrophobicContact CG-SD 4.34Å
79	R	98.8	Very high	98.4	Very high	135 Å²	135	48.8 Å²	48.8	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.9	-75.7	-179.5	-71.5	165.3	-5.3	112	Q74 N75 R76 L81 A82 D83	Q74-R79 PolarHBondContact O-NH2 2.83Å; Q74-R79 VanDerWaalsContact O-NH2 3.08Å; N75-R79 WeakPolarHBondContact O-CB 3.23Å; N75-R79 VanDerWaalsContact O-CG 3.31Å; N75-R79 WeakPolarHBondContact O-CG 3.49Å; N75-R79 PolarHBondContact O-N 3.28Å; N75-R79 VanDerWaalsContact O-N 3.09Å; N75-R79 PolarHBondContact O-NE 2.86Å; N75-R79 VanDerWaalsContact O-NE 3.1Å; R76-R79 PolarHBondContact O-N 3.1Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 3.18Å; R79-A82 PolarHBondContact O-N 3.18Å; R79-D83 WeakPolarHBondContact O-CB 3.07Å; R79-D83 VanDerWaalsContact O-CG 3.31Å; R79-D83 PolarHBondContact O-N 2.7Å
80	R	98.5	Very high	98.3	Very high	27 Å²	27	50.9 Å²	50.9	10%	0.102	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-43.9	174.5	-77.3	168.5	170.4	-167.6	-14.6	111.6	R76 S77 Y78 F84 D112 M321 W324 E325 S328	R76-R80 HydrophobicContact CG-CG 4.4Å; R76-R80 WeakPolarHBondContact O-CB 3.24Å; R76-R80 VanDerWaalsContact O-CG 3.25Å; R76-R80 WeakPolarHBondContact O-CG 3.47Å; R76-R80 PolarHBondContact O-N 3.42Å; S77-R80 WeakPolarHBondContact O-CB 3.25Å; S77-R80 PolarHBondContact O-N 3.09Å; Y78-R80 VanDerWaalsContact C-N 3.35Å; Y78-R80 PolarHBondContact O-N 3Å; R80-F84 WeakPolarHBondContact O-CB 3.46Å; R80-F84 PolarHBondContact O-N 2.68Å; R80-D112 IonicContact CZ-OD2 2.92Å; R80-D112 IonicContact NH1-OD2 3.33Å; R80-D112 VanDerWaalsContact NH2-CG 3.3Å; R80-D112 IonicContact NH2-OD1 2.71Å; R80-D112 PolarHBondContact NH2-OD1 3.39Å; R80-D112 IonicContact NH2-OD2 3.99Å; R80-D112 PolarHBondContact NH2-OD2 3.45Å; R80-M321 HydrophobicContact CB-CG 4.46Å; R80-W324 HydrophobicContact CB-CE3 4.44Å; R80-W324 HydrophobicContact CB-CH2 4.48Å; R80-W324 HydrophobicContact CB-CZ3 3.83Å; R80-W324 VanDerWaalsContact CD-CZ3 3.47Å; R80-W324 HydrophobicContact CG-CE3 4.44Å; R80-W324 HydrophobicContact CG-CH2 3.86Å; R80-W324 HydrophobicContact CG-CZ3 3.68Å; R80-W324 VanDerWaalsContact CZ-CZ2 3.44Å; R80-E325 IonicContact CZ-OE2 3.64Å; R80-E325 IonicContact NE-OE2 3.2Å; R80-E325 IonicContact NH1-OE2 3.52Å; R80-E325 PolarHBondContact NH1-OE2 2.88Å; R80-S328 PolarHBondContact NH1-OG 3.3Å
81	L	98.8	Very high	98.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-45.6	175.8	-178.9	58.7	0	0	0	111.6	S77 Y78 R79 F84 T85 A313 G317 M321 M453 Q456 M461	S77-L81 WeakPolarHBondContact O-CB 3.38Å; S77-L81 PolarHBondContact O-N 3.31Å; Y78-L81 PolarHBondContact O-N 2.86Å; R79-L81 VanDerWaalsContact C-N 3.33Å; R79-L81 PolarHBondContact O-N 3.18Å; L81-F84 PolarHBondContact O-N 2.86Å; L81-T85 HydrophobicContact CD1-CG2 3.81Å; L81-T85 HydrophobicContact CG-CG2 4.41Å; L81-T85 WeakPolarHBondContact O-CB 3.16Å; L81-T85 WeakPolarHBondContact O-CG2 3.44Å; L81-T85 PolarHBondContact O-N 2.92Å; L81-T85 PolarHBondContact O-OG1 3.21Å; L81-A313 WeakPolarHBondContact CD2-O 3.34Å; L81-G317 WeakPolarHBondContact CD1-O 3.48Å; L81-M321 HydrophobicContact CB-CB 4.44Å; L81-M321 HydrophobicContact CB-CE 4.48Å; L81-M321 HydrophobicContact CB-CG 3.89Å; L81-M321 HydrophobicContact CD1-CE 3.64Å; L81-M321 HydrophobicContact CD1-CG 4.2Å; L81-M321 HydrophobicContact CD1-SD 4.32Å; L81-M453 HydrophobicContact CB-CE 4.49Å; L81-M453 HydrophobicContact CB-SD 4.19Å; L81-M453 HydrophobicContact CD2-CE 4.28Å; L81-M453 HydrophobicContact CD2-SD 3.8Å; L81-M453 HydrophobicContact CG-CE 4.3Å; L81-M453 HydrophobicContact CG-SD 3.52Å; L81-M453 VanDerWaalsContact CG-SD 3.52Å; L81-Q456 HydrophobicContact CD2-CG 3.88Å; L81-M461 HydrophobicContact CB-CE 4.23Å; L81-M461 HydrophobicContact CD2-CE 3.74Å; L81-M461 HydrophobicContact CD2-SD 3.83Å
82	A	98.7	Very high	98.4	Very high	16 Å²	16	43.3 Å²	43.3	13%	0.132	23%	0.234	C	C	.	.	H	α-helix	trans	-59.7	-53	177.5	0	0	0	0	0	111.3	Y78 R79 F84 T85 D86 M453	Y78-A82 WeakPolarHBondContact O-CB 3.34Å; Y78-A82 PolarHBondContact O-N 3.34Å; R79-A82 PolarHBondContact O-N 3.18Å; A82-F84 VanDerWaalsContact C-N 3.27Å; A82-F84 PolarHBondContact O-N 2.74Å; A82-T85 PolarHBondContact O-N 3.15Å; A82-T85 PolarHBondContact O-OG1 3.44Å; A82-D86 VanDerWaalsContact O-CB 3.26Å; A82-D86 WeakPolarHBondContact O-CB 3.41Å; A82-D86 PolarHBondContact O-N 2.71Å; A82-M453 HydrophobicContact CB-CE 3.84Å; A82-M453 HydrophobicContact CB-CG 4.26Å; A82-M453 HydrophobicContact CB-SD 4.19Å
83	D	98.5	Very high	98.4	Very high	96 Å²	96	38.8 Å²	38.8	51%	0.513	20%	0.196	S	C	.	.	H	α-helix	trans	-59.1	-41.1	179.2	-70.8	-21	0	0	0	111.3	R79 T87	R79-D83 WeakPolarHBondContact O-CB 3.07Å; R79-D83 VanDerWaalsContact O-CG 3.31Å; R79-D83 PolarHBondContact O-N 2.7Å; D83-T87 WeakPolarHBondContact O-CB 3.32Å; D83-T87 PolarHBondContact O-N 2.67Å; D83-T87 VanDerWaalsContact O-N 3.1Å; D83-T87 PolarHBondContact O-OG1 2.77Å
84	F	98.7	Very high	98.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-52.1	177.6	173.7	-99.3	0	0	0	112.4	R80 L81 A82 T87 I88 A101 Y104 M105 L304 M321	R80-F84 WeakPolarHBondContact O-CB 3.46Å; R80-F84 PolarHBondContact O-N 2.68Å; L81-F84 PolarHBondContact O-N 2.86Å; A82-F84 VanDerWaalsContact C-N 3.27Å; A82-F84 PolarHBondContact O-N 2.74Å; F84-T87 PolarHBondContact O-N 3.19Å; F84-I88 HydrophobicContact CD2-CG1 4.19Å; F84-I88 HydrophobicContact CE2-CG1 4.14Å; F84-I88 WeakPolarHBondContact O-CB 3.29Å; F84-I88 WeakPolarHBondContact O-CG1 3.32Å; F84-I88 PolarHBondContact O-N 3.14Å; F84-A101 HydrophobicContact CE2-CB 3.68Å; F84-A101 HydrophobicContact CZ-CB 3.53Å; F84-Y104 HydrophobicContact CB-CE1 4.13Å; F84-Y104 AromaticContact CD2-CD1 3.5Å; F84-Y104 HydrophobicContact CD2-CD1 3.5Å; F84-Y104 VanDerWaalsContact CD2-CD1 3.5Å; F84-Y104 AromaticContact CD2-CE1 3.76Å; F84-Y104 HydrophobicContact CD2-CE1 3.76Å; F84-Y104 HydrophobicContact CD2-CG 4.07Å; F84-Y104 HydrophobicContact CE2-CD1 4.11Å; F84-Y104 HydrophobicContact CG-CE1 4.44Å; F84-M105 HydrophobicContact CD2-SD 4.08Å; F84-M105 HydrophobicContact CE2-CG 4Å; F84-M105 HydrophobicContact CE2-SD 4.1Å; F84-L304 HydrophobicContact CE1-CD1 4.31Å; F84-L304 HydrophobicContact CE2-CD1 4.17Å; F84-L304 HydrophobicContact CZ-CD1 3.56Å; F84-M321 HydrophobicContact CB-CE 3.46Å; F84-M321 VanDerWaalsContact CB-CE 3.46Å; F84-M321 HydrophobicContact CD1-CE 3.13Å; F84-M321 HydrophobicContact CD2-CE 4.09Å; F84-M321 HydrophobicContact CE1-CE 3.79Å; F84-M321 HydrophobicContact CG-CE 3.29Å; F84-M321 HydrophobicContact CZ-CE 4.48Å
85	T	98.4	Very high	98.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-68.5	-36.1	-177.2	49.4	0	0	0	0	112.4	L81 A82 T87 G89 Q311 A313 M453	L81-T85 HydrophobicContact CD1-CG2 3.81Å; L81-T85 HydrophobicContact CG-CG2 4.41Å; L81-T85 WeakPolarHBondContact O-CB 3.16Å; L81-T85 WeakPolarHBondContact O-CG2 3.44Å; L81-T85 PolarHBondContact O-N 2.92Å; L81-T85 PolarHBondContact O-OG1 3.21Å; A82-T85 PolarHBondContact O-N 3.15Å; A82-T85 PolarHBondContact O-OG1 3.44Å; T85-T87 VanDerWaalsContact C-N 3.32Å; T85-G89 VanDerWaalsContact O-CA 3.25Å; T85-G89 WeakPolarHBondContact O-CA 3.05Å; T85-G89 PolarHBondContact O-N 3.05Å; T85-Q311 HydrophobicContact CG2-CB 4.23Å; T85-A313 HydrophobicContact CG2-CB 4.26Å; T85-M453 WeakPolarHBondContact OG1-CG 3.18Å
86	D	97.8	Very high	98.2	Very high	116 Å²	116	41.5 Å²	41.5	62%	0.62	22%	0.215	S	C	*	.	H	α-helix	trans	-71.2	-29	175.4	-73.1	-14.5	0	0	0	112.3	A82 Q311	A82-D86 VanDerWaalsContact O-CB 3.26Å; A82-D86 WeakPolarHBondContact O-CB 3.41Å; A82-D86 PolarHBondContact O-N 2.71Å; D86-Q311 PolarHBondContact OD1-NE2 2.98Å
87	T	98.1	Very high	98.2	Very high	97 Å²	97	41.8 Å²	41.8	60%	0.595	22%	0.219	S	C	*	.	H	α-helix	trans	-80.4	-41.7	178	-61.5	0	0	0	0	112.4	D83 F84 T85	D83-T87 WeakPolarHBondContact O-CB 3.32Å; D83-T87 PolarHBondContact O-N 2.67Å; D83-T87 VanDerWaalsContact O-N 3.1Å; D83-T87 PolarHBondContact O-OG1 2.77Å; F84-T87 PolarHBondContact O-N 3.19Å; T85-T87 VanDerWaalsContact C-N 3.32Å
88	I	98.4	Very high	98.2	Very high	17 Å²	17	41.8 Å²	41.8	9%	0.087	22%	0.219	C	C	.	.	H	α-helix	trans	-103.9	-39.6	-169.6	-55.3	-62.9	0	0	0	112.4	F84 N97 M100 A101	F84-I88 HydrophobicContact CD2-CG1 4.19Å; F84-I88 HydrophobicContact CE2-CG1 4.14Å; F84-I88 WeakPolarHBondContact O-CB 3.29Å; F84-I88 WeakPolarHBondContact O-CG1 3.32Å; F84-I88 PolarHBondContact O-N 3.14Å; I88-N97 HydrophobicContact CG2-CB 4.03Å; I88-N97 WeakPolarHBondContact CG2-O 3.31Å; I88-N97 PolarHBondContact O-ND2 2.89Å; I88-M100 HydrophobicContact CD1-CB 3.75Å; I88-A101 HydrophobicContact CG2-CB 4.14Å
89	G	98	Very high	98.2	Very high	18 Å²	18	42.2 Å²	42.2	19%	0.186	22%	0.223	C	C	.	.			trans	70.5	-150.6	-168.9	0	0	0	0	0	112.8	T85	T85-G89 VanDerWaalsContact O-CA 3.25Å; T85-G89 WeakPolarHBondContact O-CA 3.05Å; T85-G89 PolarHBondContact O-N 3.05Å
90	N	97.8	Very high	98.2	Very high	45 Å²	45	39.3 Å²	39.3	24%	0.241	22%	0.216	C	C	.	.			trans	-63.1	152.9	175.1	67.4	77.3	0	0	0	112.7	N97 W307 D308	N90-N97 WeakPolarHBondContact O-CB 3.27Å; N90-N97 PolarHBondContact O-ND2 3.18Å; N90-W307 VanDerWaalsContact CB-O 3.25Å; N90-W307 WeakPolarHBondContact CB-O 3.44Å; N90-D308 PolarHBondContact ND2-O 2.76Å; N90-D308 WeakPolarHBondContact OD1-CA 3.46Å
91	R	98.3	Very high	98.2	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.			trans	-147.9	50.4	-164.1	53.1	-166.1	-168.5	-83.5	-12.6	112.3	N97 L98 L304 D305 S306 Q311 G312 G317	R91-N97 HydrophobicContact CB-CB 4.43Å; R91-L98 HydrophobicContact CB-CB 4.41Å; R91-L304 WeakPolarHBondContact CD-O 3.41Å; R91-L304 VanDerWaalsContact CG-O 3.31Å; R91-L304 WeakPolarHBondContact CG-O 3.4Å; R91-L304 PolarHBondContact NE-O 3.43Å; R91-D305 PolarHBondContact NE-O 3.15Å; R91-D305 PolarHBondContact NH2-O 2.92Å; R91-D305 WeakPolarHBondContact O-CA 3.45Å; R91-D305 WeakPolarHBondContact O-CB 3.26Å; R91-S306 CarbonylContact C-O 3.42Å; R91-S306 WeakPolarHBondContact CG-OG 3.25Å; R91-S306 PolarHBondContact N-OG 2.96Å; R91-S306 VanDerWaalsContact N-OG 3.08Å; R91-S306 PolarHBondContact O-N 2.78Å; R91-Q311 PolarHBondContact NH1-O 2.93Å; R91-G312 PolarHBondContact NH1-O 2.99Å; R91-G312 PolarHBondContact NH2-O 2.92Å; R91-G317 VanDerWaalsContact NH2-N 3.14Å
92	V	97.8	Very high	98.2	Very high	15 Å²	15	38.1 Å²	38.1	9%	0.091	21%	0.212	C	C	.	.			trans	-59.9	149.3	178.3	74.4	0	0	0	0	113	G94 S95 S306 D308	V92-G94 PolarHBondContact O-N 3.39Å; V92-S95 WeakPolarHBondContact O-CB 3.22Å; V92-S95 PolarHBondContact O-N 2.87Å; V92-S95 PolarHBondContact O-OG 3.22Å; V92-S306 WeakPolarHBondContact CA-O 3.25Å; V92-S306 WeakPolarHBondContact CB-O 3.43Å; V92-S306 PolarHBondContact N-O 3.02Å; V92-D308 HydrophobicContact CB-CB 3.89Å; V92-D308 HydrophobicContact CG1-CB 3.76Å; V92-D308 HydrophobicContact CG2-CB 4.47Å
93	S	97.1	Very high	98.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.014	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	133.6	178	-74.7	0	0	0	0	114.5	S95 P124 G348 Q351	S93-S95 PolarHBondContact O-N 3.23Å; S93-P124 WeakPolarHBondContact CB-O 3.41Å; S93-G348 WeakPolarHBondContact OG-CA 3.4Å; S93-Q351 PolarHBondContact OG-OE1 3.2Å
94	G	96.9	Very high	98.2	Very high	16 Å²	16	42.6 Å²	42.6	17%	0.165	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	-2.9	-175.8	0	0	0	0	0	114.7	V92 H125	V92-G94 PolarHBondContact O-N 3.39Å; G94-H125 PolarHBondContact O-CE1 2.99Å; G94-H125 PolarHBondContact O-NE2 3.37Å
95	S	98.1	Very high	98.2	Very high	24 Å²	24	42.6 Å²	42.6	17%	0.168	22%	0.223	C	C	.	.	S	Bend	trans	-78.5	157	178.8	74.9	0	0	0	0	113.1	V92 S93 N97 L98	V92-S95 WeakPolarHBondContact O-CB 3.22Å; V92-S95 PolarHBondContact O-N 2.87Å; V92-S95 PolarHBondContact O-OG 3.22Å; S93-S95 PolarHBondContact O-N 3.23Å; S95-N97 PolarHBondContact O-N 3.02Å; S95-N97 PolarHBondContact OG-N 3.46Å; S95-L98 PolarHBondContact O-N 3.4Å; S95-L98 PolarHBondContact OG-N 2.94Å; S95-L98 VanDerWaalsContact OG-N 3.14Å
96	Q	97.9	Very high	98.2	Very high	150 Å²	150	46.3 Å²	46.3	70%	0.701	24%	0.237	S	C	*	.	H	α-helix	trans	-63.4	-31.7	170.6	-175	176.8	-0.8	0	0	112	E99 M100	Q96-E99 PolarHBondContact O-N 3.09Å; Q96-M100 HydrophobicContact CG-CE 4.39Å; Q96-M100 WeakPolarHBondContact O-CG 3.5Å; Q96-M100 PolarHBondContact O-N 3.5Å
97	N	98.4	Very high	98.3	Very high	47 Å²	47	43.9 Å²	43.9	25%	0.251	22%	0.224	S	C	.	.	H	α-helix	trans	-66.9	-39.1	-179.8	-73.8	4.5	0	0	0	112.1	I88 N90 R91 S95 E99 M100 A101	I88-N97 HydrophobicContact CG2-CB 4.03Å; I88-N97 WeakPolarHBondContact CG2-O 3.31Å; I88-N97 PolarHBondContact O-ND2 2.89Å; N90-N97 WeakPolarHBondContact O-CB 3.27Å; N90-N97 PolarHBondContact O-ND2 3.18Å; R91-N97 HydrophobicContact CB-CB 4.43Å; S95-N97 PolarHBondContact O-N 3.02Å; S95-N97 PolarHBondContact OG-N 3.46Å; N97-E99 PolarHBondContact O-N 2.64Å; N97-M100 HydrophobicContact CB-CE 4.37Å; N97-M100 CarbonylContact O-C 3.56Å; N97-M100 PolarHBondContact O-N 3.28Å; N97-M100 WeakPolarHBondContact OD1-CE 3.32Å; N97-A101 WeakPolarHBondContact O-CB 3.28Å; N97-A101 PolarHBondContact O-N 3.49Å
98	L	98.7	Very high	98.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-45.3	173.1	177.1	58.4	0	0	0	111.9	R91 S95 M100 A101 I102 I123 D305 T347	R91-L98 HydrophobicContact CB-CB 4.41Å; S95-L98 PolarHBondContact O-N 3.4Å; S95-L98 PolarHBondContact OG-N 2.94Å; S95-L98 VanDerWaalsContact OG-N 3.14Å; L98-M100 VanDerWaalsContact C-N 3.29Å; L98-M100 PolarHBondContact O-N 2.68Å; L98-A101 WeakPolarHBondContact O-CB 3.48Å; L98-A101 PolarHBondContact O-N 2.83Å; L98-A101 VanDerWaalsContact O-N 3.11Å; L98-I102 HydrophobicContact CD1-CD1 4.16Å; L98-I102 HydrophobicContact CD1-CG1 4.36Å; L98-I102 HydrophobicContact CG-CD1 4.08Å; L98-I102 WeakPolarHBondContact O-CG1 3.31Å; L98-I102 PolarHBondContact O-N 3.24Å; L98-I123 HydrophobicContact CD2-CD1 3.67Å; L98-D305 HydrophobicContact CD1-CB 4.14Å; L98-D305 HydrophobicContact CD2-CB 4.49Å; L98-T347 HydrophobicContact CD1-CG2 4.31Å; L98-T347 HydrophobicContact CD2-CG2 3.73Å; L98-T347 HydrophobicContact CG-CG2 4.38Å
99	E	98.6	Very high	98.3	Very high	64 Å²	64	39 Å²	39	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-65.4	-33.7	177.1	-61.2	-53.8	134.1	0	0	112.5	Q96 N97 K103 S281	Q96-E99 PolarHBondContact O-N 3.09Å; N97-E99 PolarHBondContact O-N 2.64Å; E99-K103 WeakPolarHBondContact O-CB 3.36Å; E99-K103 PolarHBondContact O-N 2.91Å; E99-K103 VanDerWaalsContact O-N 3.09Å; E99-S281 VanDerWaalsContact OE1-CB 3.26Å; E99-S281 WeakPolarHBondContact OE1-CB 3.48Å; E99-S281 PolarHBondContact OE1-OG 3.32Å
100	M	98.7	Very high	98.3	Very high	74 Å²	74	41.8 Å²	41.8	37%	0.365	20%	0.203	S	C	.	.	H	α-helix	trans	-68.6	-38.8	171.5	-68.6	-171.3	-62	0	0	112	I88 Q96 N97 L98 K103 Y104	I88-M100 HydrophobicContact CD1-CB 3.75Å; Q96-M100 HydrophobicContact CG-CE 4.39Å; Q96-M100 WeakPolarHBondContact O-CG 3.5Å; Q96-M100 PolarHBondContact O-N 3.5Å; N97-M100 HydrophobicContact CB-CE 4.37Å; N97-M100 CarbonylContact O-C 3.56Å; N97-M100 PolarHBondContact O-N 3.28Å; N97-M100 WeakPolarHBondContact OD1-CE 3.32Å; L98-M100 VanDerWaalsContact C-N 3.29Å; L98-M100 PolarHBondContact O-N 2.68Å; M100-K103 PolarHBondContact O-N 2.94Å; M100-Y104 WeakPolarHBondContact O-CB 3.42Å; M100-Y104 PolarHBondContact O-N 2.97Å
101	A	98.8	Very high	98.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.7	-50.2	174.3	0	0	0	0	0	111.6	F84 I88 N97 L98 K103 Y104 M105 L304	F84-A101 HydrophobicContact CE2-CB 3.68Å; F84-A101 HydrophobicContact CZ-CB 3.53Å; I88-A101 HydrophobicContact CG2-CB 4.14Å; N97-A101 WeakPolarHBondContact O-CB 3.28Å; N97-A101 PolarHBondContact O-N 3.49Å; L98-A101 WeakPolarHBondContact O-CB 3.48Å; L98-A101 PolarHBondContact O-N 2.83Å; L98-A101 VanDerWaalsContact O-N 3.11Å; A101-K103 VanDerWaalsContact C-N 3.31Å; A101-K103 PolarHBondContact O-N 2.86Å; A101-Y104 WeakPolarHBondContact O-CB 3.37Å; A101-Y104 PolarHBondContact O-N 2.86Å; A101-Y104 VanDerWaalsContact O-N 3.13Å; A101-M105 WeakPolarHBondContact O-CG 3.3Å; A101-M105 PolarHBondContact O-N 2.89Å; A101-L304 HydrophobicContact CB-CD1 4.39Å; A101-L304 HydrophobicContact CB-CD2 4.31Å; A101-L304 HydrophobicContact CB-CG 4.18Å
102	I	98.9	Very high	98.3	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-56.2	-48.1	176.8	-70.3	163.3	0	0	0	110.2	L98 Y104 M105 Y106 L118 S281 F282 L304	L98-I102 HydrophobicContact CD1-CD1 4.16Å; L98-I102 HydrophobicContact CD1-CG1 4.36Å; L98-I102 HydrophobicContact CG-CD1 4.08Å; L98-I102 WeakPolarHBondContact O-CG1 3.31Å; L98-I102 PolarHBondContact O-N 3.24Å; I102-Y104 PolarHBondContact O-N 3.47Å; I102-M105 PolarHBondContact O-N 2.93Å; I102-Y106 WeakPolarHBondContact O-CB 3.36Å; I102-Y106 PolarHBondContact O-N 2.69Å; I102-L118 HydrophobicContact CG2-CD1 4.04Å; I102-L118 HydrophobicContact CG2-CD2 3.76Å; I102-S281 VanDerWaalsContact CD1-OG 3.28Å; I102-S281 WeakPolarHBondContact CD1-OG 3.24Å; I102-F282 VanDerWaalsContact CD1-O 3.31Å; I102-F282 WeakPolarHBondContact CD1-O 3.38Å; I102-F282 HydrophobicContact CG2-CB 4.28Å; I102-L304 HydrophobicContact CB-CD2 4.48Å; I102-L304 HydrophobicContact CG1-CD2 3.83Å
103	K	98.8	Very high	98.3	Very high	143 Å²	143	50.8 Å²	50.8	62%	0.622	26%	0.255	S	S	*	.	H	α-helix	trans	-63.5	-40.1	177.8	-176.6	177.9	178.7	-176.8	0	112.3	E99 M100 A101 N107	E99-K103 WeakPolarHBondContact O-CB 3.36Å; E99-K103 PolarHBondContact O-N 2.91Å; E99-K103 VanDerWaalsContact O-N 3.09Å; M100-K103 PolarHBondContact O-N 2.94Å; A101-K103 VanDerWaalsContact C-N 3.31Å; A101-K103 PolarHBondContact O-N 2.86Å; K103-N107 PolarHBondContact O-N 2.92Å; K103-N107 PolarHBondContact O-ND2 3.2Å
104	Y	98.8	Very high	98.3	Very high	63 Å²	63	51 Å²	51	25%	0.247	26%	0.257	C	S	.	.	H	α-helix	trans	-60.1	-53.7	176	178.2	-80.1	0	0	0	110	F84 M100 A101 I102 Y106 N107 A108	F84-Y104 HydrophobicContact CB-CE1 4.13Å; F84-Y104 AromaticContact CD2-CD1 3.5Å; F84-Y104 HydrophobicContact CD2-CD1 3.5Å; F84-Y104 VanDerWaalsContact CD2-CD1 3.5Å; F84-Y104 AromaticContact CD2-CE1 3.76Å; F84-Y104 HydrophobicContact CD2-CE1 3.76Å; F84-Y104 HydrophobicContact CD2-CG 4.07Å; F84-Y104 HydrophobicContact CE2-CD1 4.11Å; F84-Y104 HydrophobicContact CG-CE1 4.44Å; M100-Y104 WeakPolarHBondContact O-CB 3.42Å; M100-Y104 PolarHBondContact O-N 2.97Å; A101-Y104 WeakPolarHBondContact O-CB 3.37Å; A101-Y104 PolarHBondContact O-N 2.86Å; A101-Y104 VanDerWaalsContact O-N 3.13Å; I102-Y104 PolarHBondContact O-N 3.47Å; Y104-Y106 PolarHBondContact O-N 2.92Å; Y104-N107 PolarHBondContact O-N 2.94Å; Y104-N107 VanDerWaalsContact O-N 3.16Å; Y104-A108 HydrophobicContact CD1-CB 4.44Å; Y104-A108 HydrophobicContact CE1-CB 4.24Å; Y104-A108 WeakPolarHBondContact O-CB 3.27Å; Y104-A108 PolarHBondContact O-N 2.83Å
105	M	98.6	Very high	98.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.6	-42.6	-177.2	-68.9	-52.5	-71.1	0	0	111.9	F84 A101 I102 N107 A108 M109 T284 L304 M321 W324 L345	F84-M105 HydrophobicContact CD2-SD 4.08Å; F84-M105 HydrophobicContact CE2-CG 4Å; F84-M105 HydrophobicContact CE2-SD 4.1Å; A101-M105 WeakPolarHBondContact O-CG 3.3Å; A101-M105 PolarHBondContact O-N 2.89Å; I102-M105 PolarHBondContact O-N 2.93Å; M105-N107 VanDerWaalsContact C-N 3.32Å; M105-N107 PolarHBondContact O-N 2.97Å; M105-A108 PolarHBondContact O-N 3.25Å; M105-M109 HydrophobicContact CB-CE 4.1Å; M105-M109 WeakPolarHBondContact O-CB 3.46Å; M105-M109 WeakPolarHBondContact O-CG 3.44Å; M105-M109 PolarHBondContact O-N 2.82Å; M105-T284 HydrophobicContact CB-CG2 4.39Å; M105-L304 HydrophobicContact CB-CD2 4.35Å; M105-L304 HydrophobicContact CG-CD1 3.79Å; M105-L304 HydrophobicContact CG-CD2 3.98Å; M105-M321 HydrophobicContact CE-SD 4.31Å; M105-W324 HydrophobicContact CE-CB 4.43Å; M105-W324 HydrophobicContact CE-CD2 4.19Å; M105-W324 HydrophobicContact CE-CE3 3.68Å; M105-W324 HydrophobicContact CE-CZ3 4.29Å; M105-W324 HydrophobicContact SD-CE3 4.48Å; M105-L345 HydrophobicContact CB-CD1 4.11Å; M105-L345 HydrophobicContact CE-CD1 3.44Å; M105-L345 VanDerWaalsContact CE-CD1 3.44Å; M105-L345 HydrophobicContact CG-CD1 4.05Å
106	Y	98.8	Very high	98.4	Very high	78 Å²	78	53.4 Å²	53.4	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-53.7	-49.6	173.8	178.6	-89.2	0	0	0	111.9	I102 Y104 K110 V116 L118	I102-Y106 WeakPolarHBondContact O-CB 3.36Å; I102-Y106 PolarHBondContact O-N 2.69Å; Y104-Y106 PolarHBondContact O-N 2.92Å; Y106-K110 HydrophobicContact CD1-CG 4.41Å; Y106-K110 HydrophobicContact CE1-CG 4.03Å; Y106-K110 WeakPolarHBondContact O-CB 3.35Å; Y106-K110 VanDerWaalsContact O-CG 3.29Å; Y106-K110 WeakPolarHBondContact O-CG 3.42Å; Y106-K110 PolarHBondContact O-N 2.8Å; Y106-K110 VanDerWaalsContact O-N 3.08Å; Y106-V116 HydrophobicContact CD2-CB 4.42Å; Y106-V116 HydrophobicContact CD2-CG1 3.64Å; Y106-V116 HydrophobicContact CE2-CB 4.36Å; Y106-V116 HydrophobicContact CE2-CG1 4.03Å; Y106-V116 HydrophobicContact CG-CG1 4.37Å; Y106-L118 HydrophobicContact CD2-CD1 4.46Å; Y106-L118 HydrophobicContact CD2-CD2 4Å; Y106-L118 HydrophobicContact CD2-CG 3.94Å; Y106-L118 HydrophobicContact CE2-CG 4.45Å
107	N	98.7	Very high	98.5	Very high	66 Å²	66	49.3 Å²	49.3	35%	0.353	24%	0.244	S	C	.	.	H	α-helix	trans	-70.8	-42.3	-177.7	-71.8	-51.3	0	0	0	112.2	K103 Y104 M105 K110 Q111	K103-N107 PolarHBondContact O-N 2.92Å; K103-N107 PolarHBondContact O-ND2 3.2Å; Y104-N107 PolarHBondContact O-N 2.94Å; Y104-N107 VanDerWaalsContact O-N 3.16Å; M105-N107 VanDerWaalsContact C-N 3.32Å; M105-N107 PolarHBondContact O-N 2.97Å; N107-K110 PolarHBondContact O-N 2.85Å; N107-Q111 WeakPolarHBondContact O-CB 3.31Å; N107-Q111 VanDerWaalsContact O-CG 3.24Å; N107-Q111 WeakPolarHBondContact O-CG 3.23Å; N107-Q111 PolarHBondContact O-N 3.37Å
108	A	98.5	Very high	98.5	Very high	12 Å²	12	49.9 Å²	49.9	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-47.4	-179.7	0	0	0	0	0	111.4	Y104 M105 K110 Q111 D112 W324	Y104-A108 HydrophobicContact CD1-CB 4.44Å; Y104-A108 HydrophobicContact CE1-CB 4.24Å; Y104-A108 WeakPolarHBondContact O-CB 3.27Å; Y104-A108 PolarHBondContact O-N 2.83Å; M105-A108 PolarHBondContact O-N 3.25Å; A108-K110 PolarHBondContact O-N 3.11Å; A108-Q111 WeakPolarHBondContact O-CB 3.24Å; A108-Q111 PolarHBondContact O-N 3.48Å; A108-Q111 VanDerWaalsContact O-N 3.15Å; A108-D112 PolarHBondContact O-N 3.4Å; A108-W324 HydrophobicContact CB-CH2 3.59Å; A108-W324 HydrophobicContact CB-CZ2 3.83Å; A108-W324 HydrophobicContact CB-CZ3 4.33Å
109	M	98.6	Very high	98.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-34.9	177.2	-67.8	-168.1	-71.9	0	0	112.7	M105 D112 G113 L114 V116 T284 A286 W324 L345	M105-M109 HydrophobicContact CB-CE 4.1Å; M105-M109 WeakPolarHBondContact O-CB 3.46Å; M105-M109 WeakPolarHBondContact O-CG 3.44Å; M105-M109 PolarHBondContact O-N 2.82Å; M109-D112 PolarHBondContact O-N 3.35Å; M109-G113 PolarHBondContact O-N 3.4Å; M109-L114 HydrophobicContact CB-CD1 4.14Å; M109-L114 HydrophobicContact CG-CD1 4.35Å; M109-L114 WeakPolarHBondContact O-CB 3.48Å; M109-L114 PolarHBondContact O-N 3.41Å; M109-V116 HydrophobicContact CB-CG1 4.5Å; M109-V116 HydrophobicContact CB-CG2 3.66Å; M109-V116 HydrophobicContact CE-CG1 4.34Å; M109-T284 HydrophobicContact CE-CG2 3.3Å; M109-A286 HydrophobicContact CB-CB 4.35Å; M109-A286 HydrophobicContact CE-CB 4.04Å; M109-A286 HydrophobicContact CG-CB 4.5Å; M109-A286 HydrophobicContact SD-CB 3.47Å; M109-A286 WeakPolarHBondContact SD-CB 3.42Å; M109-W324 HydrophobicContact CG-CD2 4.06Å; M109-W324 HydrophobicContact CG-CG 3.85Å; M109-W324 HydrophobicContact SD-CB 4.3Å; M109-W324 HydrophobicContact SD-CG 4.1Å; M109-L345 HydrophobicContact CE-CD1 3.92Å; M109-L345 HydrophobicContact SD-CD1 4.44Å
110	K	98.5	Very high	98.5	Very high	75 Å²	75	52.8 Å²	52.8	33%	0.326	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-35.9	171.5	-81.1	-63.5	-167.1	-159.5	0	112.5	Y106 N107 A108 D112 G113 D115 V116	Y106-K110 HydrophobicContact CD1-CG 4.41Å; Y106-K110 HydrophobicContact CE1-CG 4.03Å; Y106-K110 WeakPolarHBondContact O-CB 3.35Å; Y106-K110 VanDerWaalsContact O-CG 3.29Å; Y106-K110 WeakPolarHBondContact O-CG 3.42Å; Y106-K110 PolarHBondContact O-N 2.8Å; Y106-K110 VanDerWaalsContact O-N 3.08Å; N107-K110 PolarHBondContact O-N 2.85Å; A108-K110 PolarHBondContact O-N 3.11Å; K110-D112 VanDerWaalsContact C-N 3.34Å; K110-G113 WeakPolarHBondContact O-CA 3.42Å; K110-G113 PolarHBondContact O-N 3.35Å; K110-D115 IonicContact NZ-OD1 3.54Å; K110-D115 PolarHBondContact NZ-OD1 3.2Å; K110-V116 HydrophobicContact CD-CB 3.83Å; K110-V116 HydrophobicContact CD-CG2 3.9Å; K110-V116 WeakPolarHBondContact CE-O 3.04Å; K110-V116 HydrophobicContact CG-CB 3.92Å; K110-V116 HydrophobicContact CG-CG2 3.97Å; K110-V116 PolarHBondContact NZ-O 3.02Å
111	Q	98	Very high	98.4	Very high	159 Å²	159	49.5 Å²	49.5	74%	0.743	25%	0.254	S	S	*	.	H	α-helix	trans	-69.4	-34.1	177.2	-74.7	169.7	26.1	0	0	112	N107 A108 G113	N107-Q111 WeakPolarHBondContact O-CB 3.31Å; N107-Q111 VanDerWaalsContact O-CG 3.24Å; N107-Q111 WeakPolarHBondContact O-CG 3.23Å; N107-Q111 PolarHBondContact O-N 3.37Å; A108-Q111 WeakPolarHBondContact O-CB 3.24Å; A108-Q111 PolarHBondContact O-N 3.48Å; A108-Q111 VanDerWaalsContact O-N 3.15Å; Q111-G113 PolarHBondContact O-N 2.84Å; Q111-G113 VanDerWaalsContact O-N 3.14Å
112	D	96.6	Very high	98.4	Very high	49 Å²	49	53.3 Å²	53.3	26%	0.262	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-5.3	165.7	-76.1	4.7	0	0	0	112.6	R80 A108 M109 K110 L114 W324 S328 K331	R80-D112 IonicContact CZ-OD2 2.92Å; R80-D112 IonicContact NH1-OD2 3.33Å; R80-D112 VanDerWaalsContact NH2-CG 3.3Å; R80-D112 IonicContact NH2-OD1 2.71Å; R80-D112 PolarHBondContact NH2-OD1 3.39Å; R80-D112 IonicContact NH2-OD2 3.99Å; R80-D112 PolarHBondContact NH2-OD2 3.45Å; A108-D112 PolarHBondContact O-N 3.4Å; M109-D112 PolarHBondContact O-N 3.35Å; K110-D112 VanDerWaalsContact C-N 3.34Å; D112-L114 VanDerWaalsContact C-N 3.34Å; D112-L114 HydrophobicContact CB-CG 4.4Å; D112-L114 PolarHBondContact O-N 3.14Å; D112-W324 VanDerWaalsContact OD2-CE2 3.24Å; D112-W324 VanDerWaalsContact OD2-CZ2 3.25Å; D112-W324 WeakPolarHBondContact OD2-CZ2 3.48Å; D112-W324 PolarHBondContact OD2-NE1 3.32Å; D112-S328 PolarHBondContact OD2-OG 3.01Å; D112-K331 WeakPolarHBondContact O-CD 3.35Å; D112-K331 WeakPolarHBondContact O-CE 3.17Å; D112-K331 PolarHBondContact O-NZ 3.44Å
113	G	97.6	Very high	98.3	Very high	41 Å²	41	53.2 Å²	53.2	42%	0.423	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	23.2	177.1	0	0	0	0	0	114	M109 K110 Q111 K331	M109-G113 PolarHBondContact O-N 3.4Å; K110-G113 WeakPolarHBondContact O-CA 3.42Å; K110-G113 PolarHBondContact O-N 3.35Å; Q111-G113 PolarHBondContact O-N 2.84Å; Q111-G113 VanDerWaalsContact O-N 3.14Å; G113-K331 PolarHBondContact O-NZ 2.88Å
114	L	98.4	Very high	98.2	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.042	25%	0.25	C	C	.	.			trans	-67.1	156.1	169.8	-59	175.8	0	0	0	109.4	M109 D112 V116 A286 I288 L327 K331	M109-L114 HydrophobicContact CB-CD1 4.14Å; M109-L114 HydrophobicContact CG-CD1 4.35Å; M109-L114 WeakPolarHBondContact O-CB 3.48Å; M109-L114 PolarHBondContact O-N 3.41Å; D112-L114 VanDerWaalsContact C-N 3.34Å; D112-L114 HydrophobicContact CB-CG 4.4Å; D112-L114 PolarHBondContact O-N 3.14Å; L114-V116 HydrophobicContact CB-CG2 3.94Å; L114-A286 HydrophobicContact CB-CB 4.33Å; L114-A286 HydrophobicContact CD1-CB 4.11Å; L114-I288 HydrophobicContact CD2-CD1 4.35Å; L114-I288 HydrophobicContact CD2-CG1 3.91Å; L114-L327 HydrophobicContact CD1-CB 3.94Å; L114-L327 HydrophobicContact CD1-CD2 4.05Å; L114-L327 HydrophobicContact CD2-CB 3.98Å; L114-L327 HydrophobicContact CD2-CD2 4.31Å; L114-K331 HydrophobicContact CD2-CD 4.05Å
115	D	98.3	Very high	98.1	Very high	85 Å²	85	46.7 Å²	46.7	46%	0.455	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	132.7	162.5	-163.1	-1	0	0	0	107.7	K110 A286 E287	K110-D115 IonicContact NZ-OD1 3.54Å; K110-D115 PolarHBondContact NZ-OD1 3.2Å; D115-A286 CarbonylContact O-C 3.59Å; D115-A286 WeakPolarHBondContact O-CA 3.29Å; D115-E287 HydrophobicContact CB-CB 4.41Å; D115-E287 PolarHBondContact N-O 2.64Å; D115-E287 PolarHBondContact O-N 3.18Å
116	V	98.8	Very high	98.1	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.024	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	131.1	-169	-171	0	0	0	0	109.2	Y106 M109 K110 L114 T284 V285 A286	Y106-V116 HydrophobicContact CD2-CB 4.42Å; Y106-V116 HydrophobicContact CD2-CG1 3.64Å; Y106-V116 HydrophobicContact CE2-CB 4.36Å; Y106-V116 HydrophobicContact CE2-CG1 4.03Å; Y106-V116 HydrophobicContact CG-CG1 4.37Å; M109-V116 HydrophobicContact CB-CG1 4.5Å; M109-V116 HydrophobicContact CB-CG2 3.66Å; M109-V116 HydrophobicContact CE-CG1 4.34Å; K110-V116 HydrophobicContact CD-CB 3.83Å; K110-V116 HydrophobicContact CD-CG2 3.9Å; K110-V116 WeakPolarHBondContact CE-O 3.04Å; K110-V116 HydrophobicContact CG-CB 3.92Å; K110-V116 HydrophobicContact CG-CG2 3.97Å; K110-V116 PolarHBondContact NZ-O 3.02Å; L114-V116 HydrophobicContact CB-CG2 3.94Å; V116-T284 HydrophobicContact CG1-CG2 4.4Å; V116-V285 VanDerWaalsContact CA-O 3.24Å; V116-V285 WeakPolarHBondContact CA-O 3.36Å; V116-V285 VanDerWaalsContact CG1-O 3.27Å; V116-V285 WeakPolarHBondContact CG1-O 3.42Å; V116-A286 HydrophobicContact CG2-CB 3.99Å
117	H	98.8	Very high	98.1	Very high	64 Å²	64	46 Å²	46	30%	0.296	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	166.5	173.8	65.9	-84.2	0	0	0	110.7	E119 V285	H117-E119 IonicContact CD2-OE1 2.71Å; H117-E119 IonicContact CE1-OE1 3.32Å; H117-E119 IonicContact NE2-OE1 3.21Å; H117-E119 PolarHBondContact NE2-OE1 3.08Å; H117-V285 WeakPolarHBondContact CE1-CG1 3.44Å; H117-V285 PolarHBondContact N-O 2.77Å; H117-V285 PolarHBondContact O-N 3.03Å
118	L	98.8	Very high	98	Very high	60 Å²	60	43.7 Å²	43.7	31%	0.314	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136	177.7	-64	-176	0	0	0	108.9	I102 Y106 F282 T284	I102-L118 HydrophobicContact CG2-CD1 4.04Å; I102-L118 HydrophobicContact CG2-CD2 3.76Å; Y106-L118 HydrophobicContact CD2-CD1 4.46Å; Y106-L118 HydrophobicContact CD2-CD2 4Å; Y106-L118 HydrophobicContact CD2-CG 3.94Å; Y106-L118 HydrophobicContact CE2-CG 4.45Å; L118-F282 HydrophobicContact CB-CB 3.89Å; L118-F282 HydrophobicContact CB-CD1 3.72Å; L118-F282 HydrophobicContact CB-CG 3.91Å; L118-F282 HydrophobicContact CD1-CB 4.33Å; L118-F282 HydrophobicContact CD1-CD1 4.48Å; L118-F282 HydrophobicContact CD1-CD2 4.3Å; L118-F282 HydrophobicContact CD1-CG 4.11Å; L118-F282 HydrophobicContact CD2-CB 4.29Å; L118-F282 HydrophobicContact CG-CB 4.4Å; L118-T284 HydrophobicContact CD2-CG2 3.88Å
119	E	98.6	Very high	98	Very high	18 Å²	18	45 Å²	45	8%	0.084	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.9	176.3	-66.3	-165.4	-171.9	0	0	110.2	H117 V121 F282 N283 V285 Y359 H363	H117-E119 IonicContact CD2-OE1 2.71Å; H117-E119 IonicContact CE1-OE1 3.32Å; H117-E119 IonicContact NE2-OE1 3.21Å; H117-E119 PolarHBondContact NE2-OE1 3.08Å; E119-V121 PolarHBondContact O-N 3.43Å; E119-F282 CarbonylContact O-C 3.59Å; E119-F282 VanDerWaalsContact O-CA 3.25Å; E119-F282 WeakPolarHBondContact O-CA 3.5Å; E119-N283 HydrophobicContact CB-CB 4.47Å; E119-N283 PolarHBondContact N-O 3.08Å; E119-N283 PolarHBondContact O-N 3.44Å; E119-V285 HydrophobicContact CG-CG2 3.96Å; E119-Y359 WeakPolarHBondContact OE2-CD2 3.34Å; E119-Y359 WeakPolarHBondContact OE2-CE2 3.3Å; E119-H363 IonicContact OE1-CE1 3.31Å; E119-H363 IonicContact OE1-NE2 3.54Å; E119-H363 PolarHBondContact OE1-NE2 2.85Å; E119-H363 IonicContact OE2-CD2 3.11Å; E119-H363 IonicContact OE2-CE1 3.81Å; E119-H363 IonicContact OE2-NE2 3.04Å; E119-H363 PolarHBondContact OE2-NE2 3.15Å
120	P	98.3	Very high	97.9	Very high	106 Å²	106	54.1 Å²	54.1	69%	0.688	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60	136.3	-175.9	-21.6	30.9	0	0	0	112.7	S281 F282	P120-S281 WeakPolarHBondContact CA-O 3.07Å; P120-F282 HydrophobicContact CB-CD1 4.38Å; P120-F282 HydrophobicContact CB-CE1 4.3Å; P120-F282 HydrophobicContact CG-CD1 4.29Å; P120-F282 HydrophobicContact CG-CE1 4.09Å
121	V	97.8	Very high	97.9	Very high	6 Å²	6	52.6 Å²	52.6	4%	0.036	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.8	173.1	59.3	0	0	0	0	109.2	E119 I123 S281 T347 V354 Q358	E119-V121 PolarHBondContact O-N 3.43Å; V121-I123 HydrophobicContact CB-CG2 4.46Å; V121-I123 HydrophobicContact CG1-CG2 3.94Å; V121-I123 HydrophobicContact CG2-CG2 3.74Å; V121-S281 PolarHBondContact N-O 3.14Å; V121-S281 PolarHBondContact O-N 2.91Å; V121-T347 HydrophobicContact CG1-CG2 4.04Å; V121-V354 HydrophobicContact CG2-CG1 4.33Å; V121-Q358 HydrophobicContact CG2-CB 4.36Å; V121-Q358 HydrophobicContact CG2-CG 4.49Å
122	K	98.1	Very high	97.9	Very high	80 Å²	80	48 Å²	48	35%	0.348	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.2	170.2	-165.7	75.4	-173.1	172.3	0	109.5	D278 A279 D280 V354 Q358	K122-D278 HydrophobicContact CD-CB 4.29Å; K122-D278 WeakPolarHBondContact CE-O 3.45Å; K122-D278 HydrophobicContact CG-CB 3.97Å; K122-D278 PolarHBondContact NZ-O 2.83Å; K122-A279 WeakPolarHBondContact CA-O 3.15Å; K122-D280 WeakPolarHBondContact CD-OD1 3.48Å; K122-D280 WeakPolarHBondContact CE-OD1 3.46Å; K122-D280 VanDerWaalsContact NZ-CG 3.34Å; K122-D280 IonicContact NZ-OD1 2.63Å; K122-D280 PolarHBondContact NZ-OD1 2.7Å; K122-D280 IonicContact NZ-OD2 3.91Å; K122-V354 WeakPolarHBondContact O-CG1 3.33Å; K122-Q358 PolarHBondContact O-NE2 3.08Å
123	I	97.5	Very high	98.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	148.5	-173.3	59.5	178.8	0	0	0	112.8	L98 V121 D278 A279 T347 V354	L98-I123 HydrophobicContact CD2-CD1 3.67Å; V121-I123 HydrophobicContact CB-CG2 4.46Å; V121-I123 HydrophobicContact CG1-CG2 3.94Å; V121-I123 HydrophobicContact CG2-CG2 3.74Å; I123-D278 CarbonylContact O-C 3.52Å; I123-D278 VanDerWaalsContact O-CA 3.26Å; I123-D278 WeakPolarHBondContact O-CA 3.45Å; I123-D278 WeakPolarHBondContact O-CB 3.39Å; I123-A279 HydrophobicContact CG1-CB 4.1Å; I123-A279 PolarHBondContact N-O 2.89Å; I123-A279 PolarHBondContact O-N 3.33Å; I123-T347 HydrophobicContact CD1-CG2 3.88Å; I123-T347 HydrophobicContact CG2-CG2 3.92Å; I123-V354 HydrophobicContact CG2-CG1 4.25Å
124	P	96.4	Very high	98.1	Very high	31 Å²	31	46.4 Å²	46.4	20%	0.201	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	144.5	170.7	-23.3	33.8	0	0	0	111.6	S93 W232 Q351 V354	S93-P124 WeakPolarHBondContact CB-O 3.41Å; P124-W232 HydrophobicContact CB-CH2 4.05Å; P124-W232 HydrophobicContact CG-CH2 4.46Å; P124-Q351 HydrophobicContact CB-CG 4.49Å; P124-Q351 HydrophobicContact CG-CB 4.08Å; P124-V354 HydrophobicContact CG-CG2 4.24Å
125	H	97.7	Very high	98.1	Very high	39 Å²	39	46 Å²	46	18%	0.181	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	103.5	177.2	-170.5	175.3	0	0	0	110.4	G94 L276 P277 A279	G94-H125 PolarHBondContact O-CE1 2.99Å; G94-H125 PolarHBondContact O-NE2 3.37Å; H125-L276 HydrophobicContact CB-CB 4.16Å; H125-L276 PolarHBondContact O-N 3.18Å; H125-P277 WeakPolarHBondContact CB-O 3.25Å; H125-A279 HydrophobicContact CB-CB 4.38Å
126	W	97.8	Very high	98.1	Very high	13 Å²	13	44.1 Å²	44.1	5%	0.049	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137	176.4	177.5	86.5	0	0	0	110.1	R128 L148 S151 A273	W126-R128 VanDerWaalsContact CH2-CA 3.43Å; W126-R128 HydrophobicContact CH2-CB 3.5Å; W126-R128 HydrophobicContact CH2-CG 3.85Å; W126-R128 HydrophobicContact CZ2-CB 4.31Å; W126-R128 HydrophobicContact CZ3-CB 3.65Å; W126-R128 HydrophobicContact CZ3-CG 4.37Å; W126-L148 VanDerWaalsContact CZ2-O 3.25Å; W126-L148 WeakPolarHBondContact CZ2-O 3.37Å; W126-S151 PolarHBondContact NE1-O 2.89Å; W126-A273 HydrophobicContact CZ2-CB 3.7Å
127	V	98	Very high	98.1	Very high	49 Å²	49	48.8 Å²	48.8	30%	0.297	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.4	179.7	-179.5	0	0	0	0	108.6	G129 A273 Q274 L276	V127-G129 PolarHBondContact O-N 3.48Å; V127-A273 CarbonylContact O-C 3.47Å; V127-A273 VanDerWaalsContact O-CA 3.29Å; V127-A273 WeakPolarHBondContact O-CA 3.49Å; V127-Q274 HydrophobicContact CB-CG 3.88Å; V127-Q274 PolarHBondContact N-O 3.46Å; V127-Q274 PolarHBondContact O-N 3.5Å; V127-L276 HydrophobicContact CG2-CD1 3.84Å; V127-L276 HydrophobicContact CG2-CG 4.45Å
128	R	97.6	Very high	98.1	Very high	19 Å²	19	48.7 Å²	48.7	7%	0.072	26%	0.262	C	S	.	.			trans	-59.6	-39.7	-178.9	-176.2	-179	-64.3	-74.8	-8.6	114.2	W126 E131 G147 T230 G272 A273 D308	W126-R128 VanDerWaalsContact CH2-CA 3.43Å; W126-R128 HydrophobicContact CH2-CB 3.5Å; W126-R128 HydrophobicContact CH2-CG 3.85Å; W126-R128 HydrophobicContact CZ2-CB 4.31Å; W126-R128 HydrophobicContact CZ3-CB 3.65Å; W126-R128 HydrophobicContact CZ3-CG 4.37Å; R128-E131 VanDerWaalsContact CD-OE1 3.27Å; R128-E131 WeakPolarHBondContact CD-OE1 3.44Å; R128-E131 IonicContact NH1-OE1 3.18Å; R128-E131 PolarHBondContact NH1-OE1 2.91Å; R128-G147 PolarHBondContact NH1-O 2.94Å; R128-T230 PolarHBondContact NH2-OG1 3.27Å; R128-G272 CarbonylContact O-C 3.5Å; R128-A273 WeakPolarHBondContact O-CA 3.07Å; R128-A273 PolarHBondContact O-N 3.49Å; R128-A273 VanDerWaalsContact O-N 3.09Å; R128-D308 WeakPolarHBondContact CB-OD2 3.37Å; R128-D308 WeakPolarHBondContact CD-OD2 3.36Å; R128-D308 IonicContact CZ-OD1 3.77Å; R128-D308 IonicContact CZ-OD2 2.64Å; R128-D308 VanDerWaalsContact NE-CG 3.27Å; R128-D308 IonicContact NE-OD1 3.58Å; R128-D308 PolarHBondContact NE-OD1 2.91Å; R128-D308 IonicContact NE-OD2 2.85Å; R128-D308 PolarHBondContact NE-OD2 3Å; R128-D308 IonicContact NH2-OD1 2.99Å; R128-D308 PolarHBondContact NH2-OD1 3.34Å; R128-D308 IonicContact NH2-OD2 3.59Å
129	G	97.1	Very high	98	Very high	40 Å²	40	52.1 Å²	52.1	41%	0.412	27%	0.271	S	S	.	.			trans	66.2	-166.3	-174.3	0	0	0	0	0	112.7	V127	V127-G129 PolarHBondContact O-N 3.48Å
130	K	97.9	Very high	98	Very high	190 Å²	190	55.8 Å²	55.8	83%	0.826	29%	0.294	S	S	*	.	S	Bend	trans	-79.7	138.5	174.8	-68	-175.5	179.4	-179	0	110.1	G272	K130-G272 PolarHBondContact O-N 3.39Å
131	E	98.4	Very high	98	Very high	44 Å²	44	53.1 Å²	53.1	21%	0.206	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	153.2	-179.6	60.2	-173.4	-172.3	0	0	113	R128 M145 L146 G147 V270 M271	R128-E131 VanDerWaalsContact CD-OE1 3.27Å; R128-E131 WeakPolarHBondContact CD-OE1 3.44Å; R128-E131 IonicContact NH1-OE1 3.18Å; R128-E131 PolarHBondContact NH1-OE1 2.91Å; E131-M145 HydrophobicContact CB-CE 3.69Å; E131-M145 HydrophobicContact CB-SD 4.3Å; E131-M145 HydrophobicContact CG-CE 3.82Å; E131-M145 WeakPolarHBondContact OE2-CE 2.94Å; E131-L146 VanDerWaalsContact OE1-CA 3.31Å; E131-L146 WeakPolarHBondContact OE1-CA 3.44Å; E131-G147 PolarHBondContact OE1-N 2.98Å; E131-G147 VanDerWaalsContact OE2-CA 3.22Å; E131-G147 WeakPolarHBondContact OE2-CA 3.31Å; E131-G147 PolarHBondContact OE2-N 3.43Å; E131-V270 CarbonylContact C-O 3.56Å; E131-V270 WeakPolarHBondContact CA-O 3.36Å; E131-V270 WeakPolarHBondContact CB-O 3.18Å; E131-M271 HydrophobicContact CB-CG 4.37Å
132	S	98.7	Very high	98.1	Very high	63 Å²	63	57.2 Å²	57.2	44%	0.441	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	144.6	175.9	64.4	0	0	0	0	111.2	V270	S132-V270 PolarHBondContact N-O 3.46Å; S132-V270 PolarHBondContact O-N 3.3Å
133	A	98.8	Very high	98.1	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.025	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	135.1	171.2	0	0	0	0	0	110.2	L143 M145 R268 L269	A133-L143 HydrophobicContact CB-CB 4.02Å; A133-L143 HydrophobicContact CB-CD1 4.26Å; A133-L143 PolarHBondContact O-N 2.85Å; A133-M145 HydrophobicContact CB-CB 4.17Å; A133-M145 HydrophobicContact CB-CG 3.94Å; A133-M145 HydrophobicContact CB-SD 3.5Å; A133-M145 WeakPolarHBondContact CB-SD 3.21Å; A133-M145 PolarHBondContact N-SD 2.85Å; A133-R268 WeakPolarHBondContact CA-O 3.45Å; A133-L269 HydrophobicContact CB-CD1 4.16Å
134	E	98.8	Very high	98.2	Very high	52 Å²	52	54.8 Å²	54.8	24%	0.243	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	124.6	179.4	-170.3	-178.3	-159.7	0	0	110.3	I136 T140 V267 R268	E134-I136 HydrophobicContact CB-CD1 4.23Å; E134-I136 HydrophobicContact CG-CD1 3.87Å; E134-I136 PolarHBondContact O-N 3.49Å; E134-I136 WeakPolarHBondContact OE2-CD1 3.42Å; E134-T140 HydrophobicContact CG-CG2 4.33Å; E134-T140 WeakPolarHBondContact OE1-CG2 3.49Å; E134-V267 CarbonylContact O-C 3.49Å; E134-V267 VanDerWaalsContact O-CA 3.3Å; E134-V267 WeakPolarHBondContact O-CA 3.02Å; E134-R268 PolarHBondContact N-O 3.14Å; E134-R268 PolarHBondContact O-N 2.93Å; E134-R268 IonicContact OE2-CZ 3.53Å; E134-R268 IonicContact OE2-NE 3.65Å; E134-R268 IonicContact OE2-NH2 2.65Å; E134-R268 PolarHBondContact OE2-NH2 2.95Å
135	M	98.8	Very high	98.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	120	165.9	-177.1	176.6	64.3	0	0	108.4	K137 R139 T140 K141 L143 L254 M255 L258 I265 V266 V267	M135-K137 WeakPolarHBondContact CG-O 3.44Å; M135-R139 HydrophobicContact CE-CG 4.06Å; M135-R139 VanDerWaalsContact O-O 3.1Å; M135-T140 CarbonylContact O-C 3.57Å; M135-T140 WeakPolarHBondContact O-CA 3.19Å; M135-K141 HydrophobicContact CE-CB 3.98Å; M135-K141 PolarHBondContact N-O 2.95Å; M135-K141 PolarHBondContact O-N 3.09Å; M135-L143 HydrophobicContact CB-CD1 4.31Å; M135-L143 HydrophobicContact CB-CD2 4.23Å; M135-L143 HydrophobicContact CB-CG 4.4Å; M135-L254 HydrophobicContact CE-CD2 4.1Å; M135-M255 HydrophobicContact SD-CG 4.49Å; M135-L258 HydrophobicContact CE-CD1 4.17Å; M135-L258 HydrophobicContact SD-CD1 3.74Å; M135-I265 HydrophobicContact CG-CG2 4.24Å; M135-I265 HydrophobicContact SD-CG2 4.16Å; M135-V266 CarbonylContact C-O 3.48Å; M135-V267 HydrophobicContact CB-CG2 4.36Å
136	I	98.7	Very high	98.3	Very high	46 Å²	46	53 Å²	53	24%	0.236	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-37.8	-179.4	-52.5	-58.4	0	0	0	111.1	E134 R139 V266 R268	E134-I136 HydrophobicContact CB-CD1 4.23Å; E134-I136 HydrophobicContact CG-CD1 3.87Å; E134-I136 PolarHBondContact O-N 3.49Å; E134-I136 WeakPolarHBondContact OE2-CD1 3.42Å; I136-R139 CarbonylContact O-C 3.25Å; I136-V266 HydrophobicContact CB-CB 4.46Å; I136-V266 HydrophobicContact CB-CG1 4.39Å; I136-V266 PolarHBondContact N-O 2.94Å; I136-R268 HydrophobicContact CD1-CB 4.21Å; I136-R268 HydrophobicContact CG1-CB 4.15Å
137	K	98.5	Very high	98.3	Very high	102 Å²	102	52.4 Å²	52.4	44%	0.443	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	146.1	176.7	-66.6	-175.6	-178.9	174.9	0	109.9	M135 R139 K264 I265 V266	M135-K137 WeakPolarHBondContact CG-O 3.44Å; K137-R139 VanDerWaalsContact C-N 3.34Å; K137-K264 CarbonylContact C-O 3.46Å; K137-K264 WeakPolarHBondContact CB-O 3.25Å; K137-I265 WeakPolarHBondContact O-CA 3.46Å; K137-V266 HydrophobicContact CB-CB 4.08Å; K137-V266 HydrophobicContact CB-CG2 4.14Å; K137-V266 HydrophobicContact CD-CG2 3.97Å; K137-V266 HydrophobicContact CG-CB 4.33Å; K137-V266 HydrophobicContact CG-CG2 4.3Å; K137-V266 PolarHBondContact N-O 3.47Å; K137-V266 PolarHBondContact O-N 3.07Å
138	P	98.1	Very high	98.4	Very high	61 Å²	61	50 Å²	50	40%	0.396	27%	0.268	S	S	.	.	S	Bend	cis	-79	-11.6	4.3	33.6	-38.8	0	0	0	114.2	L258 Q263	P138-L258 HydrophobicContact CG-CD1 3.99Å; P138-L258 HydrophobicContact CG-CD2 3.98Å; P138-Q263 VanDerWaalsContact CG-OE1 3.3Å
139	R	97.6	Very high	98.3	Very high	133 Å²	133	49.1 Å²	49.1	50%	0.502	27%	0.265	S	S	.	.	S	Bend	trans	-143.6	155.5	173.5	66	180	-178.8	87.8	-4.3	109.1	M135 I136 K137 K141	M135-R139 HydrophobicContact CE-CG 4.06Å; M135-R139 VanDerWaalsContact O-O 3.1Å; I136-R139 CarbonylContact O-C 3.25Å; K137-R139 VanDerWaalsContact C-N 3.34Å; R139-K141 PolarHBondContact O-N 3.48Å
140	T	98.3	Very high	98.3	Very high	94 Å²	94	48.1 Å²	48.1	58%	0.577	25%	0.251	S	S	*	.			trans	-65.3	130.1	172	-52.7	0	0	0	0	110.9	E134 M135	E134-T140 HydrophobicContact CG-CG2 4.33Å; E134-T140 WeakPolarHBondContact OE1-CG2 3.49Å; M135-T140 CarbonylContact O-C 3.57Å; M135-T140 WeakPolarHBondContact O-CA 3.19Å
141	K	98.4	Very high	98.4	Very high	51 Å²	51	39 Å²	39	22%	0.222	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	128.3	170.1	168.1	161	155.6	46.2	0	110.1	M135 R139 L143 D251 L254	M135-K141 HydrophobicContact CE-CB 3.98Å; M135-K141 PolarHBondContact N-O 2.95Å; M135-K141 PolarHBondContact O-N 3.09Å; R139-K141 PolarHBondContact O-N 3.48Å; K141-L143 HydrophobicContact CG-CD2 4.2Å; K141-D251 WeakPolarHBondContact CE-OD1 3.49Å; K141-D251 IonicContact NZ-OD1 3.82Å; K141-D251 PolarHBondContact NZ-OD1 3.2Å; K141-D251 IonicContact NZ-OD2 3.58Å; K141-L254 HydrophobicContact CD-CD2 3.9Å
142	S	98.6	Very high	98.4	Very high	91 Å²	91	38.9 Å²	38.9	64%	0.636	21%	0.214	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	133.9	164.3	179.6	0	0	0	0	109.8
143	L	98.7	Very high	98.4	Very high	4 Å²	4	37 Å²	37	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.5	176.6	-53.5	176	0	0	0	107.4	A133 M135 K141 M145 D251 M255 V267	A133-L143 HydrophobicContact CB-CB 4.02Å; A133-L143 HydrophobicContact CB-CD1 4.26Å; A133-L143 PolarHBondContact O-N 2.85Å; M135-L143 HydrophobicContact CB-CD1 4.31Å; M135-L143 HydrophobicContact CB-CD2 4.23Å; M135-L143 HydrophobicContact CB-CG 4.4Å; K141-L143 HydrophobicContact CG-CD2 4.2Å; L143-M145 PolarHBondContact O-N 3.28Å; L143-D251 WeakPolarHBondContact CA-OD2 3.43Å; L143-D251 HydrophobicContact CD2-CB 4.03Å; L143-M255 HydrophobicContact CD1-CE 3.78Å; L143-M255 HydrophobicContact CD2-CE 4.37Å; L143-V267 HydrophobicContact CD1-CG1 4.4Å; L143-V267 HydrophobicContact CD1-CG2 4.14Å
144	A	98.5	Very high	98.4	Very high	25 Å²	25	37.8 Å²	37.8	21%	0.207	21%	0.208	C	C	.	.			trans	-71.5	127.1	170.7	0	0	0	0	0	108	N226 P228 I247 T248 D251	A144-N226 WeakPolarHBondContact CB-OD1 3.33Å; A144-P228 HydrophobicContact CB-CG 4.47Å; A144-I247 WeakPolarHBondContact O-CA 3.28Å; A144-T248 HydrophobicContact CB-CG2 3.54Å; A144-T248 PolarHBondContact O-N 3.39Å; A144-D251 PolarHBondContact N-OD2 3.04Å
145	M	98.4	Very high	98.3	Very high	19 Å²	19	38 Å²	38	9%	0.094	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	155.1	-173.6	66.6	156.3	-74	0	0	111.8	E131 A133 L143 A245 C246 I247 L269 M271	E131-M145 HydrophobicContact CB-CE 3.69Å; E131-M145 HydrophobicContact CB-SD 4.3Å; E131-M145 HydrophobicContact CG-CE 3.82Å; E131-M145 WeakPolarHBondContact OE2-CE 2.94Å; A133-M145 HydrophobicContact CB-CB 4.17Å; A133-M145 HydrophobicContact CB-CG 3.94Å; A133-M145 HydrophobicContact CB-SD 3.5Å; A133-M145 WeakPolarHBondContact CB-SD 3.21Å; A133-M145 PolarHBondContact N-SD 2.85Å; L143-M145 PolarHBondContact O-N 3.28Å; M145-A245 HydrophobicContact CE-CB 3.57Å; M145-C246 CarbonylContact C-O 3.53Å; M145-C246 WeakPolarHBondContact CA-O 3.03Å; M145-C246 WeakPolarHBondContact CB-O 3.28Å; M145-I247 HydrophobicContact CB-CG2 4.15Å; M145-L269 HydrophobicContact CE-CD1 4.02Å; M145-L269 HydrophobicContact SD-CD1 3.71Å; M145-M271 HydrophobicContact CE-CG 4.14Å
146	L	98.6	Very high	98.1	Very high	14 Å²	14	44.3 Å²	44.3	7%	0.073	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.5	163.6	-73.9	174.6	0	0	0	109.2	E131 P228 A245 C246 V309	E131-L146 VanDerWaalsContact OE1-CA 3.31Å; E131-L146 WeakPolarHBondContact OE1-CA 3.44Å; L146-P228 HydrophobicContact CB-CB 4.24Å; L146-P228 HydrophobicContact CB-CG 4.47Å; L146-P228 HydrophobicContact CD1-CB 4.22Å; L146-P228 HydrophobicContact CD1-CG 3.98Å; L146-P228 VanDerWaalsContact CD1-O 3.32Å; L146-P228 WeakPolarHBondContact CD1-O 3.44Å; L146-P228 HydrophobicContact CG-CB 4Å; L146-P228 HydrophobicContact CG-CG 3.72Å; L146-A245 CarbonylContact O-C 3.54Å; L146-A245 VanDerWaalsContact O-CA 3.31Å; L146-A245 WeakPolarHBondContact O-CA 3.31Å; L146-A245 WeakPolarHBondContact O-CB 3.44Å; L146-C246 PolarHBondContact N-O 2.89Å; L146-C246 PolarHBondContact O-N 3.38Å; L146-V309 HydrophobicContact CD1-CB 4.49Å; L146-V309 HydrophobicContact CD1-CG1 3.91Å; L146-V309 HydrophobicContact CD1-CG2 4.24Å; L146-V309 HydrophobicContact CD2-CG1 3.7Å; L146-V309 HydrophobicContact CG-CG1 4.47Å
147	G	98.6	Very high	97.9	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	150.6	168.7	0	0	0	0	0	112	R128 E131 T230	R128-G147 PolarHBondContact NH1-O 2.94Å; E131-G147 PolarHBondContact OE1-N 2.98Å; E131-G147 VanDerWaalsContact OE2-CA 3.22Å; E131-G147 WeakPolarHBondContact OE2-CA 3.31Å; E131-G147 PolarHBondContact OE2-N 3.43Å; G147-T230 PolarHBondContact O-OG1 2.61Å
148	L	98.6	Very high	97.9	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-87.4	142.5	173.2	-63.1	-179.1	0	0	0	110.4	W126 S150 S151 R200 I217 Q233 T244 C246	W126-L148 VanDerWaalsContact CZ2-O 3.25Å; W126-L148 WeakPolarHBondContact CZ2-O 3.37Å; L148-S150 PolarHBondContact O-N 3.1Å; L148-S151 WeakPolarHBondContact O-CB 3.38Å; L148-S151 PolarHBondContact O-N 3.09Å; L148-R200 HydrophobicContact CD1-CG 3.79Å; L148-R200 HydrophobicContact CD2-CG 3.69Å; L148-R200 HydrophobicContact CG-CG 4.35Å; L148-I217 HydrophobicContact CD1-CG1 4.06Å; L148-Q233 HydrophobicContact CB-CB 4.21Å; L148-Q233 HydrophobicContact CB-CG 3.8Å; L148-Q233 HydrophobicContact CD1-CB 4.16Å; L148-Q233 HydrophobicContact CD1-CG 4.36Å; L148-T244 HydrophobicContact CB-CG2 4.11Å; L148-T244 HydrophobicContact CD1-CG2 4.04Å; L148-T244 HydrophobicContact CG-CG2 4.43Å; L148-T244 PolarHBondContact N-O 2.88Å; L148-C246 HydrophobicContact CD2-CB 4.3Å
149	G	97.4	Very high	97.9	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-58.8	139	177.2	0	0	0	0	0	111	S151 G231 Q233	G149-S151 PolarHBondContact O-N 3.34Å; G149-G231 PolarHBondContact N-O 3.08Å; G149-Q233 WeakPolarHBondContact O-CG 3.12Å; G149-Q233 PolarHBondContact O-N 3.17Å
150	S	96.9	Very high	98	Very high	18 Å²	18	42.5 Å²	42.5	13%	0.126	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	-6.4	-170.2	98.3	0	0	0	0	116.2	L148 Q233	L148-S150 PolarHBondContact O-N 3.1Å; S150-Q233 PolarHBondContact OG-NE2 3.11Å; S150-Q233 PolarHBondContact OG-O 3.23Å
151	S	98.4	Very high	98	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-61.9	144.7	179	-168.5	0	0	0	0	112.4	W126 L148 G149 Y235 T244 A273	W126-S151 PolarHBondContact NE1-O 2.89Å; L148-S151 WeakPolarHBondContact O-CB 3.38Å; L148-S151 PolarHBondContact O-N 3.09Å; G149-S151 PolarHBondContact O-N 3.34Å; S151-Y235 PolarHBondContact OG-OH 2.92Å; S151-T244 VanDerWaalsContact OG-CG2 3.28Å; S151-T244 WeakPolarHBondContact OG-CG2 3.49Å; S151-T244 PolarHBondContact OG-N 2.97Å; S151-T244 PolarHBondContact OG-O 3.12Å; S151-A273 WeakPolarHBondContact O-CB 3.42Å
152	V	98.6	Very high	98	Very high	41 Å²	41	39.3 Å²	39.3	25%	0.248	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-75.2	146.7	169.4	-57.7	0	0	0	0	111	Y235 R241 P243	V152-Y235 HydrophobicContact CG1-CE2 4.03Å; V152-Y235 PolarHBondContact N-OH 2.86Å; V152-Y235 VanDerWaalsContact N-OH 3.08Å; V152-R241 HydrophobicContact CG1-CB 3.83Å; V152-R241 HydrophobicContact CG2-CB 4.25Å; V152-P243 HydrophobicContact CG2-CG 4.31Å; V152-P243 WeakPolarHBondContact O-CA 3.49Å
153	G	98.4	Very high	98	Very high	22 Å²	22	35.7 Å²	35.7	23%	0.227	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-65.4	162.5	170.3	0	0	0	0	0	113.1	M271 A273	G153-M271 CarbonylContact C-O 3.56Å; G153-M271 WeakPolarHBondContact CA-O 3.24Å; G153-A273 VanDerWaalsContact CA-O 3.32Å; G153-A273 WeakPolarHBondContact CA-O 3.36Å; G153-A273 PolarHBondContact N-O 2.92Å
154	T	98.8	Very high	98.1	Very high	20 Å²	20	35.6 Å²	35.6	12%	0.123	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-72.5	162.3	168.7	56.6	0	0	0	0	110.5	V159 P243 L269 M271	T154-V159 HydrophobicContact CG2-CG2 3.99Å; T154-P243 HydrophobicContact CG2-CB 3.95Å; T154-P243 HydrophobicContact CG2-CG 3.84Å; T154-L269 HydrophobicContact CG2-CD2 4.41Å; T154-L269 HydrophobicContact CG2-CG 4.1Å; T154-M271 HydrophobicContact CG2-CB 4.08Å; T154-M271 HydrophobicContact CG2-CG 4.36Å; T154-M271 PolarHBondContact N-O 3.18Å; T154-M271 PolarHBondContact OG1-N 2.91Å; T154-M271 PolarHBondContact OG1-O 2.99Å
155	P	97.4	Very high	98.1	Very high	57 Å²	57	34.6 Å²	34.6	37%	0.37	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-52.3	158	160.7	-24.4	35.6	0	0	0	111.8	E157 G158	P155-E157 HydrophobicContact CB-CG 4.4Å; P155-E157 WeakPolarHBondContact CB-OE2 3.43Å; P155-E157 PolarHBondContact O-N 3.31Å; P155-E157 VanDerWaalsContact O-N 3.15Å; P155-G158 WeakPolarHBondContact O-CA 3.46Å; P155-G158 PolarHBondContact O-N 3.36Å
156	P	94.3	Very high	98.1	Very high	133 Å²	133	33.7 Å²	33.7	86%	0.864	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-33.1	-178.9	-27.8	36	0	0	0	114.7	G158	P156-G158 VanDerWaalsContact C-N 3.26Å; P156-G158 PolarHBondContact O-N 3Å
157	E	95.4	Very high	98.1	Very high	155 Å²	155	35.9 Å²	35.9	72%	0.724	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.2	176.4	66.4	-85.2	-160.6	0	0	114.3	P155	P155-E157 HydrophobicContact CB-CG 4.4Å; P155-E157 WeakPolarHBondContact CB-OE2 3.43Å; P155-E157 PolarHBondContact O-N 3.31Å; P155-E157 VanDerWaalsContact O-N 3.15Å
158	G	98	Very high	98.1	Very high	8 Å²	8	37 Å²	37	8%	0.082	21%	0.211	C	C	.	.			trans	79.7	-176.1	-172.2	0	0	0	0	0	113.3	P155 P156 L269	P155-G158 WeakPolarHBondContact O-CA 3.46Å; P155-G158 PolarHBondContact O-N 3.36Å; P156-G158 VanDerWaalsContact C-N 3.26Å; P156-G158 PolarHBondContact O-N 3Å; G158-L269 CarbonylContact C-O 3.58Å; G158-L269 WeakPolarHBondContact CA-O 3.19Å
159	V	98.7	Very high	98.1	Very high	19 Å²	19	38.2 Å²	38.2	12%	0.115	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	112.2	172	176.8	0	0	0	0	108.1	T154 A161 I183 V213 R268 L269	T154-V159 HydrophobicContact CG2-CG2 3.99Å; V159-A161 HydrophobicContact CG1-CB 4.48Å; V159-I183 HydrophobicContact CG1-CD1 4.27Å; V159-I183 HydrophobicContact CG1-CG1 4.27Å; V159-V213 HydrophobicContact CG1-CB 4.39Å; V159-V213 HydrophobicContact CG1-CG2 3.78Å; V159-R268 CarbonylContact O-C 3.54Å; V159-R268 WeakPolarHBondContact O-CA 3.23Å; V159-L269 PolarHBondContact N-O 3.39Å; V159-L269 PolarHBondContact O-N 3.39Å
160	E	98.8	Very high	98.1	Very high	121 Å²	121	43 Å²	43	57%	0.565	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	114.8	169	-173.5	178.1	129.5	0	0	109.6	V266 V267 R268	E160-V266 HydrophobicContact CG-CG1 3.77Å; E160-V267 WeakPolarHBondContact CA-O 3.32Å; E160-R268 HydrophobicContact CB-CB 4.33Å; E160-R268 HydrophobicContact CB-CG 4.48Å; E160-R268 HydrophobicContact CG-CB 4.3Å
161	A	98.9	Very high	98.2	Very high	13 Å²	13	43.4 Å²	43.4	11%	0.107	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	162.1	-177.6	0	0	0	0	0	113	V159 I183 V213 V266 V267	V159-A161 HydrophobicContact CG1-CB 4.48Å; A161-I183 HydrophobicContact CB-CD1 4.18Å; A161-I183 HydrophobicContact CB-CG1 4.07Å; A161-V213 HydrophobicContact CB-CG2 4.03Å; A161-V266 WeakPolarHBondContact O-CA 3.34Å; A161-V267 PolarHBondContact N-O 3.46Å; A161-V267 PolarHBondContact O-N 3.01Å
162	E	98.9	Very high	98.2	Very high	65 Å²	65	43.5 Å²	43.5	30%	0.304	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	147.1	167.5	-72.7	-176	-170.6	0	0	110.8	R182 I183 K264 I265 V266	E162-R182 HydrophobicContact CB-CG 4.19Å; E162-R182 CarbonylContact O-C 3.55Å; E162-R182 VanDerWaalsContact O-CA 3.27Å; E162-R182 WeakPolarHBondContact O-CA 3.45Å; E162-R182 WeakPolarHBondContact O-CB 3.04Å; E162-R182 IonicContact OE2-CZ 2.7Å; E162-R182 IonicContact OE2-NE 3.44Å; E162-R182 PolarHBondContact OE2-NE 2.85Å; E162-R182 IonicContact OE2-NH2 2.75Å; E162-R182 PolarHBondContact OE2-NH2 2.81Å; E162-I183 PolarHBondContact O-N 2.94Å; E162-K264 WeakPolarHBondContact OE1-CE 3.23Å; E162-K264 IonicContact OE1-NZ 2.6Å; E162-K264 PolarHBondContact OE1-NZ 3.37Å; E162-I265 WeakPolarHBondContact CA-O 3.29Å; E162-V266 HydrophobicContact CG-CG2 4.2Å
163	V	98.9	Very high	98.2	Very high	16 Å²	16	47.2 Å²	47.2	10%	0.097	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.1	179.2	171.9	0	0	0	0	111.1	V165 I183 V185 I265 V267	V163-V165 HydrophobicContact CG1-CG2 3.69Å; V163-I183 CarbonylContact C-O 3.57Å; V163-I183 VanDerWaalsContact CA-O 3.28Å; V163-I183 WeakPolarHBondContact CA-O 3.25Å; V163-I183 HydrophobicContact CG2-CB 4.24Å; V163-I183 HydrophobicContact CG2-CG2 4.45Å; V163-V185 HydrophobicContact CG1-CB 4.03Å; V163-V185 HydrophobicContact CG1-CG2 3.39Å; V163-I265 HydrophobicContact CB-CB 3.98Å; V163-I265 HydrophobicContact CB-CG2 3.81Å; V163-I265 HydrophobicContact CG1-CG2 4.44Å; V163-I265 HydrophobicContact CG2-CB 4.43Å; V163-I265 HydrophobicContact CG2-CG2 3.79Å; V163-I265 PolarHBondContact N-O 3.24Å; V163-V267 HydrophobicContact CG2-CB 3.93Å; V163-V267 HydrophobicContact CG2-CG2 3.59Å
164	L	98.9	Very high	98.2	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	111.9	162.2	172.8	61.2	0	0	0	108.5	V166 L172 E178 A179 R182 I183 V184 V185	L164-V166 HydrophobicContact CD1-CG1 4.29Å; L164-V166 HydrophobicContact CD2-CG1 4.36Å; L164-V166 HydrophobicContact CG-CG1 4.06Å; L164-L172 HydrophobicContact CD2-CD1 4.27Å; L164-E178 HydrophobicContact CD1-CB 4.29Å; L164-E178 HydrophobicContact CD2-CB 4.19Å; L164-A179 HydrophobicContact CD2-CB 3.65Å; L164-R182 HydrophobicContact CB-CB 4.39Å; L164-I183 PolarHBondContact N-O 2.76Å; L164-V184 HydrophobicContact CB-CG2 4.41Å; L164-V184 HydrophobicContact CD2-CG2 4.35Å; L164-V184 CarbonylContact O-C 3.53Å; L164-V184 WeakPolarHBondContact O-CA 3.42Å; L164-V185 PolarHBondContact O-N 2.84Å
165	V	98.9	Very high	98.2	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.6	173.6	-164	0	0	0	0	109.4	V163 R175 V185 N187 M255 W256 A259 I265	V163-V165 HydrophobicContact CG1-CG2 3.69Å; V165-R175 PolarHBondContact O-NH1 2.95Å; V165-V185 WeakPolarHBondContact CA-O 3.27Å; V165-V185 HydrophobicContact CB-CB 4.45Å; V165-V185 HydrophobicContact CG1-CB 4.16Å; V165-V185 HydrophobicContact CG1-CG1 4.05Å; V165-V185 HydrophobicContact CG2-CB 4.21Å; V165-N187 HydrophobicContact CG1-CB 4.01Å; V165-M255 HydrophobicContact CG2-CB 4.03Å; V165-W256 HydrophobicContact CB-CE3 4.27Å; V165-W256 HydrophobicContact CG1-CB 4.3Å; V165-W256 HydrophobicContact CG1-CE3 3.75Å; V165-A259 HydrophobicContact CB-CB 4.16Å; V165-A259 HydrophobicContact CG2-CB 3.91Å; V165-I265 HydrophobicContact CG2-CD1 4.21Å
166	V	98.8	Very high	98.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155.6	175	-65.7	0	0	0	0	109.4	L164 E171 L172 V184 V185 F186 N187	L164-V166 HydrophobicContact CD1-CG1 4.29Å; L164-V166 HydrophobicContact CD2-CG1 4.36Å; L164-V166 HydrophobicContact CG-CG1 4.06Å; V166-E171 WeakPolarHBondContact CA-OE2 3.35Å; V166-E171 HydrophobicContact CB-CB 4.28Å; V166-E171 HydrophobicContact CB-CG 4.33Å; V166-E171 HydrophobicContact CG1-CG 4.21Å; V166-L172 HydrophobicContact CG2-CB 4.3Å; V166-V184 HydrophobicContact CG2-CG1 3.8Å; V166-V185 PolarHBondContact N-O 2.79Å; V166-V185 VanDerWaalsContact O-O 3.12Å; V166-F186 HydrophobicContact CG2-CD1 3.64Å; V166-F186 HydrophobicContact CG2-CE1 3.83Å; V166-F186 HydrophobicContact CG2-CG 4.38Å; V166-F186 CarbonylContact O-C 3.59Å; V166-F186 WeakPolarHBondContact O-CA 3.2Å; V166-N187 PolarHBondContact O-N 2.85Å
167	Q	98.1	Very high	98.4	Very high	60 Å²	60	54.6 Å²	54.6	28%	0.28	27%	0.269	S	S	.	.	S	Bend	trans	-100.7	-22.3	176.6	-56.6	-166.4	-81.9	0	0	112.5	E171 Q188 W256	Q167-E171 PolarHBondContact N-OE2 2.94Å; Q167-Q188 WeakPolarHBondContact O-CA 3.27Å; Q167-Q188 WeakPolarHBondContact O-CB 3.46Å; Q167-Q188 PolarHBondContact O-OE1 2.74Å; Q167-W256 VanDerWaalsContact CD-CZ2 3.46Å; Q167-W256 HydrophobicContact CG-CD2 4.45Å; Q167-W256 HydrophobicContact CG-CE3 4.11Å; Q167-W256 HydrophobicContact CG-CH2 3.6Å; Q167-W256 HydrophobicContact CG-CZ2 4.01Å; Q167-W256 HydrophobicContact CG-CZ3 3.68Å
168	S	98.6	Very high	98.6	Very high	23 Å²	23	50.8 Å²	50.8	16%	0.161	25%	0.252	C	S	.	.	S	Bend	trans	-141.3	164.4	179.8	93.4	0	0	0	0	114.9	E170 E171 L172 Y199	S168-E170 VanDerWaalsContact C-N 3.28Å; S168-E170 VanDerWaalsContact CB-OE2 3.31Å; S168-E170 WeakPolarHBondContact CB-OE2 3.22Å; S168-E170 PolarHBondContact O-N 3.09Å; S168-E170 PolarHBondContact OG-N 3.02Å; S168-E170 PolarHBondContact OG-OE2 3.17Å; S168-E171 PolarHBondContact O-N 3.38Å; S168-E171 PolarHBondContact OG-N 3.47Å; S168-E171 VanDerWaalsContact OG-N 3.07Å; S168-L172 PolarHBondContact O-N 3.03Å; S168-Y199 VanDerWaalsContact CA-OH 3.25Å; S168-Y199 WeakPolarHBondContact CA-OH 3.48Å; S168-Y199 WeakPolarHBondContact CB-OH 3.5Å
169	F	98.6	Very high	98.6	Very high	26 Å²	26	50.4 Å²	50.4	11%	0.114	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-35.8	171.1	-65	-35.5	0	0	0	112.2	L172 K173 F186 A198 Y199 F202 E206	F169-L172 WeakPolarHBondContact O-CB 3.39Å; F169-L172 PolarHBondContact O-N 3.37Å; F169-K173 VanDerWaalsContact O-CG 3.3Å; F169-K173 WeakPolarHBondContact O-CG 3.19Å; F169-K173 PolarHBondContact O-N 3.39Å; F169-F186 HydrophobicContact CD1-CD1 4.29Å; F169-F186 AromaticContact CD1-CE1 3.55Å; F169-F186 HydrophobicContact CD1-CE1 3.55Å; F169-F186 AromaticContact CD1-CZ 3.98Å; F169-F186 HydrophobicContact CD1-CZ 3.98Å; F169-F186 HydrophobicContact CE1-CD1 4.27Å; F169-F186 AromaticContact CE1-CE1 3.72Å; F169-F186 HydrophobicContact CE1-CE1 3.72Å; F169-F186 AromaticContact CE1-CZ 3.87Å; F169-F186 HydrophobicContact CE1-CZ 3.87Å; F169-A198 HydrophobicContact CE2-CB 4.39Å; F169-Y199 HydrophobicContact CD1-CD1 4.11Å; F169-Y199 AromaticContact CD1-CE1 3.87Å; F169-Y199 HydrophobicContact CD1-CE1 3.87Å; F169-Y199 HydrophobicContact CD2-CE1 4.38Å; F169-Y199 AromaticContact CE1-CD1 3.63Å; F169-Y199 HydrophobicContact CE1-CD1 3.63Å; F169-Y199 AromaticContact CE1-CE1 3.86Å; F169-Y199 HydrophobicContact CE1-CE1 3.86Å; F169-Y199 HydrophobicContact CE1-CG 4.37Å; F169-Y199 HydrophobicContact CE2-CD1 4.45Å; F169-Y199 HydrophobicContact CE2-CE1 4.41Å; F169-Y199 HydrophobicContact CG-CE1 4.13Å; F169-Y199 AromaticContact CZ-CD1 3.85Å; F169-Y199 HydrophobicContact CZ-CD1 3.85Å; F169-Y199 HydrophobicContact CZ-CE1 4.17Å; F169-Y199 HydrophobicContact CZ-CG 4.17Å; F169-F202 HydrophobicContact CZ-CB 4.35Å; F169-E206 HydrophobicContact CD1-CB 3.89Å; F169-E206 HydrophobicContact CD1-CG 3.89Å; F169-E206 HydrophobicContact CD2-CG 4.44Å; F169-E206 HydrophobicContact CE1-CB 3.99Å; F169-E206 HydrophobicContact CE1-CG 3.93Å; F169-E206 HydrophobicContact CE2-CG 4.44Å; F169-E206 HydrophobicContact CG-CG 4.16Å; F169-E206 HydrophobicContact CZ-CG 4.19Å
170	E	98.6	Very high	98.6	Very high	102 Å²	102	54.3 Å²	54.3	48%	0.477	27%	0.272	S	S	.	.	H	α-helix	trans	-66.5	-39.1	175	-60.4	67.8	-149.3	0	0	111.1	S168 K173 R174	S168-E170 VanDerWaalsContact C-N 3.28Å; S168-E170 VanDerWaalsContact CB-OE2 3.31Å; S168-E170 WeakPolarHBondContact CB-OE2 3.22Å; S168-E170 PolarHBondContact O-N 3.09Å; S168-E170 PolarHBondContact OG-N 3.02Å; S168-E170 PolarHBondContact OG-OE2 3.17Å; E170-K173 PolarHBondContact O-N 3.49Å; E170-R174 WeakPolarHBondContact O-CG 3.31Å; E170-R174 PolarHBondContact O-N 3.03Å; E170-R174 PolarHBondContact O-NH1 3.31Å
171	E	98.6	Very high	98.6	Very high	26 Å²	26	50.5 Å²	50.5	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-45.2	173.9	-165.9	-165.2	156.7	0	0	111.4	V166 Q167 S168 K173 R174 R175	V166-E171 WeakPolarHBondContact CA-OE2 3.35Å; V166-E171 HydrophobicContact CB-CB 4.28Å; V166-E171 HydrophobicContact CB-CG 4.33Å; V166-E171 HydrophobicContact CG1-CG 4.21Å; Q167-E171 PolarHBondContact N-OE2 2.94Å; S168-E171 PolarHBondContact O-N 3.38Å; S168-E171 PolarHBondContact OG-N 3.47Å; S168-E171 VanDerWaalsContact OG-N 3.07Å; E171-K173 VanDerWaalsContact C-N 3.3Å; E171-K173 PolarHBondContact O-N 3.36Å; E171-R174 PolarHBondContact O-N 3.38Å; E171-R175 WeakPolarHBondContact O-CB 3.44Å; E171-R175 WeakPolarHBondContact O-CG 3.02Å; E171-R175 PolarHBondContact O-N 3.12Å; E171-R175 WeakPolarHBondContact OE1-CD 3.47Å; E171-R175 IonicContact OE1-CZ 2.71Å; E171-R175 IonicContact OE1-NH1 2.66Å; E171-R175 PolarHBondContact OE1-NH1 2.84Å
172	L	98.8	Very high	98.6	Very high	1 Å²	1	53 Å²	53	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-55.9	-45.9	174.1	-179.6	67.1	0	0	0	111.8	L164 V166 S168 F169 R174 R175 A176 A179 V184 F186 E206 A207 V210	L164-L172 HydrophobicContact CD2-CD1 4.27Å; V166-L172 HydrophobicContact CG2-CB 4.3Å; S168-L172 PolarHBondContact O-N 3.03Å; F169-L172 WeakPolarHBondContact O-CB 3.39Å; F169-L172 PolarHBondContact O-N 3.37Å; L172-R174 PolarHBondContact O-N 2.89Å; L172-R175 CarbonylContact O-C 3.57Å; L172-R175 VanDerWaalsContact O-C 3.25Å; L172-R175 PolarHBondContact O-N 3.22Å; L172-R175 VanDerWaalsContact O-N 3.14Å; L172-A176 WeakPolarHBondContact O-CA 3.41Å; L172-A176 PolarHBondContact O-N 2.69Å; L172-A179 HydrophobicContact CD1-CB 4.19Å; L172-V184 HydrophobicContact CD1-CG1 4.03Å; L172-V184 HydrophobicContact CD1-CG2 4.01Å; L172-F186 HydrophobicContact CB-CE1 4.42Å; L172-F186 HydrophobicContact CD2-CE1 3.89Å; L172-F186 HydrophobicContact CD2-CZ 3.63Å; L172-E206 HydrophobicContact CD2-CB 4.24Å; L172-A207 HydrophobicContact CD2-CB 4.36Å; L172-V210 HydrophobicContact CD1-CG2 3.82Å; L172-V210 HydrophobicContact CD2-CG2 4.24Å; L172-V210 HydrophobicContact CG-CG2 3.97Å
173	K	98.4	Very high	98.6	Very high	120 Å²	120	49.9 Å²	49.9	52%	0.522	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-43.5	177.2	-74.5	168.4	-176.5	167.7	0	111.8	F169 E170 E171 R175 A176 E206	F169-K173 VanDerWaalsContact O-CG 3.3Å; F169-K173 WeakPolarHBondContact O-CG 3.19Å; F169-K173 PolarHBondContact O-N 3.39Å; E170-K173 PolarHBondContact O-N 3.49Å; E171-K173 VanDerWaalsContact C-N 3.3Å; E171-K173 PolarHBondContact O-N 3.36Å; K173-R175 VanDerWaalsContact C-N 3.27Å; K173-R175 PolarHBondContact O-N 2.91Å; K173-A176 WeakPolarHBondContact O-CB 3.25Å; K173-A176 PolarHBondContact O-N 3.34Å; K173-E206 WeakPolarHBondContact CE-OE2 3.31Å; K173-E206 IonicContact NZ-OE2 2.67Å; K173-E206 PolarHBondContact NZ-OE2 2.71Å
174	R	98.6	Very high	98.6	Very high	178 Å²	178	49.1 Å²	49.1	67%	0.672	25%	0.253	S	S	*	.	H	α-helix	trans	-64.4	-31.7	175.7	-71.9	-171.1	-56.5	-90.1	2.6	112.8	E170 E171 L172	E170-R174 WeakPolarHBondContact O-CG 3.31Å; E170-R174 PolarHBondContact O-N 3.03Å; E170-R174 PolarHBondContact O-NH1 3.31Å; E171-R174 PolarHBondContact O-N 3.38Å; L172-R174 PolarHBondContact O-N 2.89Å
175	R	98.4	Very high	98.6	Very high	66 Å²	66	49 Å²	49	25%	0.249	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	23.1	-176.6	-60.9	177.2	68.1	-160.7	-4.5	112.6	V165 E171 L172 K173 S177 E178	V165-R175 PolarHBondContact O-NH1 2.95Å; E171-R175 WeakPolarHBondContact O-CB 3.44Å; E171-R175 WeakPolarHBondContact O-CG 3.02Å; E171-R175 PolarHBondContact O-N 3.12Å; E171-R175 WeakPolarHBondContact OE1-CD 3.47Å; E171-R175 IonicContact OE1-CZ 2.71Å; E171-R175 IonicContact OE1-NH1 2.66Å; E171-R175 PolarHBondContact OE1-NH1 2.84Å; L172-R175 CarbonylContact O-C 3.57Å; L172-R175 VanDerWaalsContact O-C 3.25Å; L172-R175 PolarHBondContact O-N 3.22Å; L172-R175 VanDerWaalsContact O-N 3.14Å; K173-R175 VanDerWaalsContact C-N 3.27Å; K173-R175 PolarHBondContact O-N 2.91Å; R175-S177 VanDerWaalsContact C-N 3.25Å; R175-S177 PolarHBondContact O-N 2.99Å; R175-S177 VanDerWaalsContact O-N 3.17Å; R175-E178 WeakPolarHBondContact CG-OE1 3.29Å; R175-E178 IonicContact CZ-OE1 3.21Å; R175-E178 IonicContact CZ-OE2 2.72Å; R175-E178 IonicContact NE-OE1 3.33Å; R175-E178 PolarHBondContact NE-OE1 3.17Å; R175-E178 IonicContact NE-OE2 3.9Å; R175-E178 IonicContact NH2-OE1 3.37Å; R175-E178 IonicContact NH2-OE2 3.6Å; R175-E178 PolarHBondContact NH2-OE2 2.82Å; R175-E178 WeakPolarHBondContact O-CB 3.48Å; R175-E178 PolarHBondContact O-N 3.36Å
176	A	98.4	Very high	98.6	Very high	31 Å²	31	48.9 Å²	48.9	26%	0.256	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-56.1	-38.1	-172.8	0	0	0	0	0	113.2	L172 K173 E178 A179 V210	L172-A176 WeakPolarHBondContact O-CA 3.41Å; L172-A176 PolarHBondContact O-N 2.69Å; K173-A176 WeakPolarHBondContact O-CB 3.25Å; K173-A176 PolarHBondContact O-N 3.34Å; A176-E178 PolarHBondContact O-N 3.07Å; A176-A179 WeakPolarHBondContact O-CB 3.24Å; A176-A179 PolarHBondContact O-N 2.98Å; A176-A179 VanDerWaalsContact O-N 3.12Å; A176-V210 HydrophobicContact CB-CB 3.96Å; A176-V210 HydrophobicContact CB-CG1 3.57Å
177	S	98.1	Very high	98.6	Very high	111 Å²	111	49 Å²	49	78%	0.776	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-65.2	-19.1	177.8	55.8	0	0	0	0	113.9	R175	R175-S177 VanDerWaalsContact C-N 3.25Å; R175-S177 PolarHBondContact O-N 2.99Å; R175-S177 VanDerWaalsContact O-N 3.17Å
178	E	98.4	Very high	98.6	Very high	75 Å²	75	48.1 Å²	48.1	35%	0.35	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-87.8	-12.6	176.7	-61.9	179.2	-117.1	0	0	113.1	L164 R175 A176 R182	L164-E178 HydrophobicContact CD1-CB 4.29Å; L164-E178 HydrophobicContact CD2-CB 4.19Å; R175-E178 WeakPolarHBondContact CG-OE1 3.29Å; R175-E178 IonicContact CZ-OE1 3.21Å; R175-E178 IonicContact CZ-OE2 2.72Å; R175-E178 IonicContact NE-OE1 3.33Å; R175-E178 PolarHBondContact NE-OE1 3.17Å; R175-E178 IonicContact NE-OE2 3.9Å; R175-E178 IonicContact NH2-OE1 3.37Å; R175-E178 IonicContact NH2-OE2 3.6Å; R175-E178 PolarHBondContact NH2-OE2 2.82Å; R175-E178 WeakPolarHBondContact O-CB 3.48Å; R175-E178 PolarHBondContact O-N 3.36Å; A176-E178 PolarHBondContact O-N 3.07Å; E178-R182 WeakPolarHBondContact O-CD 3.3Å; E178-R182 PolarHBondContact O-NE 2.85Å; E178-R182 PolarHBondContact O-NH1 3.37Å
179	A	98.4	Very high	98.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-21.3	-170.3	0	0	0	0	0	113.8	L164 L172 A176 G181 R182 V184 V210 A212	L164-A179 HydrophobicContact CD2-CB 3.65Å; L172-A179 HydrophobicContact CD1-CB 4.19Å; A176-A179 WeakPolarHBondContact O-CB 3.24Å; A176-A179 PolarHBondContact O-N 2.98Å; A176-A179 VanDerWaalsContact O-N 3.12Å; A179-G181 PolarHBondContact O-N 2.99Å; A179-R182 WeakPolarHBondContact O-CB 3.35Å; A179-R182 PolarHBondContact O-N 2.82Å; A179-V184 HydrophobicContact CB-CG2 4.28Å; A179-V210 HydrophobicContact CB-CB 4.21Å; A179-V210 HydrophobicContact CB-CG2 3.54Å; A179-A212 WeakPolarHBondContact O-CA 3.46Å
180	T	98.6	Very high	98.4	Very high	101 Å²	101	50.4 Å²	50.4	62%	0.62	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	123.2	-174.9	-59	0	0	0	0	111.6	R182 V210 G211	T180-R182 PolarHBondContact O-N 3.04Å; T180-V210 PolarHBondContact OG1-O 3.37Å; T180-G211 WeakPolarHBondContact CA-O 3.26Å
181	G	98.7	Very high	98.3	Very high	42 Å²	42	49.2 Å²	49.2	43%	0.433	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	7.2	-179.8	0	0	0	0	0	114.7	A179 G211	A179-G181 PolarHBondContact O-N 2.99Å; G181-G211 PolarHBondContact N-O 3.38Å
182	R	98.9	Very high	98.1	Very high	65 Å²	65	50.7 Å²	50.7	25%	0.245	27%	0.269	C	S	.	.	S	Bend	trans	-106.1	157.8	-178.4	-65.2	-159	177.2	150.5	-13.9	112.8	E162 L164 E178 A179 T180 A212 V213	E162-R182 HydrophobicContact CB-CG 4.19Å; E162-R182 CarbonylContact O-C 3.55Å; E162-R182 VanDerWaalsContact O-CA 3.27Å; E162-R182 WeakPolarHBondContact O-CA 3.45Å; E162-R182 WeakPolarHBondContact O-CB 3.04Å; E162-R182 IonicContact OE2-CZ 2.7Å; E162-R182 IonicContact OE2-NE 3.44Å; E162-R182 PolarHBondContact OE2-NE 2.85Å; E162-R182 IonicContact OE2-NH2 2.75Å; E162-R182 PolarHBondContact OE2-NH2 2.81Å; L164-R182 HydrophobicContact CB-CB 4.39Å; E178-R182 WeakPolarHBondContact O-CD 3.3Å; E178-R182 PolarHBondContact O-NE 2.85Å; E178-R182 PolarHBondContact O-NH1 3.37Å; A179-R182 WeakPolarHBondContact O-CB 3.35Å; A179-R182 PolarHBondContact O-N 2.82Å; T180-R182 PolarHBondContact O-N 3.04Å; R182-A212 WeakPolarHBondContact O-CA 3.23Å; R182-V213 WeakPolarHBondContact O-CG2 3.36Å; R182-V213 PolarHBondContact O-N 2.91Å
183	I	98.9	Very high	97.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.7	162.6	-67.6	162.1	0	0	0	107.3	V159 A161 E162 V163 L164 V213 A214 L216 V267	V159-I183 HydrophobicContact CG1-CD1 4.27Å; V159-I183 HydrophobicContact CG1-CG1 4.27Å; A161-I183 HydrophobicContact CB-CD1 4.18Å; A161-I183 HydrophobicContact CB-CG1 4.07Å; E162-I183 PolarHBondContact O-N 2.94Å; V163-I183 CarbonylContact C-O 3.57Å; V163-I183 VanDerWaalsContact CA-O 3.28Å; V163-I183 WeakPolarHBondContact CA-O 3.25Å; V163-I183 HydrophobicContact CG2-CB 4.24Å; V163-I183 HydrophobicContact CG2-CG2 4.45Å; L164-I183 PolarHBondContact N-O 2.76Å; I183-V213 HydrophobicContact CG1-CG2 4.42Å; I183-A214 WeakPolarHBondContact CA-O 3.37Å; I183-A214 HydrophobicContact CG1-CB 4.2Å; I183-L216 HydrophobicContact CG2-CD1 4.25Å; I183-L216 HydrophobicContact CG2-CG 4.05Å; I183-V267 HydrophobicContact CD1-CB 3.96Å; I183-V267 HydrophobicContact CD1-CG1 4.13Å; I183-V267 WeakPolarHBondContact CD1-O 3.38Å
184	V	98.9	Very high	97.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.1	174.9	173.8	0	0	0	0	109.2	L164 V166 L172 A179 F186 A207 A212 A214 T215 L216	L164-V184 HydrophobicContact CB-CG2 4.41Å; L164-V184 HydrophobicContact CD2-CG2 4.35Å; L164-V184 CarbonylContact O-C 3.53Å; L164-V184 WeakPolarHBondContact O-CA 3.42Å; V166-V184 HydrophobicContact CG2-CG1 3.8Å; L172-V184 HydrophobicContact CD1-CG1 4.03Å; L172-V184 HydrophobicContact CD1-CG2 4.01Å; A179-V184 HydrophobicContact CB-CG2 4.28Å; V184-F186 HydrophobicContact CB-CE2 4.48Å; V184-F186 HydrophobicContact CG1-CD1 4.48Å; V184-F186 HydrophobicContact CG1-CD2 3.97Å; V184-F186 HydrophobicContact CG1-CE1 4.2Å; V184-F186 HydrophobicContact CG1-CE2 3.7Å; V184-F186 HydrophobicContact CG1-CG 4.4Å; V184-F186 HydrophobicContact CG1-CZ 3.85Å; V184-A207 HydrophobicContact CB-CB 4.05Å; V184-A207 HydrophobicContact CG1-CB 4.42Å; V184-A207 HydrophobicContact CG2-CB 4.11Å; V184-A212 HydrophobicContact CB-CB 4.44Å; V184-A212 HydrophobicContact CG2-CB 3.64Å; V184-A214 PolarHBondContact N-O 2.75Å; V184-T215 HydrophobicContact CB-CG2 4.18Å; V184-T215 CarbonylContact O-C 3.56Å; V184-T215 VanDerWaalsContact O-CA 3.25Å; V184-T215 WeakPolarHBondContact O-CA 3.39Å; V184-L216 PolarHBondContact O-N 2.62Å
185	V	98.9	Very high	97.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.7	169.7	174.4	0	0	0	0	108.6	V163 L164 V165 V166 L216 I247 M255	V163-V185 HydrophobicContact CG1-CB 4.03Å; V163-V185 HydrophobicContact CG1-CG2 3.39Å; L164-V185 PolarHBondContact O-N 2.84Å; V165-V185 WeakPolarHBondContact CA-O 3.27Å; V165-V185 HydrophobicContact CB-CB 4.45Å; V165-V185 HydrophobicContact CG1-CB 4.16Å; V165-V185 HydrophobicContact CG1-CG1 4.05Å; V165-V185 HydrophobicContact CG2-CB 4.21Å; V166-V185 PolarHBondContact N-O 2.79Å; V166-V185 VanDerWaalsContact O-O 3.12Å; V185-L216 CarbonylContact C-O 3.55Å; V185-L216 VanDerWaalsContact CA-O 3.23Å; V185-L216 WeakPolarHBondContact CA-O 3.41Å; V185-L216 HydrophobicContact CG2-CB 4.01Å; V185-L216 HydrophobicContact CG2-CD1 4.27Å; V185-I247 HydrophobicContact CG1-CD1 4.27Å; V185-M255 HydrophobicContact CG2-CE 4.35Å; V185-M255 HydrophobicContact CG2-SD 3.91Å
186	F	98.9	Very high	97.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	100.3	171.4	-69.2	-81.6	0	0	0	109.8	V166 F169 L172 V184 Q188 Y199 G203 A207 T215 L216 I217 R218	V166-F186 HydrophobicContact CG2-CD1 3.64Å; V166-F186 HydrophobicContact CG2-CE1 3.83Å; V166-F186 HydrophobicContact CG2-CG 4.38Å; V166-F186 CarbonylContact O-C 3.59Å; V166-F186 WeakPolarHBondContact O-CA 3.2Å; F169-F186 HydrophobicContact CD1-CD1 4.29Å; F169-F186 AromaticContact CD1-CE1 3.55Å; F169-F186 HydrophobicContact CD1-CE1 3.55Å; F169-F186 AromaticContact CD1-CZ 3.98Å; F169-F186 HydrophobicContact CD1-CZ 3.98Å; F169-F186 HydrophobicContact CE1-CD1 4.27Å; F169-F186 AromaticContact CE1-CE1 3.72Å; F169-F186 HydrophobicContact CE1-CE1 3.72Å; F169-F186 AromaticContact CE1-CZ 3.87Å; F169-F186 HydrophobicContact CE1-CZ 3.87Å; L172-F186 HydrophobicContact CB-CE1 4.42Å; L172-F186 HydrophobicContact CD2-CE1 3.89Å; L172-F186 HydrophobicContact CD2-CZ 3.63Å; V184-F186 HydrophobicContact CB-CE2 4.48Å; V184-F186 HydrophobicContact CG1-CD1 4.48Å; V184-F186 HydrophobicContact CG1-CD2 3.97Å; V184-F186 HydrophobicContact CG1-CE1 4.2Å; V184-F186 HydrophobicContact CG1-CE2 3.7Å; V184-F186 HydrophobicContact CG1-CG 4.4Å; V184-F186 HydrophobicContact CG1-CZ 3.85Å; F186-Q188 VanDerWaalsContact C-N 3.31Å; F186-Q188 PolarHBondContact O-N 3.46Å; F186-Y199 HydrophobicContact CB-CD1 3.98Å; F186-Y199 AromaticContact CD1-CD1 3.68Å; F186-Y199 HydrophobicContact CD1-CD1 3.68Å; F186-Y199 AromaticContact CD1-CE1 3.93Å; F186-Y199 HydrophobicContact CD1-CE1 3.93Å; F186-Y199 HydrophobicContact CE1-CD1 4.37Å; F186-Y199 AromaticContact CG-CD1 3.99Å; F186-Y199 HydrophobicContact CG-CD1 3.99Å; F186-G203 WeakPolarHBondContact CE2-O 3.38Å; F186-A207 HydrophobicContact CE2-CB 4.15Å; F186-A207 HydrophobicContact CZ-CB 4.24Å; F186-T215 HydrophobicContact CD2-CG2 4.36Å; F186-T215 HydrophobicContact CE2-CG2 3.81Å; F186-L216 PolarHBondContact N-O 3.18Å; F186-I217 HydrophobicContact CB-CD1 4.18Å; F186-I217 HydrophobicContact CD2-CD1 3.43Å; F186-I217 VanDerWaalsContact CD2-CD1 3.43Å; F186-I217 HydrophobicContact CE2-CD1 4.18Å; F186-I217 HydrophobicContact CG-CD1 4.21Å; F186-R218 VanDerWaalsContact O-CB 3.27Å; F186-R218 WeakPolarHBondContact O-CB 3.25Å; F186-R218 PolarHBondContact O-N 2.77Å
187	N	98.7	Very high	97.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	25%	0.247	C	C	.	.			trans	-94.2	53.9	174.3	-176.9	42.2	0	0	0	111.2	V165 V166 P189 R218 A252 W256	V165-N187 HydrophobicContact CG1-CB 4.01Å; V166-N187 PolarHBondContact O-N 2.85Å; N187-P189 WeakPolarHBondContact O-CD 3.44Å; N187-R218 WeakPolarHBondContact OD1-CD 3.44Å; N187-R218 PolarHBondContact OD1-NH1 3.04Å; N187-A252 HydrophobicContact CB-CB 4.44Å; N187-W256 VanDerWaalsContact ND2-CB 3.3Å; N187-W256 WeakPolarHBondContact ND2-CB 3.39Å
188	Q	97.9	Very high	97.4	Very high	40 Å²	40	39.4 Å²	39.4	19%	0.187	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-72.8	120.4	173.1	173.8	65.6	-5.2	0	0	109.2	Q167 F186 T196 Y199 R218	Q167-Q188 WeakPolarHBondContact O-CA 3.27Å; Q167-Q188 WeakPolarHBondContact O-CB 3.46Å; Q167-Q188 PolarHBondContact O-OE1 2.74Å; F186-Q188 VanDerWaalsContact C-N 3.31Å; F186-Q188 PolarHBondContact O-N 3.46Å; Q188-T196 HydrophobicContact CG-CG2 4.29Å; Q188-Y199 HydrophobicContact CB-CD1 4.09Å; Q188-Y199 HydrophobicContact CB-CD2 3.82Å; Q188-Y199 HydrophobicContact CB-CE1 4.03Å; Q188-Y199 HydrophobicContact CB-CE2 3.79Å; Q188-Y199 HydrophobicContact CB-CG 3.98Å; Q188-Y199 HydrophobicContact CG-CD2 3.66Å; Q188-Y199 HydrophobicContact CG-CE1 4.46Å; Q188-Y199 HydrophobicContact CG-CE2 3.36Å; Q188-Y199 HydrophobicContact CG-CG 4.33Å; Q188-R218 VanDerWaalsContact O-CD 3.27Å; Q188-R218 WeakPolarHBondContact O-CD 3.5Å
189	P	96.9	Very high	97.4	Very high	53 Å²	53	36.8 Å²	36.8	34%	0.344	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-62.7	143.9	171.7	-20.2	33.9	0	0	0	111.4	N187 T191	N187-P189 WeakPolarHBondContact O-CD 3.44Å; P189-T191 PolarHBondContact O-N 2.89Å
190	F	97.3	Very high	97.4	Very high	45 Å²	45	38.2 Å²	38.2	20%	0.197	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-66.7	123.4	174.7	-175.1	-84.7	0	0	0	110.2	T196 V220 T221 P222 F443	F190-T196 HydrophobicContact CD2-CG2 4.29Å; F190-V220 HydrophobicContact CD2-CG1 4.33Å; F190-V220 HydrophobicContact CE2-CG1 4.3Å; F190-T221 WeakPolarHBondContact CB-O 3.39Å; F190-P222 HydrophobicContact CD1-CB 3.64Å; F190-P222 HydrophobicContact CD1-CG 4.3Å; F190-P222 HydrophobicContact CE1-CB 3.86Å; F190-P222 HydrophobicContact CE1-CG 4.08Å; F190-P222 HydrophobicContact CG-CB 4.15Å; F190-P222 HydrophobicContact CZ-CG 4.33Å; F190-F443 HydrophobicContact CZ-CB 4.49Å; F190-F443 HydrophobicContact CZ-CD2 4.36Å
191	T	96.3	Very high	97.4	Very high	76 Å²	76	33.9 Å²	33.9	47%	0.466	19%	0.189	S	C	.	.	S	Bend	trans	-102.6	-67.1	170.6	51.6	0	0	0	0	109.4	P189 E195 T196	P189-T191 PolarHBondContact O-N 2.89Å; T191-E195 WeakPolarHBondContact CB-OE2 3.45Å; T191-E195 PolarHBondContact OG1-OE2 3.37Å; T191-T196 PolarHBondContact N-OG1 3.43Å
192	N	94.8	Very high	97.4	Very high	58 Å²	58	36.2 Å²	36.2	31%	0.31	19%	0.187	S	C	.	.			trans	-141.5	165.6	166.5	58	63	0	0	0	108.3	P194 E195 T196	N192-P194 WeakPolarHBondContact OD1-CD 3.45Å; N192-E195 PolarHBondContact ND2-OE1 3.15Å; N192-E195 PolarHBondContact ND2-OE2 3.36Å; N192-E195 VanDerWaalsContact OD1-CB 3.31Å; N192-E195 WeakPolarHBondContact OD1-CB 3.46Å; N192-E195 VanDerWaalsContact OD1-CG 3.31Å; N192-E195 WeakPolarHBondContact OD1-CG 3.48Å; N192-E195 PolarHBondContact OD1-N 3.16Å; N192-T196 VanDerWaalsContact O-CB 3.24Å; N192-T196 WeakPolarHBondContact O-CB 3.34Å; N192-T196 PolarHBondContact O-N 2.91Å; N192-T196 PolarHBondContact O-OG1 2.89Å
193	Y	94.5	Very high	97.4	Very high	41 Å²	41	33.1 Å²	33.1	16%	0.161	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-49.3	-178.4	-174.7	-100.1	0	0	0	113.1	E195 T196 V197 R200 V220 F443 H446	Y193-E195 VanDerWaalsContact C-N 3.33Å; Y193-E195 PolarHBondContact O-N 3.2Å; Y193-T196 PolarHBondContact O-N 2.88Å; Y193-V197 HydrophobicContact CD1-CB 4.48Å; Y193-V197 HydrophobicContact CE1-CB 4.31Å; Y193-V197 HydrophobicContact CE1-CG2 4.18Å; Y193-V197 HydrophobicContact CE2-CB 4.36Å; Y193-V197 HydrophobicContact CE2-CG2 4.17Å; Y193-V197 WeakPolarHBondContact O-CB 3.48Å; Y193-V197 VanDerWaalsContact O-CG1 3.28Å; Y193-V197 WeakPolarHBondContact O-CG1 3.09Å; Y193-V197 PolarHBondContact O-N 3.45Å; Y193-R200 PolarHBondContact OH-NH1 3.38Å; Y193-V220 HydrophobicContact CD2-CG1 3.64Å; Y193-V220 HydrophobicContact CE2-CG1 3.88Å; Y193-F443 VanDerWaalsContact CB-CZ 3.46Å; Y193-F443 AromaticContact CD1-CE1 3.73Å; Y193-F443 HydrophobicContact CD1-CE1 3.73Å; Y193-F443 AromaticContact CD1-CZ 3.77Å; Y193-F443 HydrophobicContact CD1-CZ 3.77Å; Y193-F443 AromaticContact CD2-CD1 3.44Å; Y193-F443 HydrophobicContact CD2-CD1 3.44Å; Y193-F443 VanDerWaalsContact CD2-CD1 3.44Å; Y193-F443 AromaticContact CD2-CE1 3.25Å; Y193-F443 HydrophobicContact CD2-CE1 3.25Å; Y193-F443 HydrophobicContact CD2-CG 4.23Å; Y193-F443 AromaticContact CD2-CZ 3.9Å; Y193-F443 HydrophobicContact CD2-CZ 3.9Å; Y193-F443 HydrophobicContact CE1-CE1 4.03Å; Y193-F443 HydrophobicContact CE1-CZ 4.42Å; Y193-F443 AromaticContact CE2-CD1 3.87Å; Y193-F443 HydrophobicContact CE2-CD1 3.87Å; Y193-F443 AromaticContact CE2-CE1 3.62Å; Y193-F443 HydrophobicContact CE2-CE1 3.62Å; Y193-F443 AromaticContact CG-CD1 3.91Å; Y193-F443 HydrophobicContact CG-CD1 3.91Å; Y193-F443 AromaticContact CG-CE1 3.3Å; Y193-F443 HydrophobicContact CG-CE1 3.3Å; Y193-F443 HydrophobicContact CG-CE2 4.16Å; Y193-F443 AromaticContact CG-CZ 3.45Å; Y193-F443 HydrophobicContact CG-CZ 3.45Å; Y193-F443 VanDerWaalsContact CG-CZ 3.45Å; Y193-F443 AromaticContact CZ-CE1 3.97Å; Y193-H446 AromaticContact CE2-CE1 3.5Å; Y193-H446 VanDerWaalsContact CE2-CE1 3.5Å; Y193-H446 WeakPolarHBondContact CE2-CE1 3.45Å; Y193-H446 AromaticContact CZ-CE1 3.5Å; Y193-H446 AromaticContact CZ-NE2 3.73Å; Y193-H446 PolarHBondContact OH-CE1 2.96Å; Y193-H446 PolarHBondContact OH-NE2 2.84Å
194	P	92.7	Very high	97.3	Very high	62 Å²	62	33.1 Å²	33.1	40%	0.403	18%	0.176	S	C	.	.	H	α-helix	trans	-52.6	-41.5	178.5	-31.3	39.4	0	0	0	115.3	F16 N192	F16-P194 HydrophobicContact CE1-CB 3.57Å; F16-P194 HydrophobicContact CZ-CB 3.53Å; F16-P194 WeakPolarHBondContact CZ-O 3.47Å; N192-P194 WeakPolarHBondContact OD1-CD 3.45Å
195	E	94.6	Very high	97.3	Very high	113 Å²	113	33.2 Å²	33.2	53%	0.528	18%	0.176	S	C	.	.	H	α-helix	trans	-76.2	-43.6	177.3	-72.9	170.5	-159.1	0	0	112.6	T191 N192 Y193	T191-E195 WeakPolarHBondContact CB-OE2 3.45Å; T191-E195 PolarHBondContact OG1-OE2 3.37Å; N192-E195 PolarHBondContact ND2-OE1 3.15Å; N192-E195 PolarHBondContact ND2-OE2 3.36Å; N192-E195 VanDerWaalsContact OD1-CB 3.31Å; N192-E195 WeakPolarHBondContact OD1-CB 3.46Å; N192-E195 VanDerWaalsContact OD1-CG 3.31Å; N192-E195 WeakPolarHBondContact OD1-CG 3.48Å; N192-E195 PolarHBondContact OD1-N 3.16Å; Y193-E195 VanDerWaalsContact C-N 3.33Å; Y193-E195 PolarHBondContact O-N 3.2Å
196	T	97.4	Very high	97.3	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-77.6	-31.4	-171	-49.2	0	0	0	0	111.6	Q188 F190 T191 N192 Y193 A198 Y199 V220	Q188-T196 HydrophobicContact CG-CG2 4.29Å; F190-T196 HydrophobicContact CD2-CG2 4.29Å; T191-T196 PolarHBondContact N-OG1 3.43Å; N192-T196 VanDerWaalsContact O-CB 3.24Å; N192-T196 WeakPolarHBondContact O-CB 3.34Å; N192-T196 PolarHBondContact O-N 2.91Å; N192-T196 PolarHBondContact O-OG1 2.89Å; Y193-T196 PolarHBondContact O-N 2.88Å; T196-A198 PolarHBondContact O-N 3.13Å; T196-A198 VanDerWaalsContact O-N 3.11Å; T196-Y199 WeakPolarHBondContact O-CD2 3.24Å; T196-Y199 PolarHBondContact O-N 3.38Å; T196-Y199 VanDerWaalsContact O-N 3.13Å; T196-V220 HydrophobicContact CG2-CG1 3.89Å; T196-V220 HydrophobicContact CG2-CG2 4.48Å
197	V	97.8	Very high	97.3	Very high	22 Å²	22	34.5 Å²	34.5	13%	0.133	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-20.9	-179.3	76.1	0	0	0	0	112.9	Y193 Y199 R200 G201 V220	Y193-V197 HydrophobicContact CD1-CB 4.48Å; Y193-V197 HydrophobicContact CE1-CB 4.31Å; Y193-V197 HydrophobicContact CE1-CG2 4.18Å; Y193-V197 HydrophobicContact CE2-CB 4.36Å; Y193-V197 HydrophobicContact CE2-CG2 4.17Å; Y193-V197 WeakPolarHBondContact O-CB 3.48Å; Y193-V197 VanDerWaalsContact O-CG1 3.28Å; Y193-V197 WeakPolarHBondContact O-CG1 3.09Å; Y193-V197 PolarHBondContact O-N 3.45Å; V197-Y199 PolarHBondContact O-N 3.09Å; V197-R200 WeakPolarHBondContact O-CB 3.41Å; V197-R200 PolarHBondContact O-N 3.38Å; V197-R200 VanDerWaalsContact O-N 3.07Å; V197-G201 PolarHBondContact O-N 2.9Å; V197-V220 HydrophobicContact CB-CG1 4.26Å
198	A	98.1	Very high	97.3	Very high	28 Å²	28	35 Å²	35	23%	0.231	19%	0.187	C	C	.	.	H	α-helix	trans	-55.8	-33.2	174.1	0	0	0	0	0	113	F169 T196 G201 F202	F169-A198 HydrophobicContact CE2-CB 4.39Å; T196-A198 PolarHBondContact O-N 3.13Å; T196-A198 VanDerWaalsContact O-N 3.11Å; A198-G201 PolarHBondContact O-N 2.6Å; A198-F202 HydrophobicContact CB-CD2 4.38Å; A198-F202 WeakPolarHBondContact O-CD2 3.26Å; A198-F202 PolarHBondContact O-N 3.45Å
199	Y	98.5	Very high	97.4	Very high	20 Å²	20	37.7 Å²	37.7	8%	0.078	20%	0.198	C	C	.	.	H	α-helix	trans	-70.7	-36.9	178	-69.4	-91.6	0	0	0	112.5	S168 F169 F186 Q188 T196 V197 G203	S168-Y199 VanDerWaalsContact CA-OH 3.25Å; S168-Y199 WeakPolarHBondContact CA-OH 3.48Å; S168-Y199 WeakPolarHBondContact CB-OH 3.5Å; F169-Y199 HydrophobicContact CD1-CD1 4.11Å; F169-Y199 AromaticContact CD1-CE1 3.87Å; F169-Y199 HydrophobicContact CD1-CE1 3.87Å; F169-Y199 HydrophobicContact CD2-CE1 4.38Å; F169-Y199 AromaticContact CE1-CD1 3.63Å; F169-Y199 HydrophobicContact CE1-CD1 3.63Å; F169-Y199 AromaticContact CE1-CE1 3.86Å; F169-Y199 HydrophobicContact CE1-CE1 3.86Å; F169-Y199 HydrophobicContact CE1-CG 4.37Å; F169-Y199 HydrophobicContact CE2-CD1 4.45Å; F169-Y199 HydrophobicContact CE2-CE1 4.41Å; F169-Y199 HydrophobicContact CG-CE1 4.13Å; F169-Y199 AromaticContact CZ-CD1 3.85Å; F169-Y199 HydrophobicContact CZ-CD1 3.85Å; F169-Y199 HydrophobicContact CZ-CE1 4.17Å; F169-Y199 HydrophobicContact CZ-CG 4.17Å; F186-Y199 HydrophobicContact CB-CD1 3.98Å; F186-Y199 AromaticContact CD1-CD1 3.68Å; F186-Y199 HydrophobicContact CD1-CD1 3.68Å; F186-Y199 AromaticContact CD1-CE1 3.93Å; F186-Y199 HydrophobicContact CD1-CE1 3.93Å; F186-Y199 HydrophobicContact CE1-CD1 4.37Å; F186-Y199 AromaticContact CG-CD1 3.99Å; F186-Y199 HydrophobicContact CG-CD1 3.99Å; Q188-Y199 HydrophobicContact CB-CD1 4.09Å; Q188-Y199 HydrophobicContact CB-CD2 3.82Å; Q188-Y199 HydrophobicContact CB-CE1 4.03Å; Q188-Y199 HydrophobicContact CB-CE2 3.79Å; Q188-Y199 HydrophobicContact CB-CG 3.98Å; Q188-Y199 HydrophobicContact CG-CD2 3.66Å; Q188-Y199 HydrophobicContact CG-CE1 4.46Å; Q188-Y199 HydrophobicContact CG-CE2 3.36Å; Q188-Y199 HydrophobicContact CG-CG 4.33Å; T196-Y199 WeakPolarHBondContact O-CD2 3.24Å; T196-Y199 PolarHBondContact O-N 3.38Å; T196-Y199 VanDerWaalsContact O-N 3.13Å; V197-Y199 PolarHBondContact O-N 3.09Å; Y199-G203 VanDerWaalsContact O-CA 3.3Å; Y199-G203 WeakPolarHBondContact O-CA 3.38Å; Y199-G203 PolarHBondContact O-N 2.95Å
200	R	98.5	Very high	97.5	Very high	30 Å²	30	36.6 Å²	36.6	11%	0.113	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-50.9	169.3	-176.8	-167.5	78.5	-154.6	-1.3	110.1	L148 Y193 V197 F202 V220 W232 Q233	L148-R200 HydrophobicContact CD1-CG 3.79Å; L148-R200 HydrophobicContact CD2-CG 3.69Å; L148-R200 HydrophobicContact CG-CG 4.35Å; Y193-R200 PolarHBondContact OH-NH1 3.38Å; V197-R200 WeakPolarHBondContact O-CB 3.41Å; V197-R200 PolarHBondContact O-N 3.38Å; V197-R200 VanDerWaalsContact O-N 3.07Å; R200-F202 PolarHBondContact O-N 3.25Å; R200-V220 HydrophobicContact CB-CG2 3.92Å; R200-W232 PolarHBondContact NE-O 2.97Å; R200-Q233 WeakPolarHBondContact O-CB 3.4Å
201	G	97.8	Very high	97.5	Very high	10 Å²	10	35.9 Å²	35.9	10%	0.103	20%	0.196	C	C	.	.	H	α-helix	trans	-63.1	-41.3	-172.8	0	0	0	0	0	114	V197 A198 T234	V197-G201 PolarHBondContact O-N 2.9Å; A198-G201 PolarHBondContact O-N 2.6Å; G201-T234 PolarHBondContact O-N 3.1Å
202	F	98.5	Very high	97.6	Very high	91 Å²	91	32.5 Å²	32.5	40%	0.399	18%	0.176	S	C	.	.	H	α-helix	trans	-127.6	-3.7	-166.7	-52.9	-64.8	0	0	0	114.7	F169 A198 R200 A204 S205 E206	F169-F202 HydrophobicContact CZ-CB 4.35Å; A198-F202 HydrophobicContact CB-CD2 4.38Å; A198-F202 WeakPolarHBondContact O-CD2 3.26Å; A198-F202 PolarHBondContact O-N 3.45Å; R200-F202 PolarHBondContact O-N 3.25Å; F202-A204 VanDerWaalsContact C-N 3.28Å; F202-A204 PolarHBondContact O-N 2.56Å; F202-S205 PolarHBondContact O-N 3.26Å; F202-S205 VanDerWaalsContact O-N 3.12Å; F202-E206 PolarHBondContact O-N 3.05Å
203	G	98.6	Very high	97.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.4	-38.7	-174.5	0	0	0	0	0	113.9	F186 Y199 E206 A207	F186-G203 WeakPolarHBondContact CE2-O 3.38Å; Y199-G203 VanDerWaalsContact O-CA 3.3Å; Y199-G203 WeakPolarHBondContact O-CA 3.38Å; Y199-G203 PolarHBondContact O-N 2.95Å; G203-E206 PolarHBondContact O-N 2.87Å; G203-A207 VanDerWaalsContact O-CB 3.31Å; G203-A207 WeakPolarHBondContact O-CB 3.28Å; G203-A207 PolarHBondContact O-N 2.65Å
204	A	98.8	Very high	98	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-45.4	177.7	0	0	0	0	0	112	F202 A208 Y235 I242 T244	F202-A204 VanDerWaalsContact C-N 3.28Å; F202-A204 PolarHBondContact O-N 2.56Å; A204-A208 VanDerWaalsContact O-CB 3.22Å; A204-A208 WeakPolarHBondContact O-CB 3.34Å; A204-A208 PolarHBondContact O-N 2.89Å; A204-Y235 HydrophobicContact CB-CD1 4.37Å; A204-Y235 HydrophobicContact CB-CE1 3.8Å; A204-I242 HydrophobicContact CB-CG1 4.17Å; A204-I242 WeakPolarHBondContact O-CD1 3.3Å; A204-T244 HydrophobicContact CB-CG2 3.78Å
205	S	98.8	Very high	98.3	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-68.9	-44	178.3	-76.3	0	0	0	0	112.5	F202 A207 A208 K209 E236	F202-S205 PolarHBondContact O-N 3.26Å; F202-S205 VanDerWaalsContact O-N 3.12Å; S205-A207 VanDerWaalsContact C-N 3.3Å; S205-A207 PolarHBondContact O-N 3.42Å; S205-A208 PolarHBondContact O-N 3.21Å; S205-K209 VanDerWaalsContact O-CG 3.31Å; S205-K209 WeakPolarHBondContact O-CG 3.34Å; S205-K209 PolarHBondContact O-N 2.68Å; S205-K209 VanDerWaalsContact O-N 3.1Å; S205-E236 PolarHBondContact OG-N 2.93Å
206	E	98.8	Very high	98.5	Very high	27 Å²	27	21.5 Å²	21.5	13%	0.126	12%	0.121	C	C	.	.	H	α-helix	trans	-62.1	-38.5	178	-71.7	-61.3	104.9	0	0	111.9	F169 L172 K173 F202 G203 K209	F169-E206 HydrophobicContact CD1-CB 3.89Å; F169-E206 HydrophobicContact CD1-CG 3.89Å; F169-E206 HydrophobicContact CD2-CG 4.44Å; F169-E206 HydrophobicContact CE1-CB 3.99Å; F169-E206 HydrophobicContact CE1-CG 3.93Å; F169-E206 HydrophobicContact CE2-CG 4.44Å; F169-E206 HydrophobicContact CG-CG 4.16Å; F169-E206 HydrophobicContact CZ-CG 4.19Å; L172-E206 HydrophobicContact CD2-CB 4.24Å; K173-E206 WeakPolarHBondContact CE-OE2 3.31Å; K173-E206 IonicContact NZ-OE2 2.67Å; K173-E206 PolarHBondContact NZ-OE2 2.71Å; F202-E206 PolarHBondContact O-N 3.05Å; G203-E206 PolarHBondContact O-N 2.87Å; E206-K209 IonicContact OE1-NZ 2.68Å; E206-K209 PolarHBondContact OE1-NZ 3.25Å
207	A	98.9	Very high	98.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-73.1	-39.1	175.9	0	0	0	0	0	113.2	L172 V184 F186 G203 S205 K209 V210 G211 A212 T215 I242	L172-A207 HydrophobicContact CD2-CB 4.36Å; V184-A207 HydrophobicContact CB-CB 4.05Å; V184-A207 HydrophobicContact CG1-CB 4.42Å; V184-A207 HydrophobicContact CG2-CB 4.11Å; F186-A207 HydrophobicContact CE2-CB 4.15Å; F186-A207 HydrophobicContact CZ-CB 4.24Å; G203-A207 VanDerWaalsContact O-CB 3.31Å; G203-A207 WeakPolarHBondContact O-CB 3.28Å; G203-A207 PolarHBondContact O-N 2.65Å; S205-A207 VanDerWaalsContact C-N 3.3Å; S205-A207 PolarHBondContact O-N 3.42Å; A207-K209 VanDerWaalsContact C-N 3.3Å; A207-K209 PolarHBondContact O-N 3.15Å; A207-V210 WeakPolarHBondContact O-CG2 3.4Å; A207-V210 PolarHBondContact O-N 3.02Å; A207-V210 VanDerWaalsContact O-N 3.17Å; A207-G211 PolarHBondContact O-N 3.02Å; A207-A212 HydrophobicContact CB-CB 3.67Å; A207-A212 VanDerWaalsContact O-CB 3.22Å; A207-A212 WeakPolarHBondContact O-CB 3.25Å; A207-A212 PolarHBondContact O-N 3.43Å; A207-A212 VanDerWaalsContact O-N 3.09Å; A207-T215 HydrophobicContact CB-CG2 3.3Å; A207-I242 HydrophobicContact CB-CD1 4.15Å
208	A	98.8	Very high	98.7	Very high	15 Å²	15	21.6 Å²	21.6	12%	0.124	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-36.8	177.4	0	0	0	0	0	112.4	A204 S205 V210 G211 V239 K240 I242	A204-A208 VanDerWaalsContact O-CB 3.22Å; A204-A208 WeakPolarHBondContact O-CB 3.34Å; A204-A208 PolarHBondContact O-N 2.89Å; S205-A208 PolarHBondContact O-N 3.21Å; A208-V210 PolarHBondContact O-N 3.14Å; A208-V210 VanDerWaalsContact O-N 3.14Å; A208-G211 PolarHBondContact O-N 3.49Å; A208-V239 HydrophobicContact CB-CG1 3.6Å; A208-K240 WeakPolarHBondContact CB-O 3.41Å; A208-I242 HydrophobicContact CB-CD1 3.98Å; A208-I242 HydrophobicContact CB-CG1 4.2Å; A208-I242 HydrophobicContact CB-CG2 4.15Å
209	K	98.7	Very high	98.7	Very high	96 Å²	96	20.3 Å²	20.3	42%	0.417	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.2	176.2	-73.1	169.6	-170.8	175.9	0	113.4	S205 E206 A207 E236 V239	S205-K209 VanDerWaalsContact O-CG 3.31Å; S205-K209 WeakPolarHBondContact O-CG 3.34Å; S205-K209 PolarHBondContact O-N 2.68Å; S205-K209 VanDerWaalsContact O-N 3.1Å; E206-K209 IonicContact OE1-NZ 2.68Å; E206-K209 PolarHBondContact OE1-NZ 3.25Å; A207-K209 VanDerWaalsContact C-N 3.3Å; A207-K209 PolarHBondContact O-N 3.15Å; K209-E236 VanDerWaalsContact CE-CD 3.43Å; K209-E236 WeakPolarHBondContact CE-OE1 3.22Å; K209-E236 VanDerWaalsContact CE-OE2 3.26Å; K209-E236 WeakPolarHBondContact CE-OE2 3.03Å; K209-E236 VanDerWaalsContact NZ-CD 3.28Å; K209-E236 IonicContact NZ-OE1 2.77Å; K209-E236 PolarHBondContact NZ-OE1 3.37Å; K209-E236 IonicContact NZ-OE2 2.66Å; K209-E236 PolarHBondContact NZ-OE2 3.37Å; K209-V239 HydrophobicContact CG-CG1 4.13Å; K209-V239 HydrophobicContact CG-CG2 4.07Å
210	V	98.6	Very high	98.7	Very high	29 Å²	29	19.6 Å²	19.6	18%	0.176	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	12.9	179.4	-59.8	0	0	0	0	113.3	L172 A176 A179 T180 A207 A208	L172-V210 HydrophobicContact CD1-CG2 3.82Å; L172-V210 HydrophobicContact CD2-CG2 4.24Å; L172-V210 HydrophobicContact CG-CG2 3.97Å; A176-V210 HydrophobicContact CB-CB 3.96Å; A176-V210 HydrophobicContact CB-CG1 3.57Å; A179-V210 HydrophobicContact CB-CB 4.21Å; A179-V210 HydrophobicContact CB-CG2 3.54Å; T180-V210 PolarHBondContact OG1-O 3.37Å; A207-V210 WeakPolarHBondContact O-CG2 3.4Å; A207-V210 PolarHBondContact O-N 3.02Å; A207-V210 VanDerWaalsContact O-N 3.17Å; A208-V210 PolarHBondContact O-N 3.14Å; A208-V210 VanDerWaalsContact O-N 3.14Å
211	G	98.5	Very high	98.7	Very high	31 Å²	31	18.2 Å²	18.2	32%	0.32	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	14.6	172.1	0	0	0	0	0	115.5	T180 G181 A207 A208	T180-G211 WeakPolarHBondContact CA-O 3.26Å; G181-G211 PolarHBondContact N-O 3.38Å; A207-G211 PolarHBondContact O-N 3.02Å; A208-G211 PolarHBondContact O-N 3.49Å
212	A	98.9	Very high	98.6	Very high	4 Å²	4	20.9 Å²	20.9	3%	0.033	12%	0.116	C	C	.	.			trans	-61.3	154.3	170.9	0	0	0	0	0	111.3	A179 R182 V184 A207 I242	A179-A212 WeakPolarHBondContact O-CA 3.46Å; R182-A212 WeakPolarHBondContact O-CA 3.23Å; V184-A212 HydrophobicContact CB-CB 4.44Å; V184-A212 HydrophobicContact CG2-CB 3.64Å; A207-A212 HydrophobicContact CB-CB 3.67Å; A207-A212 VanDerWaalsContact O-CB 3.22Å; A207-A212 WeakPolarHBondContact O-CB 3.25Å; A207-A212 PolarHBondContact O-N 3.43Å; A207-A212 VanDerWaalsContact O-N 3.09Å; A212-I242 HydrophobicContact CB-CD1 4.23Å
213	V	98.9	Very high	98.5	Very high	43 Å²	43	20.9 Å²	20.9	26%	0.261	12%	0.116	S	C	.	.	S	Bend	trans	-104.2	-19.6	-177.7	-67	0	0	0	0	113.8	V159 A161 R182 I183 P243	V159-V213 HydrophobicContact CG1-CB 4.39Å; V159-V213 HydrophobicContact CG1-CG2 3.78Å; A161-V213 HydrophobicContact CB-CG2 4.03Å; R182-V213 WeakPolarHBondContact O-CG2 3.36Å; R182-V213 PolarHBondContact O-N 2.91Å; I183-V213 HydrophobicContact CG1-CG2 4.42Å; V213-P243 WeakPolarHBondContact O-CD 3.2Å
214	A	98.9	Very high	98.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	169.3	169.9	0	0	0	0	0	109.9	I183 V184 P243 L269	I183-A214 WeakPolarHBondContact CA-O 3.37Å; I183-A214 HydrophobicContact CG1-CB 4.2Å; V184-A214 PolarHBondContact N-O 2.75Å; A214-P243 CarbonylContact C-O 3.41Å; A214-P243 WeakPolarHBondContact CA-O 3.38Å; A214-P243 HydrophobicContact CB-CB 4.18Å; A214-P243 VanDerWaalsContact CB-O 3.28Å; A214-P243 WeakPolarHBondContact CB-O 3.24Å; A214-L269 HydrophobicContact CB-CD2 3.84Å
215	T	98.9	Very high	98.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.2	175.8	46	0	0	0	0	112.7	V184 F186 A207 I242 P243 T244 A245	V184-T215 HydrophobicContact CB-CG2 4.18Å; V184-T215 CarbonylContact O-C 3.56Å; V184-T215 VanDerWaalsContact O-CA 3.25Å; V184-T215 WeakPolarHBondContact O-CA 3.39Å; F186-T215 HydrophobicContact CD2-CG2 4.36Å; F186-T215 HydrophobicContact CE2-CG2 3.81Å; A207-T215 HydrophobicContact CB-CG2 3.3Å; T215-I242 HydrophobicContact CG2-CD1 4.05Å; T215-P243 PolarHBondContact N-O 3.39Å; T215-T244 WeakPolarHBondContact O-CA 3.31Å; T215-T244 WeakPolarHBondContact OG1-CB 3.49Å; T215-T244 PolarHBondContact OG1-OG1 3.23Å; T215-A245 PolarHBondContact O-N 3Å; T215-A245 VanDerWaalsContact O-N 3.15Å
216	L	98.9	Very high	98.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.8	165.4	-61.8	176.4	0	0	0	108.6	I183 V184 V185 F186 A245 I247 V267 L269	I183-L216 HydrophobicContact CG2-CD1 4.25Å; I183-L216 HydrophobicContact CG2-CG 4.05Å; V184-L216 PolarHBondContact O-N 2.62Å; V185-L216 CarbonylContact C-O 3.55Å; V185-L216 VanDerWaalsContact CA-O 3.23Å; V185-L216 WeakPolarHBondContact CA-O 3.41Å; V185-L216 HydrophobicContact CG2-CB 4.01Å; V185-L216 HydrophobicContact CG2-CD1 4.27Å; F186-L216 PolarHBondContact N-O 3.18Å; L216-A245 CarbonylContact C-O 3.57Å; L216-A245 VanDerWaalsContact CA-O 3.24Å; L216-A245 WeakPolarHBondContact CA-O 3.29Å; L216-A245 HydrophobicContact CD2-CB 4.03Å; L216-I247 HydrophobicContact CB-CD1 4.12Å; L216-I247 HydrophobicContact CB-CG1 4.31Å; L216-I247 HydrophobicContact CB-CG2 4.26Å; L216-I247 HydrophobicContact CD1-CG2 4.18Å; L216-I247 HydrophobicContact CD2-CG2 4.05Å; L216-I247 HydrophobicContact CG-CG2 4.39Å; L216-V267 HydrophobicContact CD1-CG1 4.16Å; L216-L269 HydrophobicContact CD2-CD1 4.24Å; L216-L269 HydrophobicContact CD2-CD2 4.4Å
217	I	98.9	Very high	98.1	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.6	-176.1	-45.3	-54.7	0	0	0	108.2	L148 F186 S219 A245 C246 I247	L148-I217 HydrophobicContact CD1-CG1 4.06Å; F186-I217 HydrophobicContact CB-CD1 4.18Å; F186-I217 HydrophobicContact CD2-CD1 3.43Å; F186-I217 VanDerWaalsContact CD2-CD1 3.43Å; F186-I217 HydrophobicContact CE2-CD1 4.18Å; F186-I217 HydrophobicContact CG-CD1 4.21Å; I217-S219 PolarHBondContact O-N 2.9Å; I217-A245 PolarHBondContact N-O 3.49Å; I217-C246 CarbonylContact O-C 3.41Å; I217-C246 VanDerWaalsContact O-CA 3.24Å; I217-C246 WeakPolarHBondContact O-CA 3.19Å; I217-I247 PolarHBondContact O-N 3Å
218	R	98.8	Very high	98.1	Very high	27 Å²	27	33 Å²	33	10%	0.102	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	125.3	163.7	167.6	167	168.8	155.8	7.5	107.9	F186 N187 Q188 V220 V249 A252 E253	F186-R218 VanDerWaalsContact O-CB 3.27Å; F186-R218 WeakPolarHBondContact O-CB 3.25Å; F186-R218 PolarHBondContact O-N 2.77Å; N187-R218 WeakPolarHBondContact OD1-CD 3.44Å; N187-R218 PolarHBondContact OD1-NH1 3.04Å; Q188-R218 VanDerWaalsContact O-CD 3.27Å; Q188-R218 WeakPolarHBondContact O-CD 3.5Å; R218-V220 PolarHBondContact O-N 2.95Å; R218-V249 HydrophobicContact CG-CG2 4.3Å; R218-V249 VanDerWaalsContact NH2-CG1 3.3Å; R218-A252 HydrophobicContact CB-CB 3.73Å; R218-A252 HydrophobicContact CG-CB 4.17Å; R218-E253 IonicContact CZ-OE1 3.11Å; R218-E253 IonicContact NH1-OE1 3.8Å; R218-E253 PolarHBondContact NH1-OE1 3.43Å; R218-E253 IonicContact NH2-OE1 3.69Å; R218-E253 PolarHBondContact NH2-OE1 3.37Å
219	S	98.7	Very high	98.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.007	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-49.8	136.1	179.9	-68	0	0	0	0	111.6	I217 T221 P228 H229 I247	I217-S219 PolarHBondContact O-N 2.9Å; S219-T221 PolarHBondContact O-N 3.22Å; S219-P228 VanDerWaalsContact OG-CA 3.31Å; S219-P228 WeakPolarHBondContact OG-CA 3.43Å; S219-H229 PolarHBondContact OG-N 3.25Å; S219-I247 WeakPolarHBondContact CB-O 3.31Å; S219-I247 PolarHBondContact N-O 3.31Å; S219-I247 PolarHBondContact OG-O 2.92Å
220	V	98.4	Very high	98.1	Very high	5 Å²	5	28 Å²	28	3%	0.03	16%	0.161	C	C	.	.	S	Bend	trans	-78.9	68.4	-176.2	-172.2	0	0	0	0	108.9	F190 Y193 T196 V197 R200 R218	F190-V220 HydrophobicContact CD2-CG1 4.33Å; F190-V220 HydrophobicContact CE2-CG1 4.3Å; Y193-V220 HydrophobicContact CD2-CG1 3.64Å; Y193-V220 HydrophobicContact CE2-CG1 3.88Å; T196-V220 HydrophobicContact CG2-CG1 3.89Å; T196-V220 HydrophobicContact CG2-CG2 4.48Å; V197-V220 HydrophobicContact CB-CG1 4.26Å; R200-V220 HydrophobicContact CB-CG2 3.92Å; R218-V220 PolarHBondContact O-N 2.95Å
221	T	98	Very high	98.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.152	C	C	.	.			trans	-143.7	142.8	-177.4	173.7	0	0	0	0	110.7	F190 S219 F223 V249 F443	F190-T221 WeakPolarHBondContact CB-O 3.39Å; S219-T221 PolarHBondContact O-N 3.22Å; T221-F223 VanDerWaalsContact C-N 3.26Å; T221-F223 WeakPolarHBondContact CG2-O 3.41Å; T221-F223 PolarHBondContact OG1-N 3.22Å; T221-F223 PolarHBondContact OG1-O 3.13Å; T221-V249 HydrophobicContact CG2-CG2 3.92Å; T221-F443 VanDerWaalsContact CB-O 3.3Å; T221-F443 WeakPolarHBondContact CB-O 3.4Å; T221-F443 PolarHBondContact OG1-O 3.33Å
222	P	97.1	Very high	98	Very high	66 Å²	66	28 Å²	28	43%	0.429	15%	0.148	S	C	.	.	S	Bend	trans	-73.1	-18.6	170.5	30.9	-34.8	0	0	0	112.8	F190 F443	F190-P222 HydrophobicContact CD1-CB 3.64Å; F190-P222 HydrophobicContact CD1-CG 4.3Å; F190-P222 HydrophobicContact CE1-CB 3.86Å; F190-P222 HydrophobicContact CE1-CG 4.08Å; F190-P222 HydrophobicContact CG-CB 4.15Å; F190-P222 HydrophobicContact CZ-CG 4.33Å; P222-F443 HydrophobicContact CG-CB 4.32Å
223	F	95.7	Very high	97.9	Very high	91 Å²	91	27.8 Å²	27.8	40%	0.399	15%	0.146	S	C	.	.			trans	-141.6	136	-172.8	-178.9	-101.6	0	0	0	112.1	T221 I225 W444	T221-F223 VanDerWaalsContact C-N 3.26Å; T221-F223 WeakPolarHBondContact CG2-O 3.41Å; T221-F223 PolarHBondContact OG1-N 3.22Å; T221-F223 PolarHBondContact OG1-O 3.13Å; F223-I225 HydrophobicContact CE1-CD1 3.96Å; F223-I225 HydrophobicContact CE1-CG1 3.77Å; F223-I225 HydrophobicContact CZ-CD1 3.71Å; F223-I225 HydrophobicContact CZ-CG1 3.6Å; F223-W444 HydrophobicContact CB-CD2 4.06Å; F223-W444 HydrophobicContact CB-CG 3.85Å; F223-W444 HydrophobicContact CD1-CB 4.34Å; F223-W444 HydrophobicContact CD1-CD2 4.01Å; F223-W444 HydrophobicContact CD1-CE3 4.09Å; F223-W444 HydrophobicContact CD1-CG 4.14Å; F223-W444 HydrophobicContact CE1-CE3 4.5Å; F223-W444 HydrophobicContact CG-CD2 4.19Å; F223-W444 HydrophobicContact CG-CG 4.35Å
224	S	96.1	Very high	97.8	Very high	17 Å²	17	28.9 Å²	28.9	12%	0.119	15%	0.153	C	C	.	.			trans	-143.3	141	178.8	173.9	0	0	0	0	109.9	N226 S227 E250	S224-N226 PolarHBondContact OG-N 3.26Å; S224-S227 PolarHBondContact OG-N 3.4Å; S224-S227 PolarHBondContact OG-O 2.96Å; S224-E250 VanDerWaalsContact CB-OE2 3.31Å; S224-E250 WeakPolarHBondContact CB-OE2 3.48Å; S224-E250 VanDerWaalsContact O-OE1 3.1Å; S224-E250 PolarHBondContact OG-OE1 2.77Å; S224-E250 PolarHBondContact OG-OE2 3.4Å
225	I	96.6	Very high	97.7	Very high	131 Å²	131	30.2 Å²	30.2	67%	0.672	16%	0.158	S	C	*	.	S	Bend	trans	-126.2	84.9	159.4	-56.4	177.6	0	0	0	106	F223 S227 E250	F223-I225 HydrophobicContact CE1-CD1 3.96Å; F223-I225 HydrophobicContact CE1-CG1 3.77Å; F223-I225 HydrophobicContact CZ-CD1 3.71Å; F223-I225 HydrophobicContact CZ-CG1 3.6Å; I225-S227 PolarHBondContact O-N 3.46Å; I225-S227 VanDerWaalsContact O-N 3.15Å; I225-E250 WeakPolarHBondContact CA-OE1 3.49Å
226	N	97.2	Very high	97.6	Very high	95 Å²	95	34.7 Å²	34.7	51%	0.508	18%	0.179	S	C	.	.	S	Bend	trans	51.2	37	-175.5	-168.2	64.3	0	0	0	113	A144 S224 P228 E250	A144-N226 WeakPolarHBondContact CB-OD1 3.33Å; S224-N226 PolarHBondContact OG-N 3.26Å; N226-P228 WeakPolarHBondContact O-CD 3.3Å; N226-E250 PolarHBondContact N-OE1 2.88Å
227	S	97.4	Very high	97.5	Very high	24 Å²	24	43.6 Å²	43.6	17%	0.168	22%	0.221	C	C	.	.			trans	-109.4	107	-175.9	-171.1	0	0	0	0	110.6	S224 I225 H229 S448	S224-S227 PolarHBondContact OG-N 3.4Å; S224-S227 PolarHBondContact OG-O 2.96Å; I225-S227 PolarHBondContact O-N 3.46Å; I225-S227 VanDerWaalsContact O-N 3.15Å; S227-H229 PolarHBondContact O-CD2 3.09Å; S227-H229 VanDerWaalsContact O-CD2 3.28Å; S227-H229 PolarHBondContact OG-NE2 3.31Å; S227-S448 WeakPolarHBondContact OG-CB 3.32Å
228	P	98.3	Very high	97.4	Very high	18 Å²	18	47.7 Å²	47.7	12%	0.117	26%	0.263	C	S	.	.			trans	-77.7	146.7	167.6	31	-33.5	0	0	0	111	A144 L146 S219 N226 S448	A144-P228 HydrophobicContact CB-CG 4.47Å; L146-P228 HydrophobicContact CB-CB 4.24Å; L146-P228 HydrophobicContact CB-CG 4.47Å; L146-P228 HydrophobicContact CD1-CB 4.22Å; L146-P228 HydrophobicContact CD1-CG 3.98Å; L146-P228 VanDerWaalsContact CD1-O 3.32Å; L146-P228 WeakPolarHBondContact CD1-O 3.44Å; L146-P228 HydrophobicContact CG-CB 4Å; L146-P228 HydrophobicContact CG-CG 3.72Å; S219-P228 VanDerWaalsContact OG-CA 3.31Å; S219-P228 WeakPolarHBondContact OG-CA 3.43Å; N226-P228 WeakPolarHBondContact O-CD 3.3Å; P228-S448 WeakPolarHBondContact O-CB 3.49Å
229	H	98.7	Very high	97.4	Very high	3 Å²	3	47.7 Å²	47.7	1%	0.014	27%	0.266	C	S	.	.			trans	-119.9	121.6	-180	-66.5	-120.3	0	0	0	110.5	S219 S227 C246 F443 W444 H446 H447	S219-H229 PolarHBondContact OG-N 3.25Å; S227-H229 PolarHBondContact O-CD2 3.09Å; S227-H229 VanDerWaalsContact O-CD2 3.28Å; S227-H229 PolarHBondContact OG-NE2 3.31Å; H229-C246 WeakPolarHBondContact O-CB 3.37Å; H229-C246 PolarHBondContact O-SG 3.05Å; H229-F443 PolarHBondContact CE1-O 3.32Å; H229-W444 PolarHBondContact CE1-O 3.11Å; H229-H446 PolarHBondContact ND1-O 3.18Å; H229-H447 CarbonylContact C-O 3.49Å; H229-H447 VanDerWaalsContact CA-O 3.32Å; H229-H447 WeakPolarHBondContact CA-O 3.43Å
230	T	98.6	Very high	97.3	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.012	30%	0.296	C	S	.	.			trans	-82.3	-161.8	177.1	-166.1	0	0	0	0	111.3	R128 G147 W307 V309 H447	R128-T230 PolarHBondContact NH2-OG1 3.27Å; G147-T230 PolarHBondContact O-OG1 2.61Å; T230-W307 HydrophobicContact CG2-CB 3.74Å; T230-W307 HydrophobicContact CG2-CD2 3.55Å; T230-W307 HydrophobicContact CG2-CE3 3.71Å; T230-W307 HydrophobicContact CG2-CG 3.5Å; T230-W307 VanDerWaalsContact CG2-CG 3.5Å; T230-V309 HydrophobicContact CG2-CG2 3.95Å; T230-H447 HydrophobicContact CG2-CB 4.09Å; T230-H447 PolarHBondContact N-O 2.91Å; T230-H447 WeakPolarHBondContact O-CB 3.48Å; T230-H447 PolarHBondContact O-ND1 3.24Å
231	G	97.9	Very high	97.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.323	C	S	.	.			trans	141.6	165.3	-179	0	0	0	0	0	111.5	G149 W307 H447	G149-G231 PolarHBondContact N-O 3.08Å; G231-W307 VanDerWaalsContact CA-CE2 3.45Å; G231-H447 VanDerWaalsContact CA-ND1 3.29Å; G231-H447 WeakPolarHBondContact CA-ND1 3.44Å
232	W	97	Very high	97.4	Very high	59 Å²	59	62 Å²	62	22%	0.223	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-70.4	141	-179.3	-166.2	-104.5	0	0	0	111.4	P124 R200 W307 E350 Q351	P124-W232 HydrophobicContact CB-CH2 4.05Å; P124-W232 HydrophobicContact CG-CH2 4.46Å; R200-W232 PolarHBondContact NE-O 2.97Å; W232-W307 HydrophobicContact CB-CH2 4.16Å; W232-W307 HydrophobicContact CB-CZ2 4.06Å; W232-W307 HydrophobicContact CE3-CH2 4.07Å; W232-W307 VanDerWaalsContact N-CH2 3.35Å; W232-E350 WeakPolarHBondContact CB-O 3.25Å; W232-Q351 HydrophobicContact CD2-CB 4.05Å; W232-Q351 HydrophobicContact CD2-CG 4.18Å; W232-Q351 HydrophobicContact CE3-CB 3.77Å; W232-Q351 HydrophobicContact CE3-CG 3.38Å; W232-Q351 HydrophobicContact CH2-CB 3.93Å; W232-Q351 HydrophobicContact CH2-CG 3.83Å; W232-Q351 HydrophobicContact CZ2-CB 4.21Å; W232-Q351 HydrophobicContact CZ3-CB 3.72Å; W232-Q351 HydrophobicContact CZ3-CG 3.19Å
233	Q	97.2	Very high	97.5	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	31%	0.306	C	S	.	.			trans	-126.4	159.5	167.6	72.3	84.4	40.4	0	0	110.5	L148 G149 S150 R200 Y235 T244	L148-Q233 HydrophobicContact CB-CB 4.21Å; L148-Q233 HydrophobicContact CB-CG 3.8Å; L148-Q233 HydrophobicContact CD1-CB 4.16Å; L148-Q233 HydrophobicContact CD1-CG 4.36Å; G149-Q233 WeakPolarHBondContact O-CG 3.12Å; G149-Q233 PolarHBondContact O-N 3.17Å; S150-Q233 PolarHBondContact OG-NE2 3.11Å; S150-Q233 PolarHBondContact OG-O 3.23Å; R200-Q233 WeakPolarHBondContact O-CB 3.4Å; Q233-Y235 VanDerWaalsContact NE2-CD2 3.35Å; Q233-T244 HydrophobicContact CG-CG2 3.85Å
234	T	95.7	Very high	97.6	Very high	65 Å²	65	54.9 Å²	54.9	40%	0.399	29%	0.287	S	S	.	.			trans	-126.9	125.1	-177.7	-61.5	0	0	0	0	110.4	G201	G201-T234 PolarHBondContact O-N 3.1Å
235	Y	97.6	Very high	97.7	Very high	28 Å²	28	54.1 Å²	54.1	11%	0.11	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-79.8	125.5	169	-69.4	-66.2	0	0	0	110.9	S151 V152 A204 Q233 R241 I242	S151-Y235 PolarHBondContact OG-OH 2.92Å; V152-Y235 HydrophobicContact CG1-CE2 4.03Å; V152-Y235 PolarHBondContact N-OH 2.86Å; V152-Y235 VanDerWaalsContact N-OH 3.08Å; A204-Y235 HydrophobicContact CB-CD1 4.37Å; A204-Y235 HydrophobicContact CB-CE1 3.8Å; Q233-Y235 VanDerWaalsContact NE2-CD2 3.35Å; Y235-R241 HydrophobicContact CD1-CB 3.98Å; Y235-R241 HydrophobicContact CD1-CG 3.84Å; Y235-R241 HydrophobicContact CD2-CB 4.21Å; Y235-R241 HydrophobicContact CD2-CG 3.77Å; Y235-R241 HydrophobicContact CE1-CB 3.82Å; Y235-R241 HydrophobicContact CE1-CG 4.19Å; Y235-R241 HydrophobicContact CE2-CB 4.04Å; Y235-R241 HydrophobicContact CE2-CG 4.1Å; Y235-R241 HydrophobicContact CG-CB 4.18Å; Y235-R241 HydrophobicContact CG-CG 3.62Å; Y235-I242 PolarHBondContact OH-O 2.9Å
236	E	97.8	Very high	97.8	Very high	94 Å²	94	47.9 Å²	47.9	44%	0.439	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-60.9	138.1	167.4	-174.2	174.3	121.9	0	0	111.7	S205 K209 V239	S205-E236 PolarHBondContact OG-N 2.93Å; K209-E236 VanDerWaalsContact CE-CD 3.43Å; K209-E236 WeakPolarHBondContact CE-OE1 3.22Å; K209-E236 VanDerWaalsContact CE-OE2 3.26Å; K209-E236 WeakPolarHBondContact CE-OE2 3.03Å; K209-E236 VanDerWaalsContact NZ-CD 3.28Å; K209-E236 IonicContact NZ-OE1 2.77Å; K209-E236 PolarHBondContact NZ-OE1 3.37Å; K209-E236 IonicContact NZ-OE2 2.66Å; K209-E236 PolarHBondContact NZ-OE2 3.37Å; E236-V239 HydrophobicContact CB-CB 4.25Å; E236-V239 HydrophobicContact CB-CG2 3.85Å; E236-V239 HydrophobicContact CG-CG2 3.9Å; E236-V239 PolarHBondContact O-N 2.66Å
237	E	96.4	Very high	97.9	Very high	187 Å²	187	43.3 Å²	43.3	87%	0.874	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	139.3	177.1	-170.7	176.6	-177.1	0	0	111.5	V239	E237-V239 PolarHBondContact O-N 2.93Å
238	G	96.9	Very high	98	Very high	87 Å²	87	42.2 Å²	42.2	90%	0.897	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	-6.8	-178.6	0	0	0	0	0	115
239	V	97.9	Very high	98	Very high	27 Å²	27	42 Å²	42	16%	0.164	22%	0.216	C	C	.	.	S	Bend	trans	-91.8	138.9	174.2	-178.7	0	0	0	0	110.3	A208 K209 E236 E237 R241	A208-V239 HydrophobicContact CB-CG1 3.6Å; K209-V239 HydrophobicContact CG-CG1 4.13Å; K209-V239 HydrophobicContact CG-CG2 4.07Å; E236-V239 HydrophobicContact CB-CB 4.25Å; E236-V239 HydrophobicContact CB-CG2 3.85Å; E236-V239 HydrophobicContact CG-CG2 3.9Å; E236-V239 PolarHBondContact O-N 2.66Å; E237-V239 PolarHBondContact O-N 2.93Å; V239-R241 PolarHBondContact O-N 3.46Å
240	K	97.5	Very high	98	Very high	149 Å²	149	45.1 Å²	45.1	65%	0.648	23%	0.23	S	C	*	.	P	Polyproline II helix	trans	-59.2	125.9	176.1	-178.6	-178	176.9	-174.2	0	109.9	A208 I242	A208-K240 WeakPolarHBondContact CB-O 3.41Å; K240-I242 HydrophobicContact CG-CG2 4.41Å
241	R	98.6	Very high	98	Very high	156 Å²	156	45.2 Å²	45.2	59%	0.589	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-72.7	129.6	173.2	-56.7	-173.6	-178.9	178	-0.4	109.9	V152 Y235 V239	V152-R241 HydrophobicContact CG1-CB 3.83Å; V152-R241 HydrophobicContact CG2-CB 4.25Å; Y235-R241 HydrophobicContact CD1-CB 3.98Å; Y235-R241 HydrophobicContact CD1-CG 3.84Å; Y235-R241 HydrophobicContact CD2-CB 4.21Å; Y235-R241 HydrophobicContact CD2-CG 3.77Å; Y235-R241 HydrophobicContact CE1-CB 3.82Å; Y235-R241 HydrophobicContact CE1-CG 4.19Å; Y235-R241 HydrophobicContact CE2-CB 4.04Å; Y235-R241 HydrophobicContact CE2-CG 4.1Å; Y235-R241 HydrophobicContact CG-CB 4.18Å; Y235-R241 HydrophobicContact CG-CG 3.62Å; V239-R241 PolarHBondContact O-N 3.46Å
242	I	98.8	Very high	98.1	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.231	C	C	.	.			trans	-126.5	147.6	177.5	62.9	174.7	0	0	0	110.3	A204 A207 A208 A212 T215 Y235 K240	A204-I242 HydrophobicContact CB-CG1 4.17Å; A204-I242 WeakPolarHBondContact O-CD1 3.3Å; A207-I242 HydrophobicContact CB-CD1 4.15Å; A208-I242 HydrophobicContact CB-CD1 3.98Å; A208-I242 HydrophobicContact CB-CG1 4.2Å; A208-I242 HydrophobicContact CB-CG2 4.15Å; A212-I242 HydrophobicContact CB-CD1 4.23Å; T215-I242 HydrophobicContact CG2-CD1 4.05Å; Y235-I242 PolarHBondContact OH-O 2.9Å; K240-I242 HydrophobicContact CG-CG2 4.41Å
243	P	98.9	Very high	98.1	Very high	9 Å²	9	45.8 Å²	45.8	6%	0.058	24%	0.235	C	C	.	.			trans	-57	140.4	176.5	-23.4	33.7	0	0	0	111.6	V152 T154 V213 A214 T215 L269 M271	V152-P243 HydrophobicContact CG2-CG 4.31Å; V152-P243 WeakPolarHBondContact O-CA 3.49Å; T154-P243 HydrophobicContact CG2-CB 3.95Å; T154-P243 HydrophobicContact CG2-CG 3.84Å; V213-P243 WeakPolarHBondContact O-CD 3.2Å; A214-P243 CarbonylContact C-O 3.41Å; A214-P243 WeakPolarHBondContact CA-O 3.38Å; A214-P243 HydrophobicContact CB-CB 4.18Å; A214-P243 VanDerWaalsContact CB-O 3.28Å; A214-P243 WeakPolarHBondContact CB-O 3.24Å; T215-P243 PolarHBondContact N-O 3.39Å; P243-L269 HydrophobicContact CB-CD2 4.25Å; P243-M271 HydrophobicContact CB-SD 3.84Å
244	T	98.9	Very high	98.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	134.5	-178.8	-175.1	0	0	0	0	112.1	L148 S151 A204 T215 Q233 M271	L148-T244 HydrophobicContact CB-CG2 4.11Å; L148-T244 HydrophobicContact CD1-CG2 4.04Å; L148-T244 HydrophobicContact CG-CG2 4.43Å; L148-T244 PolarHBondContact N-O 2.88Å; S151-T244 VanDerWaalsContact OG-CG2 3.28Å; S151-T244 WeakPolarHBondContact OG-CG2 3.49Å; S151-T244 PolarHBondContact OG-N 2.97Å; S151-T244 PolarHBondContact OG-O 3.12Å; A204-T244 HydrophobicContact CB-CG2 3.78Å; T215-T244 WeakPolarHBondContact O-CA 3.31Å; T215-T244 WeakPolarHBondContact OG1-CB 3.49Å; T215-T244 PolarHBondContact OG1-OG1 3.23Å; Q233-T244 HydrophobicContact CG-CG2 3.85Å; T244-M271 VanDerWaalsContact O-CE 3.28Å; T244-M271 WeakPolarHBondContact O-CE 3.48Å
245	A	98.9	Very high	98.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	156.5	-179.8	0	0	0	0	0	110.9	M145 L146 T215 L216 I217 M271	M145-A245 HydrophobicContact CE-CB 3.57Å; L146-A245 CarbonylContact O-C 3.54Å; L146-A245 VanDerWaalsContact O-CA 3.31Å; L146-A245 WeakPolarHBondContact O-CA 3.31Å; L146-A245 WeakPolarHBondContact O-CB 3.44Å; T215-A245 PolarHBondContact O-N 3Å; T215-A245 VanDerWaalsContact O-N 3.15Å; L216-A245 CarbonylContact C-O 3.57Å; L216-A245 VanDerWaalsContact CA-O 3.24Å; L216-A245 WeakPolarHBondContact CA-O 3.29Å; L216-A245 HydrophobicContact CD2-CB 4.03Å; I217-A245 PolarHBondContact N-O 3.49Å; A245-M271 HydrophobicContact CB-SD 4.21Å
246	C	98.6	Very high	98.4	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	149.1	162.7	-85.1	0	0	0	0	111.1	M145 L146 L148 I217 H229	M145-C246 CarbonylContact C-O 3.53Å; M145-C246 WeakPolarHBondContact CA-O 3.03Å; M145-C246 WeakPolarHBondContact CB-O 3.28Å; L146-C246 PolarHBondContact N-O 2.89Å; L146-C246 PolarHBondContact O-N 3.38Å; L148-C246 HydrophobicContact CD2-CB 4.3Å; I217-C246 CarbonylContact O-C 3.41Å; I217-C246 VanDerWaalsContact O-CA 3.24Å; I217-C246 WeakPolarHBondContact O-CA 3.19Å; H229-C246 WeakPolarHBondContact O-CB 3.37Å; H229-C246 PolarHBondContact O-SG 3.05Å
247	I	98.9	Very high	98.4	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	163.7	167.7	55.2	171.9	0	0	0	109.5	A144 M145 V185 L216 I217 S219 D251 A252 M255	A144-I247 WeakPolarHBondContact O-CA 3.28Å; M145-I247 HydrophobicContact CB-CG2 4.15Å; V185-I247 HydrophobicContact CG1-CD1 4.27Å; L216-I247 HydrophobicContact CB-CD1 4.12Å; L216-I247 HydrophobicContact CB-CG1 4.31Å; L216-I247 HydrophobicContact CB-CG2 4.26Å; L216-I247 HydrophobicContact CD1-CG2 4.18Å; L216-I247 HydrophobicContact CD2-CG2 4.05Å; L216-I247 HydrophobicContact CG-CG2 4.39Å; I217-I247 PolarHBondContact O-N 3Å; S219-I247 WeakPolarHBondContact CB-O 3.31Å; S219-I247 PolarHBondContact N-O 3.31Å; S219-I247 PolarHBondContact OG-O 2.92Å; I247-D251 HydrophobicContact CB-CB 4.49Å; I247-D251 HydrophobicContact CD1-CB 4.36Å; I247-A252 HydrophobicContact CD1-CB 3.95Å; I247-A252 HydrophobicContact CG1-CB 4.27Å; I247-M255 HydrophobicContact CD1-CE 3.27Å
248	T	98.8	Very high	98.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.			trans	-59.1	155.2	177.7	66.9	0	0	0	0	111.9	A144 E250 D251 A252	A144-T248 HydrophobicContact CB-CG2 3.54Å; A144-T248 PolarHBondContact O-N 3.39Å; T248-E250 WeakPolarHBondContact CB-OE2 3.16Å; T248-E250 PolarHBondContact O-N 3.18Å; T248-D251 PolarHBondContact O-N 3.5Å; T248-D251 VanDerWaalsContact OG1-CB 3.23Å; T248-D251 WeakPolarHBondContact OG1-CB 3.33Å; T248-D251 PolarHBondContact OG1-N 3.1Å; T248-D251 VanDerWaalsContact OG1-N 3.09Å; T248-D251 PolarHBondContact OG1-OD2 3.37Å; T248-D251 VanDerWaalsContact OG1-OD2 3.05Å; T248-A252 PolarHBondContact O-N 2.68Å; T248-A252 VanDerWaalsContact O-N 3.08Å
249	V	98.7	Very high	98.6	Very high	15 Å²	15	36.1 Å²	36.1	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-56.2	-42.9	173.7	169.7	0	0	0	0	110.3	R218 T221 D251 A252 E253	R218-V249 HydrophobicContact CG-CG2 4.3Å; R218-V249 VanDerWaalsContact NH2-CG1 3.3Å; T221-V249 HydrophobicContact CG2-CG2 3.92Å; V249-D251 PolarHBondContact O-N 2.88Å; V249-A252 PolarHBondContact O-N 2.91Å; V249-E253 HydrophobicContact CG1-CG 4.32Å; V249-E253 WeakPolarHBondContact O-CB 3.37Å; V249-E253 VanDerWaalsContact O-CG 3.29Å; V249-E253 WeakPolarHBondContact O-CG 3.39Å; V249-E253 PolarHBondContact O-N 3.14Å
250	E	98.8	Very high	98.6	Very high	68 Å²	68	40.1 Å²	40.1	32%	0.318	18%	0.18	S	C	.	.	H	α-helix	trans	-65.3	-40	-176.5	-58.9	93.7	136.8	0	0	112.2	S224 I225 N226 T248 L254	S224-E250 VanDerWaalsContact CB-OE2 3.31Å; S224-E250 WeakPolarHBondContact CB-OE2 3.48Å; S224-E250 VanDerWaalsContact O-OE1 3.1Å; S224-E250 PolarHBondContact OG-OE1 2.77Å; S224-E250 PolarHBondContact OG-OE2 3.4Å; I225-E250 WeakPolarHBondContact CA-OE1 3.49Å; N226-E250 PolarHBondContact N-OE1 2.88Å; T248-E250 WeakPolarHBondContact CB-OE2 3.16Å; T248-E250 PolarHBondContact O-N 3.18Å; E250-L254 VanDerWaalsContact O-CB 3.25Å; E250-L254 WeakPolarHBondContact O-CB 3.38Å; E250-L254 PolarHBondContact O-N 3.35Å
251	D	98.8	Very high	98.7	Very high	4 Å²	4	38.3 Å²	38.3	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-71.8	-39.8	177.6	-74.1	-30.2	0	0	0	111.8	K141 L143 A144 I247 T248 V249 L254 M255	K141-D251 WeakPolarHBondContact CE-OD1 3.49Å; K141-D251 IonicContact NZ-OD1 3.82Å; K141-D251 PolarHBondContact NZ-OD1 3.2Å; K141-D251 IonicContact NZ-OD2 3.58Å; L143-D251 WeakPolarHBondContact CA-OD2 3.43Å; L143-D251 HydrophobicContact CD2-CB 4.03Å; A144-D251 PolarHBondContact N-OD2 3.04Å; I247-D251 HydrophobicContact CB-CB 4.49Å; I247-D251 HydrophobicContact CD1-CB 4.36Å; T248-D251 PolarHBondContact O-N 3.5Å; T248-D251 VanDerWaalsContact OG1-CB 3.23Å; T248-D251 WeakPolarHBondContact OG1-CB 3.33Å; T248-D251 PolarHBondContact OG1-N 3.1Å; T248-D251 VanDerWaalsContact OG1-N 3.09Å; T248-D251 PolarHBondContact OG1-OD2 3.37Å; T248-D251 VanDerWaalsContact OG1-OD2 3.05Å; V249-D251 PolarHBondContact O-N 2.88Å; D251-L254 WeakPolarHBondContact O-CB 3.29Å; D251-L254 PolarHBondContact O-N 2.85Å; D251-M255 HydrophobicContact CB-CE 4.46Å; D251-M255 WeakPolarHBondContact O-CE 3.5Å; D251-M255 PolarHBondContact O-N 3.11Å
252	A	98.8	Very high	98.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-44.7	174.1	0	0	0	0	0	111.6	N187 R218 I247 T248 V249 M255 W256	N187-A252 HydrophobicContact CB-CB 4.44Å; R218-A252 HydrophobicContact CB-CB 3.73Å; R218-A252 HydrophobicContact CG-CB 4.17Å; I247-A252 HydrophobicContact CD1-CB 3.95Å; I247-A252 HydrophobicContact CG1-CB 4.27Å; T248-A252 PolarHBondContact O-N 2.68Å; T248-A252 VanDerWaalsContact O-N 3.08Å; V249-A252 PolarHBondContact O-N 2.91Å; A252-M255 PolarHBondContact O-N 2.99Å; A252-W256 PolarHBondContact O-N 3.09Å
253	E	98.6	Very high	98.6	Very high	70 Å²	70	44.3 Å²	44.3	33%	0.327	21%	0.209	S	C	.	.	H	α-helix	trans	-69	-35	177.7	-71.3	-177.5	174.8	0	0	112.4	R218 V249 W256 R257	R218-E253 IonicContact CZ-OE1 3.11Å; R218-E253 IonicContact NH1-OE1 3.8Å; R218-E253 PolarHBondContact NH1-OE1 3.43Å; R218-E253 IonicContact NH2-OE1 3.69Å; R218-E253 PolarHBondContact NH2-OE1 3.37Å; V249-E253 HydrophobicContact CG1-CG 4.32Å; V249-E253 WeakPolarHBondContact O-CB 3.37Å; V249-E253 VanDerWaalsContact O-CG 3.29Å; V249-E253 WeakPolarHBondContact O-CG 3.39Å; V249-E253 PolarHBondContact O-N 3.14Å; E253-W256 WeakPolarHBondContact O-CB 3.33Å; E253-W256 PolarHBondContact O-N 2.81Å; E253-R257 WeakPolarHBondContact O-CG 3.36Å; E253-R257 PolarHBondContact O-N 3.18Å; E253-R257 PolarHBondContact O-NH1 2.76Å
254	L	98.6	Very high	98.6	Very high	25 Å²	25	49 Å²	49	13%	0.131	23%	0.228	C	C	.	.	H	α-helix	trans	-56.8	-53.1	170.6	170.6	64.3	0	0	0	110.5	M135 K141 E250 D251 W256 R257 L258	M135-L254 HydrophobicContact CE-CD2 4.1Å; K141-L254 HydrophobicContact CD-CD2 3.9Å; E250-L254 VanDerWaalsContact O-CB 3.25Å; E250-L254 WeakPolarHBondContact O-CB 3.38Å; E250-L254 PolarHBondContact O-N 3.35Å; D251-L254 WeakPolarHBondContact O-CB 3.29Å; D251-L254 PolarHBondContact O-N 2.85Å; L254-W256 VanDerWaalsContact C-N 3.27Å; L254-W256 PolarHBondContact O-N 3.07Å; L254-R257 PolarHBondContact O-N 3.13Å; L254-L258 HydrophobicContact CD1-CD1 4.06Å; L254-L258 HydrophobicContact CD1-CG 4.17Å; L254-L258 HydrophobicContact CG-CD1 4.07Å; L254-L258 VanDerWaalsContact O-CG 3.3Å; L254-L258 WeakPolarHBondContact O-CG 3.45Å; L254-L258 PolarHBondContact O-N 3.17Å
255	M	98.8	Very high	98.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-37.4	179.5	-75.1	-173.2	-97.4	0	0	111.7	M135 L143 V165 V185 I247 D251 A252 L258 A259 I265 V267	M135-M255 HydrophobicContact SD-CG 4.49Å; L143-M255 HydrophobicContact CD1-CE 3.78Å; L143-M255 HydrophobicContact CD2-CE 4.37Å; V165-M255 HydrophobicContact CG2-CB 4.03Å; V185-M255 HydrophobicContact CG2-CE 4.35Å; V185-M255 HydrophobicContact CG2-SD 3.91Å; I247-M255 HydrophobicContact CD1-CE 3.27Å; D251-M255 HydrophobicContact CB-CE 4.46Å; D251-M255 WeakPolarHBondContact O-CE 3.5Å; D251-M255 PolarHBondContact O-N 3.11Å; A252-M255 PolarHBondContact O-N 2.99Å; M255-L258 PolarHBondContact O-N 3.46Å; M255-A259 WeakPolarHBondContact O-CB 3.39Å; M255-A259 PolarHBondContact O-N 2.94Å; M255-I265 HydrophobicContact CB-CD1 4.08Å; M255-I265 HydrophobicContact CG-CD1 4.35Å; M255-I265 HydrophobicContact CG-CG2 4.25Å; M255-I265 VanDerWaalsContact O-CD1 3.24Å; M255-I265 WeakPolarHBondContact O-CD1 3.49Å; M255-I265 HydrophobicContact SD-CG2 4.2Å; M255-V267 HydrophobicContact SD-CG2 4.18Å
256	W	98.7	Very high	98.6	Very high	54 Å²	54	49.9 Å²	49.9	21%	0.205	23%	0.233	C	C	.	.	H	α-helix	trans	-57.5	-51.3	172.5	177.5	-114.5	0	0	0	112.5	V165 Q167 N187 A252 E253 L254 L258 A259 Q260	V165-W256 HydrophobicContact CB-CE3 4.27Å; V165-W256 HydrophobicContact CG1-CB 4.3Å; V165-W256 HydrophobicContact CG1-CE3 3.75Å; Q167-W256 VanDerWaalsContact CD-CZ2 3.46Å; Q167-W256 HydrophobicContact CG-CD2 4.45Å; Q167-W256 HydrophobicContact CG-CE3 4.11Å; Q167-W256 HydrophobicContact CG-CH2 3.6Å; Q167-W256 HydrophobicContact CG-CZ2 4.01Å; Q167-W256 HydrophobicContact CG-CZ3 3.68Å; N187-W256 VanDerWaalsContact ND2-CB 3.3Å; N187-W256 WeakPolarHBondContact ND2-CB 3.39Å; A252-W256 PolarHBondContact O-N 3.09Å; E253-W256 WeakPolarHBondContact O-CB 3.33Å; E253-W256 PolarHBondContact O-N 2.81Å; L254-W256 VanDerWaalsContact C-N 3.27Å; L254-W256 PolarHBondContact O-N 3.07Å; W256-L258 VanDerWaalsContact C-N 3.32Å; W256-L258 PolarHBondContact O-N 3.18Å; W256-A259 PolarHBondContact O-N 3Å; W256-Q260 HydrophobicContact CD2-CG 4.18Å; W256-Q260 HydrophobicContact CZ2-CG 4.14Å; W256-Q260 WeakPolarHBondContact O-CG 3.3Å; W256-Q260 PolarHBondContact O-N 2.8Å
257	R	98.7	Very high	98.6	Very high	126 Å²	126	49.9 Å²	49.9	48%	0.475	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-39	178.3	-69.3	-174	-57.2	-77.6	2.3	112.5	E253 L254 Q260 N261	E253-R257 WeakPolarHBondContact O-CG 3.36Å; E253-R257 PolarHBondContact O-N 3.18Å; E253-R257 PolarHBondContact O-NH1 2.76Å; L254-R257 PolarHBondContact O-N 3.13Å; R257-Q260 PolarHBondContact O-N 2.84Å; R257-N261 WeakPolarHBondContact O-CB 3.45Å; R257-N261 PolarHBondContact O-N 2.8Å; R257-N261 VanDerWaalsContact O-N 3.08Å; R257-N261 PolarHBondContact O-ND2 3.05Å
258	L	98.8	Very high	98.6	Very high	21 Å²	21	54.9 Å²	54.9	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-42.7	176.1	-67.6	176	0	0	0	111.6	M135 P138 L254 M255 W256 N261 K262 Q263 I265	M135-L258 HydrophobicContact CE-CD1 4.17Å; M135-L258 HydrophobicContact SD-CD1 3.74Å; P138-L258 HydrophobicContact CG-CD1 3.99Å; P138-L258 HydrophobicContact CG-CD2 3.98Å; L254-L258 HydrophobicContact CD1-CD1 4.06Å; L254-L258 HydrophobicContact CD1-CG 4.17Å; L254-L258 HydrophobicContact CG-CD1 4.07Å; L254-L258 VanDerWaalsContact O-CG 3.3Å; L254-L258 WeakPolarHBondContact O-CG 3.45Å; L254-L258 PolarHBondContact O-N 3.17Å; M255-L258 PolarHBondContact O-N 3.46Å; W256-L258 VanDerWaalsContact C-N 3.32Å; W256-L258 PolarHBondContact O-N 3.18Å; L258-N261 CarbonylContact O-C 3.37Å; L258-N261 PolarHBondContact O-N 2.88Å; L258-K262 PolarHBondContact O-N 3.14Å; L258-Q263 HydrophobicContact CB-CB 4.48Å; L258-Q263 WeakPolarHBondContact O-CB 3.38Å; L258-Q263 PolarHBondContact O-N 3.19Å; L258-I265 HydrophobicContact CB-CD1 3.72Å; L258-I265 HydrophobicContact CB-CG1 3.96Å; L258-I265 HydrophobicContact CD1-CG1 4.41Å
259	A	98.3	Very high	98.6	Very high	34 Å²	34	54.9 Å²	54.9	28%	0.281	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-42.4	177	0	0	0	0	0	112.1	V165 M255 W256 N261 K262 I265	V165-A259 HydrophobicContact CB-CB 4.16Å; V165-A259 HydrophobicContact CG2-CB 3.91Å; M255-A259 WeakPolarHBondContact O-CB 3.39Å; M255-A259 PolarHBondContact O-N 2.94Å; W256-A259 PolarHBondContact O-N 3Å; A259-N261 PolarHBondContact O-N 3.3Å; A259-K262 WeakPolarHBondContact O-CA 3.37Å; A259-K262 PolarHBondContact O-N 2.86Å; A259-I265 HydrophobicContact CB-CD1 4.18Å
260	Q	98	Very high	98.6	Very high	110 Å²	110	56.5 Å²	56.5	51%	0.514	26%	0.262	S	S	.	.	H	α-helix	trans	-60.2	-34.6	174.2	-69.1	-57.3	-48.8	0	0	112.1	W256 R257 K262	W256-Q260 HydrophobicContact CD2-CG 4.18Å; W256-Q260 HydrophobicContact CZ2-CG 4.14Å; W256-Q260 WeakPolarHBondContact O-CG 3.3Å; W256-Q260 PolarHBondContact O-N 2.8Å; R257-Q260 PolarHBondContact O-N 2.84Å; Q260-K262 PolarHBondContact O-N 2.72Å
261	N	98.1	Very high	98.6	Very high	111 Å²	111	53.4 Å²	53.4	59%	0.594	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	11.6	173.5	-68.9	-24.3	0	0	0	113.8	R257 L258 A259 Q263	R257-N261 WeakPolarHBondContact O-CB 3.45Å; R257-N261 PolarHBondContact O-N 2.8Å; R257-N261 VanDerWaalsContact O-N 3.08Å; R257-N261 PolarHBondContact O-ND2 3.05Å; L258-N261 CarbonylContact O-C 3.37Å; L258-N261 PolarHBondContact O-N 2.88Å; A259-N261 PolarHBondContact O-N 3.3Å; N261-Q263 HydrophobicContact CB-CG 4.18Å; N261-Q263 PolarHBondContact O-N 2.77Å; N261-Q263 VanDerWaalsContact O-N 3.15Å
262	K	97.6	Very high	98.6	Very high	195 Å²	195	55.2 Å²	55.2	85%	0.848	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	27.4	179.8	-53.8	179.6	-178.7	178.9	0	113.4	L258 A259 Q260	L258-K262 PolarHBondContact O-N 3.14Å; A259-K262 WeakPolarHBondContact O-CA 3.37Å; A259-K262 PolarHBondContact O-N 2.86Å; Q260-K262 PolarHBondContact O-N 2.72Å
263	Q	98.5	Very high	98.6	Very high	88 Å²	88	55.6 Å²	55.6	41%	0.411	27%	0.27	S	S	.	.			trans	-82.6	140.1	176.6	-60.3	-165.2	7.3	0	0	110.4	P138 L258 N261 I265	P138-Q263 VanDerWaalsContact CG-OE1 3.3Å; L258-Q263 HydrophobicContact CB-CB 4.48Å; L258-Q263 WeakPolarHBondContact O-CB 3.38Å; L258-Q263 PolarHBondContact O-N 3.19Å; N261-Q263 HydrophobicContact CB-CG 4.18Å; N261-Q263 PolarHBondContact O-N 2.77Å; N261-Q263 VanDerWaalsContact O-N 3.15Å; Q263-I265 PolarHBondContact O-N 3Å
264	K	98.6	Very high	98.5	Very high	108 Å²	108	56.9 Å²	56.9	47%	0.47	28%	0.276	S	S	.	.			trans	-71.8	119.8	174	179.7	172.4	-179.2	154.7	0	109.7	K137 E162 V266	K137-K264 CarbonylContact C-O 3.46Å; K137-K264 WeakPolarHBondContact CB-O 3.25Å; E162-K264 WeakPolarHBondContact OE1-CE 3.23Å; E162-K264 IonicContact OE1-NZ 2.6Å; E162-K264 PolarHBondContact OE1-NZ 3.37Å; K264-V266 HydrophobicContact CG-CG2 4.21Å
265	I	98.9	Very high	98.4	Very high	6 Å²	6	59.9 Å²	59.9	3%	0.031	30%	0.296	C	S	.	.			trans	-105.8	130.4	175	-54.7	165	0	0	0	107.9	M135 K137 E162 V163 V165 M255 L258 A259 Q263 V267	M135-I265 HydrophobicContact CG-CG2 4.24Å; M135-I265 HydrophobicContact SD-CG2 4.16Å; K137-I265 WeakPolarHBondContact O-CA 3.46Å; E162-I265 WeakPolarHBondContact CA-O 3.29Å; V163-I265 HydrophobicContact CB-CB 3.98Å; V163-I265 HydrophobicContact CB-CG2 3.81Å; V163-I265 HydrophobicContact CG1-CG2 4.44Å; V163-I265 HydrophobicContact CG2-CB 4.43Å; V163-I265 HydrophobicContact CG2-CG2 3.79Å; V163-I265 PolarHBondContact N-O 3.24Å; V165-I265 HydrophobicContact CG2-CD1 4.21Å; M255-I265 HydrophobicContact CB-CD1 4.08Å; M255-I265 HydrophobicContact CG-CD1 4.35Å; M255-I265 HydrophobicContact CG-CG2 4.25Å; M255-I265 VanDerWaalsContact O-CD1 3.24Å; M255-I265 WeakPolarHBondContact O-CD1 3.49Å; M255-I265 HydrophobicContact SD-CG2 4.2Å; L258-I265 HydrophobicContact CB-CD1 3.72Å; L258-I265 HydrophobicContact CB-CG1 3.96Å; L258-I265 HydrophobicContact CD1-CG1 4.41Å; A259-I265 HydrophobicContact CB-CD1 4.18Å; Q263-I265 PolarHBondContact O-N 3Å; I265-V267 HydrophobicContact CG2-CG2 4.36Å
266	V	98.9	Very high	98.3	Very high	12 Å²	12	62.6 Å²	62.6	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.7	173.7	177.4	0	0	0	0	107.3	M135 I136 K137 E160 A161 E162 K264	M135-V266 CarbonylContact C-O 3.48Å; I136-V266 HydrophobicContact CB-CB 4.46Å; I136-V266 HydrophobicContact CB-CG1 4.39Å; I136-V266 PolarHBondContact N-O 2.94Å; K137-V266 HydrophobicContact CB-CB 4.08Å; K137-V266 HydrophobicContact CB-CG2 4.14Å; K137-V266 HydrophobicContact CD-CG2 3.97Å; K137-V266 HydrophobicContact CG-CB 4.33Å; K137-V266 HydrophobicContact CG-CG2 4.3Å; K137-V266 PolarHBondContact N-O 3.47Å; K137-V266 PolarHBondContact O-N 3.07Å; E160-V266 HydrophobicContact CG-CG1 3.77Å; A161-V266 WeakPolarHBondContact O-CA 3.34Å; E162-V266 HydrophobicContact CG-CG2 4.2Å; K264-V266 HydrophobicContact CG-CG2 4.21Å
267	V	98.9	Very high	98.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.2	177.9	169.6	0	0	0	0	109.3	E134 M135 L143 E160 A161 V163 I183 L216 M255 I265	E134-V267 CarbonylContact O-C 3.49Å; E134-V267 VanDerWaalsContact O-CA 3.3Å; E134-V267 WeakPolarHBondContact O-CA 3.02Å; M135-V267 HydrophobicContact CB-CG2 4.36Å; L143-V267 HydrophobicContact CD1-CG1 4.4Å; L143-V267 HydrophobicContact CD1-CG2 4.14Å; E160-V267 WeakPolarHBondContact CA-O 3.32Å; A161-V267 PolarHBondContact N-O 3.46Å; A161-V267 PolarHBondContact O-N 3.01Å; V163-V267 HydrophobicContact CG2-CB 3.93Å; V163-V267 HydrophobicContact CG2-CG2 3.59Å; I183-V267 HydrophobicContact CD1-CB 3.96Å; I183-V267 HydrophobicContact CD1-CG1 4.13Å; I183-V267 WeakPolarHBondContact CD1-O 3.38Å; L216-V267 HydrophobicContact CD1-CG1 4.16Å; M255-V267 HydrophobicContact SD-CG2 4.18Å; I265-V267 HydrophobicContact CG2-CG2 4.36Å
268	R	98.9	Very high	98.2	Very high	106 Å²	106	63.6 Å²	63.6	40%	0.4	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.3	165.1	179.9	170.9	60.2	176.3	-1	108.8	A133 E134 I136 V159 E160	A133-R268 WeakPolarHBondContact CA-O 3.45Å; E134-R268 PolarHBondContact N-O 3.14Å; E134-R268 PolarHBondContact O-N 2.93Å; E134-R268 IonicContact OE2-CZ 3.53Å; E134-R268 IonicContact OE2-NE 3.65Å; E134-R268 IonicContact OE2-NH2 2.65Å; E134-R268 PolarHBondContact OE2-NH2 2.95Å; I136-R268 HydrophobicContact CD1-CB 4.21Å; I136-R268 HydrophobicContact CG1-CB 4.15Å; V159-R268 CarbonylContact O-C 3.54Å; V159-R268 WeakPolarHBondContact O-CA 3.23Å; E160-R268 HydrophobicContact CB-CB 4.33Å; E160-R268 HydrophobicContact CB-CG 4.48Å; E160-R268 HydrophobicContact CG-CB 4.3Å
269	L	98.9	Very high	98.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.8	178.3	177.9	64.2	0	0	0	109.4	A133 M145 T154 G158 V159 A214 L216 P243 M271	A133-L269 HydrophobicContact CB-CD1 4.16Å; M145-L269 HydrophobicContact CE-CD1 4.02Å; M145-L269 HydrophobicContact SD-CD1 3.71Å; T154-L269 HydrophobicContact CG2-CD2 4.41Å; T154-L269 HydrophobicContact CG2-CG 4.1Å; G158-L269 CarbonylContact C-O 3.58Å; G158-L269 WeakPolarHBondContact CA-O 3.19Å; V159-L269 PolarHBondContact N-O 3.39Å; V159-L269 PolarHBondContact O-N 3.39Å; A214-L269 HydrophobicContact CB-CD2 3.84Å; L216-L269 HydrophobicContact CD2-CD1 4.24Å; L216-L269 HydrophobicContact CD2-CD2 4.4Å; P243-L269 HydrophobicContact CB-CD2 4.25Å; L269-M271 HydrophobicContact CD1-CG 3.99Å; L269-M271 HydrophobicContact CD1-SD 4.22Å; L269-M271 HydrophobicContact CD2-SD 4.05Å; L269-M271 HydrophobicContact CG-CG 4.2Å; L269-M271 HydrophobicContact CG-SD 4.32Å
270	V	98.9	Very high	98.2	Very high	49 Å²	49	67.6 Å²	67.6	30%	0.297	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.4	172.5	-179.7	0	0	0	0	107.6	E131 S132	E131-V270 CarbonylContact C-O 3.56Å; E131-V270 WeakPolarHBondContact CA-O 3.36Å; E131-V270 WeakPolarHBondContact CB-O 3.18Å; S132-V270 PolarHBondContact N-O 3.46Å; S132-V270 PolarHBondContact O-N 3.3Å
271	M	98.8	Very high	98.2	Very high	3 Å²	3	62.4 Å²	62.4	2%	0.015	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	121.4	175.9	-66	175.4	63.7	0	0	109.6	E131 M145 G153 T154 P243 T244 A245 L269 A273	E131-M271 HydrophobicContact CB-CG 4.37Å; M145-M271 HydrophobicContact CE-CG 4.14Å; G153-M271 CarbonylContact C-O 3.56Å; G153-M271 WeakPolarHBondContact CA-O 3.24Å; T154-M271 HydrophobicContact CG2-CB 4.08Å; T154-M271 HydrophobicContact CG2-CG 4.36Å; T154-M271 PolarHBondContact N-O 3.18Å; T154-M271 PolarHBondContact OG1-N 2.91Å; T154-M271 PolarHBondContact OG1-O 2.99Å; P243-M271 HydrophobicContact CB-SD 3.84Å; T244-M271 VanDerWaalsContact O-CE 3.28Å; T244-M271 WeakPolarHBondContact O-CE 3.48Å; A245-M271 HydrophobicContact CB-SD 4.21Å; L269-M271 HydrophobicContact CD1-CG 3.99Å; L269-M271 HydrophobicContact CD1-SD 4.22Å; L269-M271 HydrophobicContact CD2-SD 4.05Å; L269-M271 HydrophobicContact CG-CG 4.2Å; L269-M271 HydrophobicContact CG-SD 4.32Å; M271-A273 HydrophobicContact CE-CB 4.4Å; M271-A273 PolarHBondContact O-N 3.39Å
272	G	98.4	Very high	98.2	Very high	41 Å²	41	60.4 Å²	60.4	42%	0.423	32%	0.317	S	S	.	.			trans	-85.9	16.3	174.7	0	0	0	0	0	114.1	R128 K130	R128-G272 CarbonylContact O-C 3.5Å; K130-G272 PolarHBondContact O-N 3.39Å
273	A	97.8	Very high	98.3	Very high	9 Å²	9	51.3 Å²	51.3	7%	0.074	28%	0.277	C	S	.	.			trans	-63.7	137.8	-171.9	0	0	0	0	0	112.3	W126 V127 R128 S151 G153 M271	W126-A273 HydrophobicContact CZ2-CB 3.7Å; V127-A273 CarbonylContact O-C 3.47Å; V127-A273 VanDerWaalsContact O-CA 3.29Å; V127-A273 WeakPolarHBondContact O-CA 3.49Å; R128-A273 WeakPolarHBondContact O-CA 3.07Å; R128-A273 PolarHBondContact O-N 3.49Å; R128-A273 VanDerWaalsContact O-N 3.09Å; S151-A273 WeakPolarHBondContact O-CB 3.42Å; G153-A273 VanDerWaalsContact CA-O 3.32Å; G153-A273 WeakPolarHBondContact CA-O 3.36Å; G153-A273 PolarHBondContact N-O 2.92Å; M271-A273 HydrophobicContact CE-CB 4.4Å; M271-A273 PolarHBondContact O-N 3.39Å
274	Q	96.9	Very high	98.3	Very high	96 Å²	96	47.1 Å²	47.1	45%	0.449	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	140.3	-179.2	61.6	-179	4.9	0	0	111.3	V127 L276	V127-Q274 HydrophobicContact CB-CG 3.88Å; V127-Q274 PolarHBondContact N-O 3.46Å; V127-Q274 PolarHBondContact O-N 3.5Å; Q274-L276 HydrophobicContact CG-CD2 4.33Å; Q274-L276 HydrophobicContact CG-CG 4.48Å
275	T	96.4	Very high	98.3	Very high	88 Å²	88	42 Å²	42	54%	0.54	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.1	167.3	-56.2	0	0	0	0	108.4
276	L	97.5	Very high	98.3	Very high	57 Å²	57	41.7 Å²	41.7	30%	0.298	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	168.3	174.4	-60.7	-178.3	0	0	0	109.4	H125 V127 Q274	H125-L276 HydrophobicContact CB-CB 4.16Å; H125-L276 PolarHBondContact O-N 3.18Å; V127-L276 HydrophobicContact CG2-CD1 3.84Å; V127-L276 HydrophobicContact CG2-CG 4.45Å; Q274-L276 HydrophobicContact CG-CD2 4.33Å; Q274-L276 HydrophobicContact CG-CG 4.48Å
277	P	97.6	Very high	98.3	Very high	114 Å²	114	42.2 Å²	42.2	74%	0.74	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.5	143.9	170.4	-23.1	34.4	0	0	0	111	H125 A279	H125-P277 WeakPolarHBondContact CB-O 3.25Å; P277-A279 PolarHBondContact O-N 2.91Å
278	D	97.6	Very high	98.3	Very high	88 Å²	88	43.2 Å²	43.2	47%	0.471	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.4	138.3	176.7	-63.9	-8.3	0	0	0	111.5	K122 I123	K122-D278 HydrophobicContact CD-CB 4.29Å; K122-D278 WeakPolarHBondContact CE-O 3.45Å; K122-D278 HydrophobicContact CG-CB 3.97Å; K122-D278 PolarHBondContact NZ-O 2.83Å; I123-D278 CarbonylContact O-C 3.52Å; I123-D278 VanDerWaalsContact O-CA 3.26Å; I123-D278 WeakPolarHBondContact O-CA 3.45Å; I123-D278 WeakPolarHBondContact O-CB 3.39Å
279	A	97.8	Very high	98.3	Very high	19 Å²	19	45.3 Å²	45.3	16%	0.157	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	147.6	-178.2	0	0	0	0	0	111	K122 I123 H125 P277	K122-A279 WeakPolarHBondContact CA-O 3.15Å; I123-A279 HydrophobicContact CG1-CB 4.1Å; I123-A279 PolarHBondContact N-O 2.89Å; I123-A279 PolarHBondContact O-N 3.33Å; H125-A279 HydrophobicContact CB-CB 4.38Å; P277-A279 PolarHBondContact O-N 2.91Å
280	D	98.4	Very high	98.3	Very high	120 Å²	120	45.4 Å²	45.4	64%	0.642	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	133.4	164.9	-58.8	-43.1	0	0	0	108.2	K122	K122-D280 WeakPolarHBondContact CD-OD1 3.48Å; K122-D280 WeakPolarHBondContact CE-OD1 3.46Å; K122-D280 VanDerWaalsContact NZ-CG 3.34Å; K122-D280 IonicContact NZ-OD1 2.63Å; K122-D280 PolarHBondContact NZ-OD1 2.7Å; K122-D280 IonicContact NZ-OD2 3.91Å
281	S	98.5	Very high	98.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	-166	179.7	-165.6	0	0	0	0	109.9	E99 I102 P120 V121	E99-S281 VanDerWaalsContact OE1-CB 3.26Å; E99-S281 WeakPolarHBondContact OE1-CB 3.48Å; E99-S281 PolarHBondContact OE1-OG 3.32Å; I102-S281 VanDerWaalsContact CD1-OG 3.28Å; I102-S281 WeakPolarHBondContact CD1-OG 3.24Å; P120-S281 WeakPolarHBondContact CA-O 3.07Å; V121-S281 PolarHBondContact N-O 3.14Å; V121-S281 PolarHBondContact O-N 2.91Å
282	F	98.8	Very high	98.2	Very high	69 Å²	69	53 Å²	53	30%	0.303	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	136.2	-176	-54.6	-89.1	0	0	0	113.9	I102 L118 E119 P120 T347	I102-F282 VanDerWaalsContact CD1-O 3.31Å; I102-F282 WeakPolarHBondContact CD1-O 3.38Å; I102-F282 HydrophobicContact CG2-CB 4.28Å; L118-F282 HydrophobicContact CB-CB 3.89Å; L118-F282 HydrophobicContact CB-CD1 3.72Å; L118-F282 HydrophobicContact CB-CG 3.91Å; L118-F282 HydrophobicContact CD1-CB 4.33Å; L118-F282 HydrophobicContact CD1-CD1 4.48Å; L118-F282 HydrophobicContact CD1-CD2 4.3Å; L118-F282 HydrophobicContact CD1-CG 4.11Å; L118-F282 HydrophobicContact CD2-CB 4.29Å; L118-F282 HydrophobicContact CG-CB 4.4Å; E119-F282 CarbonylContact O-C 3.59Å; E119-F282 VanDerWaalsContact O-CA 3.25Å; E119-F282 WeakPolarHBondContact O-CA 3.5Å; P120-F282 HydrophobicContact CB-CD1 4.38Å; P120-F282 HydrophobicContact CB-CE1 4.3Å; P120-F282 HydrophobicContact CG-CD1 4.29Å; P120-F282 HydrophobicContact CG-CE1 4.09Å; F282-T347 PolarHBondContact O-OG1 2.9Å
283	N	98.8	Very high	98.2	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	140.1	154.9	-68.9	-29.3	0	0	0	108.7	E119 V344 T347 G355	E119-N283 HydrophobicContact CB-CB 4.47Å; E119-N283 PolarHBondContact N-O 3.08Å; E119-N283 PolarHBondContact O-N 3.44Å; N283-V344 HydrophobicContact CB-CG1 4.28Å; N283-T347 PolarHBondContact OD1-N 2.97Å; N283-G355 PolarHBondContact ND2-O 3.06Å; N283-G355 VanDerWaalsContact ND2-O 3.12Å
284	T	98.8	Very high	98.3	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	122.5	176.6	-52.7	0	0	0	0	109.8	M105 M109 V116 L118 L345	M105-T284 HydrophobicContact CB-CG2 4.39Å; M109-T284 HydrophobicContact CE-CG2 3.3Å; V116-T284 HydrophobicContact CG1-CG2 4.4Å; L118-T284 HydrophobicContact CD2-CG2 3.88Å; T284-L345 PolarHBondContact N-O 2.88Å; T284-L345 PolarHBondContact O-N 2.97Å
285	V	98.9	Very high	98.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	131.8	-176.7	-176.2	0	0	0	0	110	V116 H117 E119 E287 R342 A343 V344 Y359	V116-V285 VanDerWaalsContact CA-O 3.24Å; V116-V285 WeakPolarHBondContact CA-O 3.36Å; V116-V285 VanDerWaalsContact CG1-O 3.27Å; V116-V285 WeakPolarHBondContact CG1-O 3.42Å; H117-V285 WeakPolarHBondContact CE1-CG1 3.44Å; H117-V285 PolarHBondContact N-O 2.77Å; H117-V285 PolarHBondContact O-N 3.03Å; E119-V285 HydrophobicContact CG-CG2 3.96Å; V285-E287 HydrophobicContact CG1-CG 4.4Å; V285-R342 HydrophobicContact CG1-CG 3.65Å; V285-A343 WeakPolarHBondContact CA-O 3.38Å; V285-V344 HydrophobicContact CG1-CG2 4.39Å; V285-V344 HydrophobicContact CG2-CG1 4.04Å; V285-V344 HydrophobicContact CG2-CG2 4.31Å; V285-Y359 HydrophobicContact CG2-CE2 4.47Å
286	A	98.8	Very high	98.4	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.5	173.5	0	0	0	0	0	112	M109 L114 D115 V116 L327 R342 A343	M109-A286 HydrophobicContact CB-CB 4.35Å; M109-A286 HydrophobicContact CE-CB 4.04Å; M109-A286 HydrophobicContact CG-CB 4.5Å; M109-A286 HydrophobicContact SD-CB 3.47Å; M109-A286 WeakPolarHBondContact SD-CB 3.42Å; L114-A286 HydrophobicContact CB-CB 4.33Å; L114-A286 HydrophobicContact CD1-CB 4.11Å; D115-A286 CarbonylContact O-C 3.59Å; D115-A286 WeakPolarHBondContact O-CA 3.29Å; V116-A286 HydrophobicContact CG2-CB 3.99Å; A286-L327 HydrophobicContact CB-CD2 4.23Å; A286-L327 WeakPolarHBondContact O-CD2 3.17Å; A286-R342 CarbonylContact O-C 3.51Å; A286-R342 WeakPolarHBondContact O-CA 3.29Å; A286-A343 HydrophobicContact CB-CB 4.47Å; A286-A343 PolarHBondContact N-O 2.73Å; A286-A343 PolarHBondContact O-N 3.48Å
287	E	98.8	Very high	98.5	Very high	24 Å²	24	49.5 Å²	49.5	11%	0.112	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.3	-172.1	-61.9	-172.9	158	0	0	114.7	D115 V285 T340 L341 R342	D115-E287 HydrophobicContact CB-CB 4.41Å; D115-E287 PolarHBondContact N-O 2.64Å; D115-E287 PolarHBondContact O-N 3.18Å; V285-E287 HydrophobicContact CG1-CG 4.4Å; E287-T340 HydrophobicContact CB-CG2 4.14Å; E287-T340 HydrophobicContact CG-CG2 4.14Å; E287-L341 VanDerWaalsContact CA-O 3.24Å; E287-L341 WeakPolarHBondContact CA-O 3.17Å; E287-R342 HydrophobicContact CG-CB 4.2Å; E287-R342 HydrophobicContact CG-CG 4.04Å; E287-R342 IonicContact OE1-CZ 2.77Å; E287-R342 IonicContact OE1-NE 2.64Å; E287-R342 PolarHBondContact OE1-NE 2.77Å; E287-R342 IonicContact OE1-NH2 3.92Å; E287-R342 PolarHBondContact OE1-NH2 3.4Å
288	I	98.8	Very high	98.5	Very high	20 Å²	20	44.1 Å²	44.1	10%	0.103	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	104.8	153.1	-61.4	174.4	0	0	0	107.1	L114 G290 L327 I330 K331 T340 L341	L114-I288 HydrophobicContact CD2-CD1 4.35Å; L114-I288 HydrophobicContact CD2-CG1 3.91Å; I288-G290 PolarHBondContact O-N 3.15Å; I288-L327 HydrophobicContact CD1-CB 4.14Å; I288-L327 HydrophobicContact CD1-CG 4.15Å; I288-L327 VanDerWaalsContact CD1-O 3.29Å; I288-L327 WeakPolarHBondContact CD1-O 3.34Å; I288-L327 HydrophobicContact CG1-CB 4.47Å; I288-L327 HydrophobicContact CG1-CD2 4.49Å; I288-L327 HydrophobicContact CG1-CG 4.16Å; I288-I330 HydrophobicContact CD1-CB 3.99Å; I288-I330 HydrophobicContact CD1-CG2 3.83Å; I288-K331 HydrophobicContact CD1-CB 4.13Å; I288-T340 WeakPolarHBondContact O-CA 3.35Å; I288-L341 HydrophobicContact CB-CB 4.38Å; I288-L341 PolarHBondContact N-O 3.29Å; I288-L341 PolarHBondContact O-N 2.64Å
289	R	98.5	Very high	98.6	Very high	151 Å²	151	39.9 Å²	39.9	57%	0.57	19%	0.186	S	C	*	.			trans	-63	128.2	-177.8	-173.9	175.4	179.2	136.7	3.5	111.7	P294 R336	R289-P294 HydrophobicContact CG-CB 3.78Å; R289-R336 PolarHBondContact O-NE 2.84Å; R289-R336 PolarHBondContact O-NH2 3.12Å
290	G	98.6	Very high	98.6	Very high	2 Å²	2	39 Å²	39	2%	0.021	18%	0.178	C	C	.	.			trans	-57.7	151.9	175.9	0	0	0	0	0	112.7	I288 R336 P337 R338 R339 T340	I288-G290 PolarHBondContact O-N 3.15Å; G290-R336 PolarHBondContact O-NH2 3.45Å; G290-P337 VanDerWaalsContact CA-O 3.3Å; G290-P337 WeakPolarHBondContact CA-O 3.27Å; G290-R338 CarbonylContact C-O 3.47Å; G290-R338 WeakPolarHBondContact CA-O 3.25Å; G290-R339 VanDerWaalsContact CA-C 3.45Å; G290-R339 VanDerWaalsContact CA-O 3.26Å; G290-R339 WeakPolarHBondContact CA-O 3.36Å; G290-T340 PolarHBondContact N-OG1 3.44Å
291	W	98.5	Very high	98.6	Very high	133 Å²	133	33.3 Å²	33.3	50%	0.504	15%	0.148	S	C	.	.	S	Bend	trans	-91.2	-25.3	178.1	69.9	-95	0	0	0	113.7	R336 P337 R338	W291-R336 HydrophobicContact CB-CG 4.29Å; W291-P337 PolarHBondContact N-O 3.06Å; W291-P337 VanDerWaalsContact N-O 3.09Å; W291-R338 HydrophobicContact CZ2-CG 3.62Å; W291-R338 PolarHBondContact N-O 2.8Å
292	Q	98.4	Very high	98.6	Very high	79 Å²	79	33.2 Å²	33.2	37%	0.369	15%	0.147	S	C	.	.	S	Bend	trans	-108.6	-45.2	-176.3	-165.8	177.3	5.3	0	0	112.4	P294 R338	Q292-P294 VanDerWaalsContact C-CD 3.47Å; Q292-P294 WeakPolarHBondContact O-CD 3.43Å; Q292-R338 HydrophobicContact CB-CB 4.05Å; Q292-R338 HydrophobicContact CB-CG 4.1Å; Q292-R338 PolarHBondContact N-O 3.1Å; Q292-R338 VanDerWaalsContact N-O 3.1Å; Q292-R338 VanDerWaalsContact OE1-CD 3.23Å
293	H	98.4	Very high	98.6	Very high	48 Å²	48	30 Å²	30	22%	0.222	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	65.3	-176.1	-61.6	-63.8	0	0	0	109.8	E295 Q296 R338 R339	H293-E295 VanDerWaalsContact C-OE2 3.31Å; H293-E295 IonicContact ND1-OE1 3.69Å; H293-E295 PolarHBondContact O-N 3.35Å; H293-E295 VanDerWaalsContact O-N 3.12Å; H293-Q296 HydrophobicContact CB-CB 4.06Å; H293-Q296 HydrophobicContact CB-CG 3.97Å; H293-Q296 PolarHBondContact O-N 2.99Å; H293-R338 PolarHBondContact N-O 2.75Å; H293-R339 HydrophobicContact CB-CG 4.28Å
294	P	98.4	Very high	98.6	Very high	42 Å²	42	29.8 Å²	29.8	27%	0.273	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	-19.6	-175.7	27.4	-36.8	0	0	0	113.9	R289 Q292 T340	R289-P294 HydrophobicContact CG-CB 3.78Å; Q292-P294 VanDerWaalsContact C-CD 3.47Å; Q292-P294 WeakPolarHBondContact O-CD 3.43Å; P294-T340 WeakPolarHBondContact CA-OG1 3.24Å; P294-T340 PolarHBondContact O-OG1 2.92Å
295	E	98.1	Very high	98.5	Very high	92 Å²	92	29.8 Å²	29.8	43%	0.43	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-22.9	175.4	72.4	-69.4	166.8	0	0	113.8	H293 N369	H293-E295 VanDerWaalsContact C-OE2 3.31Å; H293-E295 IonicContact ND1-OE1 3.69Å; H293-E295 PolarHBondContact O-N 3.35Å; H293-E295 VanDerWaalsContact O-N 3.12Å; E295-N369 VanDerWaalsContact O-CB 3.32Å; E295-N369 WeakPolarHBondContact O-CB 3.25Å; E295-N369 PolarHBondContact O-ND2 3.45Å
296	Q	98.6	Very high	98.5	Very high	31 Å²	31	29.9 Å²	29.9	15%	0.145	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	141.6	179.5	-64.8	176.6	-0.7	0	0	110	H293 R339 T340 N369 M481	H293-Q296 HydrophobicContact CB-CB 4.06Å; H293-Q296 HydrophobicContact CB-CG 3.97Å; H293-Q296 PolarHBondContact O-N 2.99Å; Q296-R339 HydrophobicContact CB-CB 4.12Å; Q296-R339 HydrophobicContact CB-CG 3.76Å; Q296-T340 WeakPolarHBondContact O-CB 3.43Å; Q296-T340 PolarHBondContact O-N 3.12Å; Q296-N369 CarbonylContact C-O 3.58Å; Q296-N369 WeakPolarHBondContact CA-O 3.39Å; Q296-M481 VanDerWaalsContact CD-SD 3.56Å; Q296-M481 HydrophobicContact CG-SD 4.01Å
297	V	98.8	Very high	98.5	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.024	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.9	-167.6	178.8	0	0	0	0	111	L299 T340 R342 N369 F370 D371	V297-L299 HydrophobicContact CG1-CB 4.14Å; V297-T340 WeakPolarHBondContact CA-O 3.31Å; V297-R342 HydrophobicContact CG1-CB 3.66Å; V297-N369 PolarHBondContact N-O 2.99Å; V297-F370 HydrophobicContact CB-CD1 4.08Å; V297-F370 HydrophobicContact CB-CE1 4.2Å; V297-F370 HydrophobicContact CG1-CD1 4.09Å; V297-F370 HydrophobicContact CG1-CE1 4.01Å; V297-F370 CarbonylContact O-C 3.58Å; V297-F370 WeakPolarHBondContact O-CA 3.42Å; V297-D371 PolarHBondContact O-N 2.89Å
298	V	98.9	Very high	98.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	114.9	153.7	170.7	0	0	0	0	106.8	T340 L341 R342 D371 L372 M374 A472 V475 A476	V298-T340 PolarHBondContact N-O 3.38Å; V298-L341 HydrophobicContact CB-CD2 4.06Å; V298-L341 HydrophobicContact CG1-CD2 4.16Å; V298-R342 PolarHBondContact O-N 3.28Å; V298-D371 HydrophobicContact CG2-CB 3.9Å; V298-L372 WeakPolarHBondContact CA-O 3.47Å; V298-L372 HydrophobicContact CG1-CB 4.28Å; V298-L372 HydrophobicContact CG2-CB 4.38Å; V298-M374 HydrophobicContact CG1-SD 4.34Å; V298-A472 HydrophobicContact CG1-CB 4.19Å; V298-V475 HydrophobicContact CG2-CB 4.35Å; V298-V475 HydrophobicContact CG2-CG1 3.85Å; V298-A476 HydrophobicContact CB-CB 4.1Å; V298-A476 HydrophobicContact CG2-CB 3.79Å
299	L	98.9	Very high	98.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	135.7	-178	-176.4	152.3	0	0	0	109.3	V297 R342 V344 W346 Y359 F370 L372 V373 M374 I422	V297-L299 HydrophobicContact CG1-CB 4.14Å; L299-R342 CarbonylContact C-O 3.55Å; L299-R342 VanDerWaalsContact CA-O 3.29Å; L299-R342 WeakPolarHBondContact CA-O 3.44Å; L299-V344 HydrophobicContact CD1-CG2 3.68Å; L299-V344 HydrophobicContact CG-CG2 4.07Å; L299-W346 HydrophobicContact CD1-CH2 4.08Å; L299-W346 HydrophobicContact CD1-CZ2 4.32Å; L299-W346 HydrophobicContact CD2-CZ2 3.97Å; L299-Y359 HydrophobicContact CD1-CE1 3.93Å; L299-F370 HydrophobicContact CD1-CE1 4.08Å; L299-L372 PolarHBondContact N-O 3.44Å; L299-V373 HydrophobicContact CB-CB 4.48Å; L299-V373 HydrophobicContact CB-CG1 4.12Å; L299-V373 HydrophobicContact CD2-CB 4.4Å; L299-V373 CarbonylContact O-C 3.57Å; L299-V373 WeakPolarHBondContact O-CA 3.49Å; L299-M374 WeakPolarHBondContact O-CB 3.35Å; L299-M374 WeakPolarHBondContact O-CG 3.26Å; L299-M374 PolarHBondContact O-N 3.22Å; L299-I422 HydrophobicContact CD2-CG2 4.27Å
300	L	98.6	Very high	98.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.5	169.8	44.3	141.5	0	0	0	110	S323 A326 L327 L341 R342 A343 V344 M374 W468 A472	L300-S323 WeakPolarHBondContact CD1-O 3.26Å; L300-A326 HydrophobicContact CD1-CB 3.76Å; L300-L327 HydrophobicContact CD1-CD1 3.61Å; L300-L327 HydrophobicContact CD2-CD1 3.98Å; L300-L327 HydrophobicContact CG-CD1 4.13Å; L300-L341 HydrophobicContact CD2-CD2 4.34Å; L300-R342 PolarHBondContact N-O 3.2Å; L300-A343 HydrophobicContact CD1-CB 4.43Å; L300-A343 CarbonylContact O-C 3.06Å; L300-A343 VanDerWaalsContact O-CA 3.23Å; L300-A343 WeakPolarHBondContact O-CA 3.24Å; L300-V344 PolarHBondContact O-N 3.42Å; L300-M374 CarbonylContact C-O 3.41Å; L300-M374 WeakPolarHBondContact CA-O 3.34Å; L300-M374 HydrophobicContact CB-CB 4.38Å; L300-W468 HydrophobicContact CB-CZ2 4.47Å; L300-A472 HydrophobicContact CD2-CB 3.89Å
301	S	98.8	Very high	98.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	163.6	-172.1	60.6	0	0	0	0	115	S323 V344 W346 M374 E375 S376	S301-S323 VanDerWaalsContact C-OG 3.29Å; S301-S323 PolarHBondContact N-OG 2.85Å; S301-S323 PolarHBondContact O-OG 2.95Å; S301-V344 VanDerWaalsContact CA-O 3.29Å; S301-V344 WeakPolarHBondContact CA-O 3.47Å; S301-V344 WeakPolarHBondContact CB-O 3.38Å; S301-W346 PolarHBondContact OG-NE1 3.37Å; S301-W346 VanDerWaalsContact OG-NE1 3.09Å; S301-M374 PolarHBondContact N-O 2.86Å; S301-M374 PolarHBondContact OG-O 2.89Å; S301-E375 PolarHBondContact OG-OE1 3.05Å; S301-S376 PolarHBondContact O-N 3.25Å; S301-S376 VanDerWaalsContact O-N 3.12Å
302	G	98.5	Very high	98.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	170.2	158.9	0	0	0	0	0	107.2	D316 L345 W346	G302-D316 VanDerWaalsContact C-OD2 3.32Å; G302-D316 WeakPolarHBondContact CA-OD2 3.28Å; G302-L345 WeakPolarHBondContact O-CA 3.43Å; G302-W346 PolarHBondContact O-N 3.03Å; G302-W346 VanDerWaalsContact O-N 3.1Å
303	H	98.7	Very high	98.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	144.6	179.9	76.1	82.9	0	0	0	112.8	D305 D315 D316 W346 E349 E350 D377	H303-D305 PolarHBondContact CE1-O 3.41Å; H303-D305 PolarHBondContact ND1-O 2.82Å; H303-D305 IonicContact ND1-OD1 3.86Å; H303-D315 IonicContact CE1-OD1 2.83Å; H303-D315 PolarHBondContact CE1-OD1 3.06Å; H303-D315 IonicContact NE2-OD1 2.69Å; H303-D315 PolarHBondContact NE2-OD1 2.85Å; H303-D316 WeakPolarHBondContact CD2-CB 3.32Å; H303-D316 PolarHBondContact CE1-N 3.3Å; H303-D316 PolarHBondContact N-OD2 3.43Å; H303-D316 WeakPolarHBondContact NE2-CB 3.38Å; H303-W346 HydrophobicContact CB-CB 3.98Å; H303-E349 HydrophobicContact CB-CB 3.43Å; H303-E349 VanDerWaalsContact CB-CB 3.43Å; H303-E349 HydrophobicContact CB-CG 3.98Å; H303-E349 IonicContact CD2-OE2 3.04Å; H303-E349 VanDerWaalsContact CG-CB 3.48Å; H303-E349 IonicContact NE2-OE2 3.25Å; H303-E350 IonicContact CE1-OE1 3.38Å; H303-D377 IonicContact CD2-OD1 3.69Å; H303-D377 PolarHBondContact CD2-OD1 3.23Å; H303-D377 IonicContact CD2-OD2 3.76Å; H303-D377 IonicContact NE2-OD1 2.84Å; H303-D377 PolarHBondContact NE2-OD1 3.38Å
304	L	97.4	Very high	98.2	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.069	C	C	.	.	S	Bend	trans	-98.1	-14.6	-176.7	-166.5	59.7	0	0	0	112.3	F84 R91 A101 I102 M105 L345 W346	F84-L304 HydrophobicContact CE1-CD1 4.31Å; F84-L304 HydrophobicContact CE2-CD1 4.17Å; F84-L304 HydrophobicContact CZ-CD1 3.56Å; R91-L304 WeakPolarHBondContact CD-O 3.41Å; R91-L304 VanDerWaalsContact CG-O 3.31Å; R91-L304 WeakPolarHBondContact CG-O 3.4Å; R91-L304 PolarHBondContact NE-O 3.43Å; A101-L304 HydrophobicContact CB-CD1 4.39Å; A101-L304 HydrophobicContact CB-CD2 4.31Å; A101-L304 HydrophobicContact CB-CG 4.18Å; I102-L304 HydrophobicContact CB-CD2 4.48Å; I102-L304 HydrophobicContact CG1-CD2 3.83Å; M105-L304 HydrophobicContact CB-CD2 4.35Å; M105-L304 HydrophobicContact CG-CD1 3.79Å; M105-L304 HydrophobicContact CG-CD2 3.98Å; L304-L345 HydrophobicContact CB-CB 4.12Å; L304-L345 HydrophobicContact CD2-CB 4.48Å; L304-W346 WeakPolarHBondContact CA-O 3.13Å; L304-W346 VanDerWaalsContact CB-O 3.31Å; L304-W346 WeakPolarHBondContact CB-O 3.06Å; L304-W346 PolarHBondContact N-O 3.46Å
305	D	98.3	Very high	98.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.057	C	C	.	.			trans	-75.8	178.6	166.9	59	-61.6	0	0	0	111.2	R91 L98 H303 G348 E349 E350	R91-D305 PolarHBondContact NE-O 3.15Å; R91-D305 PolarHBondContact NH2-O 2.92Å; R91-D305 WeakPolarHBondContact O-CA 3.45Å; R91-D305 WeakPolarHBondContact O-CB 3.26Å; L98-D305 HydrophobicContact CD1-CB 4.14Å; L98-D305 HydrophobicContact CD2-CB 4.49Å; H303-D305 PolarHBondContact CE1-O 3.41Å; H303-D305 PolarHBondContact ND1-O 2.82Å; H303-D305 IonicContact ND1-OD1 3.86Å; D305-G348 PolarHBondContact OD1-N 3.4Å; D305-G348 VanDerWaalsContact OD2-CA 3.28Å; D305-G348 WeakPolarHBondContact OD2-CA 3.12Å; D305-G348 PolarHBondContact OD2-N 3.09Å; D305-E349 PolarHBondContact OD1-N 2.98Å; D305-E349 PolarHBondContact OD2-N 3.1Å; D305-E350 VanDerWaalsContact OD2-CB 3.3Å; D305-E350 WeakPolarHBondContact OD2-CB 3.45Å; D305-E350 WeakPolarHBondContact OD2-CG 3.4Å; D305-E350 PolarHBondContact OD2-N 3.43Å; D305-E350 VanDerWaalsContact OD2-N 3.14Å
306	S	98.4	Very high	98.2	Very high	1 Å²	1	6.7 Å²	6.7	1%	0.007	4%	0.037	C	C	.	.			trans	-162.1	167.5	171.3	76.2	0	0	0	0	107.6	R91 V92 E350	R91-S306 CarbonylContact C-O 3.42Å; R91-S306 WeakPolarHBondContact CG-OG 3.25Å; R91-S306 PolarHBondContact N-OG 2.96Å; R91-S306 VanDerWaalsContact N-OG 3.08Å; R91-S306 PolarHBondContact O-N 2.78Å; V92-S306 WeakPolarHBondContact CA-O 3.25Å; V92-S306 WeakPolarHBondContact CB-O 3.43Å; V92-S306 PolarHBondContact N-O 3.02Å; S306-E350 WeakPolarHBondContact CA-OE1 3.47Å
307	W	98.3	Very high	98.2	Very high	7 Å²	7	5.2 Å²	5.2	3%	0.027	3%	0.03	C	C	.	.			trans	-59.4	158.9	161.2	-72.9	95.2	0	0	0	113	N90 T230 G231 W232 V309 E350 H447	N90-W307 VanDerWaalsContact CB-O 3.25Å; N90-W307 WeakPolarHBondContact CB-O 3.44Å; T230-W307 HydrophobicContact CG2-CB 3.74Å; T230-W307 HydrophobicContact CG2-CD2 3.55Å; T230-W307 HydrophobicContact CG2-CE3 3.71Å; T230-W307 HydrophobicContact CG2-CG 3.5Å; T230-W307 VanDerWaalsContact CG2-CG 3.5Å; G231-W307 VanDerWaalsContact CA-CE2 3.45Å; W232-W307 HydrophobicContact CB-CH2 4.16Å; W232-W307 HydrophobicContact CB-CZ2 4.06Å; W232-W307 HydrophobicContact CE3-CH2 4.07Å; W232-W307 VanDerWaalsContact N-CH2 3.35Å; W307-V309 HydrophobicContact CB-CG2 4.1Å; W307-V309 PolarHBondContact O-N 2.74Å; W307-V309 VanDerWaalsContact O-N 3.15Å; W307-E350 VanDerWaalsContact CD1-OE2 3.28Å; W307-E350 HydrophobicContact CZ2-CB 4.19Å; W307-E350 WeakPolarHBondContact CZ2-O 3.34Å; W307-E350 PolarHBondContact N-OE1 2.87Å; W307-E350 VanDerWaalsContact N-OE1 3.09Å; W307-E350 PolarHBondContact NE1-OE1 3.34Å; W307-E350 PolarHBondContact NE1-OE2 3.2Å; W307-H447 AromaticContact CD1-CD2 3.16Å; W307-H447 AromaticContact CD1-CE1 3.74Å; W307-H447 AromaticContact CD1-CG 3.34Å; W307-H447 AromaticContact CD1-ND1 3.71Å; W307-H447 AromaticContact CD1-NE2 3.43Å; W307-H447 HydrophobicContact CG-CB 4.42Å; W307-H447 AromaticContact NE1-CD2 3.37Å; W307-H447 PolarHBondContact NE1-CD2 3.24Å; W307-H447 AromaticContact NE1-CE1 3.1Å; W307-H447 PolarHBondContact NE1-CE1 3.19Å; W307-H447 AromaticContact NE1-CG 3.52Å; W307-H447 AromaticContact NE1-ND1 3.37Å; W307-H447 PolarHBondContact NE1-ND1 3.11Å; W307-H447 AromaticContact NE1-NE2 3.11Å; W307-H447 PolarHBondContact NE1-NE2 3.06Å; W307-H447 VanDerWaalsContact NE1-NE2 3.11Å
308	D	97.2	Very high	98.2	Very high	32 Å²	32	5 Å²	5	17%	0.171	3%	0.029	C	C	.	.	S	Bend	trans	-79.2	19.8	179.6	58.6	-34.7	0	0	0	114.4	N90 V92 R128	N90-D308 PolarHBondContact ND2-O 2.76Å; N90-D308 WeakPolarHBondContact OD1-CA 3.46Å; V92-D308 HydrophobicContact CB-CB 3.89Å; V92-D308 HydrophobicContact CG1-CB 3.76Å; V92-D308 HydrophobicContact CG2-CB 4.47Å; R128-D308 WeakPolarHBondContact CB-OD2 3.37Å; R128-D308 WeakPolarHBondContact CD-OD2 3.36Å; R128-D308 IonicContact CZ-OD1 3.77Å; R128-D308 IonicContact CZ-OD2 2.64Å; R128-D308 VanDerWaalsContact NE-CG 3.27Å; R128-D308 IonicContact NE-OD1 3.58Å; R128-D308 PolarHBondContact NE-OD1 2.91Å; R128-D308 IonicContact NE-OD2 2.85Å; R128-D308 PolarHBondContact NE-OD2 3Å; R128-D308 IonicContact NH2-OD1 2.99Å; R128-D308 PolarHBondContact NH2-OD1 3.34Å; R128-D308 IonicContact NH2-OD2 3.59Å
309	V	96.9	Very high	98.1	Very high	6 Å²	6	5 Å²	5	4%	0.036	3%	0.029	C	C	.	.	S	Bend	trans	-127.2	154.2	175.8	-65.6	0	0	0	0	109.4	L146 T230 W307 E449	L146-V309 HydrophobicContact CD1-CB 4.49Å; L146-V309 HydrophobicContact CD1-CG1 3.91Å; L146-V309 HydrophobicContact CD1-CG2 4.24Å; L146-V309 HydrophobicContact CD2-CG1 3.7Å; L146-V309 HydrophobicContact CG-CG1 4.47Å; T230-V309 HydrophobicContact CG2-CG2 3.95Å; W307-V309 HydrophobicContact CB-CG2 4.1Å; W307-V309 PolarHBondContact O-N 2.74Å; W307-V309 VanDerWaalsContact O-N 3.15Å; V309-E449 HydrophobicContact CB-CG 4.29Å
310	G	97.3	Very high	98.1	Very high	12 Å²	12	5 Å²	5	12%	0.124	3%	0.029	C	C	.	.	S	Bend	trans	61.3	-143.3	-174.1	0	0	0	0	0	111.7	E449	G310-E449 PolarHBondContact N-OE2 2.82Å
311	Q	97.9	Very high	98.1	Very high	40 Å²	40	5 Å²	5	19%	0.187	3%	0.029	C	C	.	.			trans	-124.4	-6.6	-178.3	-63	179.6	-49.7	0	0	113.1	T85 D86 R91 A313 D451 T452 M453	T85-Q311 HydrophobicContact CG2-CB 4.23Å; D86-Q311 PolarHBondContact OD1-NE2 2.98Å; R91-Q311 PolarHBondContact NH1-O 2.93Å; Q311-A313 VanDerWaalsContact C-N 3.32Å; Q311-A313 PolarHBondContact O-N 2.85Å; Q311-D451 PolarHBondContact N-O 2.77Å; Q311-T452 HydrophobicContact CG-CG2 4.27Å; Q311-T452 VanDerWaalsContact OE1-CA 3.28Å; Q311-M453 VanDerWaalsContact OE1-N 3.12Å
312	G	98.3	Very high	98.1	Very high	2 Å²	2	5 Å²	5	2%	0.021	3%	0.029	C	C	.	.			trans	59.5	43.4	-173.3	0	0	0	0	0	111.7	R91 D315 G317 D451	R91-G312 PolarHBondContact NH1-O 2.99Å; R91-G312 PolarHBondContact NH2-O 2.92Å; G312-D315 CarbonylContact C-O 3.6Å; G312-D315 WeakPolarHBondContact CA-O 3.48Å; G312-G317 WeakPolarHBondContact O-CA 3.41Å; G312-G317 PolarHBondContact O-N 3.18Å; G312-D451 VanDerWaalsContact CA-OD2 3.23Å; G312-D451 WeakPolarHBondContact CA-OD2 3.38Å
313	A	98.5	Very high	98.2	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.029	C	C	.	.	I	π-helix	trans	-81.8	-41.6	-170.9	0	0	0	0	0	111.2	L81 T85 Q311 G317 G318 D451 T452 M453 Q456	L81-A313 WeakPolarHBondContact CD2-O 3.34Å; T85-A313 HydrophobicContact CG2-CB 4.26Å; Q311-A313 VanDerWaalsContact C-N 3.32Å; Q311-A313 PolarHBondContact O-N 2.85Å; A313-G317 CarbonylContact O-C 3.57Å; A313-G318 PolarHBondContact O-N 3.18Å; A313-D451 WeakPolarHBondContact CA-OD1 3.42Å; A313-D451 PolarHBondContact N-OD1 3.42Å; A313-D451 PolarHBondContact N-OD2 3.3Å; A313-T452 VanDerWaalsContact CB-C 3.43Å; A313-M453 HydrophobicContact CB-SD 4.28Å; A313-Q456 PolarHBondContact O-NE2 2.72Å
314	M	97.3	Very high	98.2	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.03	C	C	.	.	I	π-helix	trans	-94.5	-22.5	171.1	76.7	-176.7	-171	0	0	113	G379 F381 Y442 F445 H446 D451 V455	M314-G379 WeakPolarHBondContact O-CA 3.2Å; M314-F381 HydrophobicContact SD-CZ 3.75Å; M314-Y442 HydrophobicContact CE-CD2 3.73Å; M314-Y442 HydrophobicContact CE-CE2 3.82Å; M314-Y442 HydrophobicContact CE-CG 4.36Å; M314-Y442 VanDerWaalsContact CE-O 3.25Å; M314-Y442 WeakPolarHBondContact CE-O 2.93Å; M314-Y442 HydrophobicContact CG-CD2 4.25Å; M314-Y442 HydrophobicContact CG-CE2 3.99Å; M314-Y442 HydrophobicContact SD-CD2 3.79Å; M314-Y442 HydrophobicContact SD-CE2 4.1Å; M314-F445 HydrophobicContact CE-CB 3.67Å; M314-F445 HydrophobicContact SD-CB 4.13Å; M314-H446 HydrophobicContact CE-CB 3.67Å; M314-D451 WeakPolarHBondContact CG-OD1 3.45Å; M314-D451 PolarHBondContact N-OD1 3.21Å; M314-V455 HydrophobicContact CB-CG2 3.88Å; M314-V455 HydrophobicContact CG-CG2 4.16Å; M314-V455 HydrophobicContact SD-CG2 3.88Å
315	D	98.2	Very high	98.2	Very high	5 Å²	5	5.5 Å²	5.5	3%	0.027	3%	0.031	C	C	.	.	I	π-helix	trans	-126.2	89.4	-177.3	-171.4	0.9	0	0	0	110.3	H303 G312 Y442 H446 H447 D451	H303-D315 IonicContact CE1-OD1 2.83Å; H303-D315 PolarHBondContact CE1-OD1 3.06Å; H303-D315 IonicContact NE2-OD1 2.69Å; H303-D315 PolarHBondContact NE2-OD1 2.85Å; G312-D315 CarbonylContact C-O 3.6Å; G312-D315 WeakPolarHBondContact CA-O 3.48Å; D315-Y442 HydrophobicContact CB-CE2 4.48Å; D315-Y442 WeakPolarHBondContact CB-OH 3.06Å; D315-Y442 PolarHBondContact OD2-OH 3.45Å; D315-H446 IonicContact OD2-CD2 3.42Å; D315-H446 PolarHBondContact OD2-CD2 2.89Å; D315-H446 IonicContact OD2-CG 3.85Å; D315-H446 IonicContact OD2-NE2 3.76Å; D315-H447 IonicContact OD2-CD2 3.62Å; D315-H447 PolarHBondContact OD2-CD2 3.45Å; D315-H447 VanDerWaalsContact OD2-CD2 3.24Å; D315-H447 IonicContact OD2-NE2 3.08Å; D315-D451 PolarHBondContact N-OD2 3.1Å
316	D	98	Very high	98.3	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.031	C	C	.	.	I	π-helix	cis	-126.2	45.7	-9.2	-177.4	37.8	0	0	0	112.5	G302 H303 G318 G319 A320 S376 D377	G302-D316 VanDerWaalsContact C-OD2 3.32Å; G302-D316 WeakPolarHBondContact CA-OD2 3.28Å; H303-D316 WeakPolarHBondContact CD2-CB 3.32Å; H303-D316 PolarHBondContact CE1-N 3.3Å; H303-D316 PolarHBondContact N-OD2 3.43Å; H303-D316 WeakPolarHBondContact NE2-CB 3.38Å; D316-G318 PolarHBondContact O-N 3.05Å; D316-G319 PolarHBondContact O-N 2.66Å; D316-G319 WeakPolarHBondContact OD1-CA 3.32Å; D316-G319 PolarHBondContact OD1-N 2.71Å; D316-A320 WeakPolarHBondContact O-CB 3.38Å; D316-A320 PolarHBondContact O-N 3.11Å; D316-A320 VanDerWaalsContact O-N 3.09Å; D316-S376 VanDerWaalsContact CG-O 3.25Å; D316-S376 VanDerWaalsContact OD1-O 3.12Å; D316-D377 WeakPolarHBondContact CB-OD1 3.07Å
317	G	98.4	Very high	98.3	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.031	C	C	.	.	I	π-helix	trans	-58.2	-36	174.4	0	0	0	0	0	111.8	L81 R91 G312 A313 M321	L81-G317 WeakPolarHBondContact CD1-O 3.48Å; R91-G317 VanDerWaalsContact NH2-N 3.14Å; G312-G317 WeakPolarHBondContact O-CA 3.41Å; G312-G317 PolarHBondContact O-N 3.18Å; A313-G317 CarbonylContact O-C 3.57Å; G317-M321 VanDerWaalsContact O-CB 3.3Å; G317-M321 WeakPolarHBondContact O-CB 3.34Å; G317-M321 WeakPolarHBondContact O-CG 3.31Å; G317-M321 PolarHBondContact O-N 3Å
318	G	98.4	Very high	98.3	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.03	C	C	.	.	H	α-helix	trans	-59.9	-56.8	176.6	0	0	0	0	0	112.8	A313 D316 A320 M321 I322 T380	A313-G318 PolarHBondContact O-N 3.18Å; D316-G318 PolarHBondContact O-N 3.05Å; G318-A320 PolarHBondContact O-N 3.11Å; G318-M321 PolarHBondContact O-N 3.37Å; G318-M321 VanDerWaalsContact O-N 3.15Å; G318-I322 PolarHBondContact O-N 2.7Å; G318-T380 VanDerWaalsContact C-CG2 3.41Å
319	G	98.6	Very high	98.4	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-59.5	-43.4	179.9	0	0	0	0	0	113.1	D316 M321 I322 S323 S376	D316-G319 PolarHBondContact O-N 2.66Å; D316-G319 WeakPolarHBondContact OD1-CA 3.32Å; D316-G319 PolarHBondContact OD1-N 2.71Å; G319-M321 VanDerWaalsContact C-N 3.33Å; G319-M321 PolarHBondContact O-N 3.32Å; G319-I322 WeakPolarHBondContact O-CG1 2.97Å; G319-S323 WeakPolarHBondContact O-CB 3.22Å; G319-S323 PolarHBondContact O-N 3.47Å; G319-S323 VanDerWaalsContact O-N 3.11Å; G319-S323 PolarHBondContact O-OG 3.05Å; G319-S323 VanDerWaalsContact O-OG 3.05Å; G319-S376 VanDerWaalsContact CA-O 3.31Å; G319-S376 WeakPolarHBondContact CA-O 3.24Å
320	A	98.7	Very high	98.5	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-58.5	-43.8	174	0	0	0	0	0	112.2	D316 G318 S323 W324 L345	D316-A320 WeakPolarHBondContact O-CB 3.38Å; D316-A320 PolarHBondContact O-N 3.11Å; D316-A320 VanDerWaalsContact O-N 3.09Å; G318-A320 PolarHBondContact O-N 3.11Å; A320-S323 PolarHBondContact O-N 2.86Å; A320-W324 PolarHBondContact O-N 3.38Å; A320-W324 VanDerWaalsContact O-N 3.1Å; A320-L345 HydrophobicContact CB-CD2 3.93Å
321	M	98.7	Very high	98.5	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-74.4	-38.5	-176	-86.1	44.6	154.1	0	0	112.7	R80 L81 F84 M105 G317 G318 G319 S323 W324 E325 M461	R80-M321 HydrophobicContact CB-CG 4.46Å; L81-M321 HydrophobicContact CB-CB 4.44Å; L81-M321 HydrophobicContact CB-CE 4.48Å; L81-M321 HydrophobicContact CB-CG 3.89Å; L81-M321 HydrophobicContact CD1-CE 3.64Å; L81-M321 HydrophobicContact CD1-CG 4.2Å; L81-M321 HydrophobicContact CD1-SD 4.32Å; F84-M321 HydrophobicContact CB-CE 3.46Å; F84-M321 VanDerWaalsContact CB-CE 3.46Å; F84-M321 HydrophobicContact CD1-CE 3.13Å; F84-M321 HydrophobicContact CD2-CE 4.09Å; F84-M321 HydrophobicContact CE1-CE 3.79Å; F84-M321 HydrophobicContact CG-CE 3.29Å; F84-M321 HydrophobicContact CZ-CE 4.48Å; M105-M321 HydrophobicContact CE-SD 4.31Å; G317-M321 VanDerWaalsContact O-CB 3.3Å; G317-M321 WeakPolarHBondContact O-CB 3.34Å; G317-M321 WeakPolarHBondContact O-CG 3.31Å; G317-M321 PolarHBondContact O-N 3Å; G318-M321 PolarHBondContact O-N 3.37Å; G318-M321 VanDerWaalsContact O-N 3.15Å; G319-M321 VanDerWaalsContact C-N 3.33Å; G319-M321 PolarHBondContact O-N 3.32Å; M321-S323 VanDerWaalsContact C-N 3.26Å; M321-S323 PolarHBondContact O-N 3Å; M321-W324 PolarHBondContact O-N 3.42Å; M321-E325 VanDerWaalsContact O-CB 3.24Å; M321-E325 WeakPolarHBondContact O-CB 3.37Å; M321-E325 PolarHBondContact O-N 3.25Å; M321-M461 HydrophobicContact CB-CE 4.33Å
322	I	98.8	Very high	98.5	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-68.9	-29.1	175.3	68.1	167.6	0	0	0	111.5	G318 G319 E325 A326 T380 L435 M461 C464 W468	G318-I322 PolarHBondContact O-N 2.7Å; G319-I322 WeakPolarHBondContact O-CG1 2.97Å; I322-E325 PolarHBondContact O-N 2.77Å; I322-A326 WeakPolarHBondContact O-CB 3.21Å; I322-A326 PolarHBondContact O-N 3.25Å; I322-T380 HydrophobicContact CD1-CG2 4.05Å; I322-T380 HydrophobicContact CG1-CG2 4.4Å; I322-T380 HydrophobicContact CG2-CG2 3.96Å; I322-L435 HydrophobicContact CD1-CD2 3.76Å; I322-M461 HydrophobicContact CG2-CE 4.35Å; I322-C464 HydrophobicContact CD1-CB 4.15Å; I322-C464 HydrophobicContact CG2-CB 4.13Å; I322-W468 HydrophobicContact CD1-CD2 4.36Å; I322-W468 HydrophobicContact CD1-CG 4.23Å
323	S	98.8	Very high	98.6	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-69.4	-42.3	174.9	-70	0	0	0	0	112	L300 S301 G319 A320 M321 W468	L300-S323 WeakPolarHBondContact CD1-O 3.26Å; S301-S323 VanDerWaalsContact C-OG 3.29Å; S301-S323 PolarHBondContact N-OG 2.85Å; S301-S323 PolarHBondContact O-OG 2.95Å; G319-S323 WeakPolarHBondContact O-CB 3.22Å; G319-S323 PolarHBondContact O-N 3.47Å; G319-S323 VanDerWaalsContact O-N 3.11Å; G319-S323 PolarHBondContact O-OG 3.05Å; G319-S323 VanDerWaalsContact O-OG 3.05Å; A320-S323 PolarHBondContact O-N 2.86Å; M321-S323 VanDerWaalsContact C-N 3.26Å; M321-S323 PolarHBondContact O-N 3Å; S323-W468 PolarHBondContact OG-NE1 3.35Å
324	W	98.8	Very high	98.6	Very high	8 Å²	8	14 Å²	14	3%	0.03	9%	0.087	C	C	.	.	H	α-helix	trans	-65.4	-43	169.7	172.2	26.8	0	0	0	112.2	R80 M105 A108 M109 D112 A320 M321 A326 L327 S328	R80-W324 HydrophobicContact CB-CE3 4.44Å; R80-W324 HydrophobicContact CB-CH2 4.48Å; R80-W324 HydrophobicContact CB-CZ3 3.83Å; R80-W324 VanDerWaalsContact CD-CZ3 3.47Å; R80-W324 HydrophobicContact CG-CE3 4.44Å; R80-W324 HydrophobicContact CG-CH2 3.86Å; R80-W324 HydrophobicContact CG-CZ3 3.68Å; R80-W324 VanDerWaalsContact CZ-CZ2 3.44Å; M105-W324 HydrophobicContact CE-CB 4.43Å; M105-W324 HydrophobicContact CE-CD2 4.19Å; M105-W324 HydrophobicContact CE-CE3 3.68Å; M105-W324 HydrophobicContact CE-CZ3 4.29Å; M105-W324 HydrophobicContact SD-CE3 4.48Å; A108-W324 HydrophobicContact CB-CH2 3.59Å; A108-W324 HydrophobicContact CB-CZ2 3.83Å; A108-W324 HydrophobicContact CB-CZ3 4.33Å; M109-W324 HydrophobicContact CG-CD2 4.06Å; M109-W324 HydrophobicContact CG-CG 3.85Å; M109-W324 HydrophobicContact SD-CB 4.3Å; M109-W324 HydrophobicContact SD-CG 4.1Å; D112-W324 VanDerWaalsContact OD2-CE2 3.24Å; D112-W324 VanDerWaalsContact OD2-CZ2 3.25Å; D112-W324 WeakPolarHBondContact OD2-CZ2 3.48Å; D112-W324 PolarHBondContact OD2-NE1 3.32Å; A320-W324 PolarHBondContact O-N 3.38Å; A320-W324 VanDerWaalsContact O-N 3.1Å; M321-W324 PolarHBondContact O-N 3.42Å; W324-A326 VanDerWaalsContact C-N 3.3Å; W324-A326 PolarHBondContact O-N 3.41Å; W324-L327 PolarHBondContact O-N 2.91Å; W324-S328 PolarHBondContact NE1-OG 3.11Å; W324-S328 PolarHBondContact O-N 3.19Å; W324-S328 PolarHBondContact O-OG 3.44Å
325	E	98.8	Very high	98.6	Very high	3 Å²	3	15.2 Å²	15.2	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-61.7	-38.9	-179.8	-173.4	61.4	-156	0	0	111.6	R76 R80 M321 I322 L327 S328 L329	R76-E325 IonicContact CZ-OE1 3.19Å; R76-E325 IonicContact CZ-OE2 3.73Å; R76-E325 VanDerWaalsContact NE-CD 3.31Å; R76-E325 IonicContact NE-OE1 3.81Å; R76-E325 PolarHBondContact NE-OE1 3.26Å; R76-E325 IonicContact NE-OE2 2.94Å; R76-E325 PolarHBondContact NE-OE2 3.32Å; R76-E325 IonicContact NH2-OE1 3.78Å; R76-E325 PolarHBondContact NH2-OE1 2.65Å; R76-E325 IonicContact NH2-OE2 3.25Å; R80-E325 IonicContact CZ-OE2 3.64Å; R80-E325 IonicContact NE-OE2 3.2Å; R80-E325 IonicContact NH1-OE2 3.52Å; R80-E325 PolarHBondContact NH1-OE2 2.88Å; M321-E325 VanDerWaalsContact O-CB 3.24Å; M321-E325 WeakPolarHBondContact O-CB 3.37Å; M321-E325 PolarHBondContact O-N 3.25Å; I322-E325 PolarHBondContact O-N 2.77Å; E325-L327 PolarHBondContact O-N 2.78Å; E325-S328 WeakPolarHBondContact O-CA 3.4Å; E325-S328 WeakPolarHBondContact O-CB 3.3Å; E325-S328 PolarHBondContact O-N 3.04Å; E325-L329 HydrophobicContact CG-CD1 4.02Å; E325-L329 HydrophobicContact CG-CG 4.16Å; E325-L329 WeakPolarHBondContact O-CG 3.28Å; E325-L329 PolarHBondContact O-N 2.88Å
326	A	98.9	Very high	98.6	Very high	1 Å²	1	21 Å²	21	1%	0.008	12%	0.115	C	C	.	.	H	α-helix	trans	-56.5	-49.4	176.8	0	0	0	0	0	112.2	L300 I322 W324 S328 L329 I330 W468 A469	L300-A326 HydrophobicContact CD1-CB 3.76Å; I322-A326 WeakPolarHBondContact O-CB 3.21Å; I322-A326 PolarHBondContact O-N 3.25Å; W324-A326 VanDerWaalsContact C-N 3.3Å; W324-A326 PolarHBondContact O-N 3.41Å; A326-S328 VanDerWaalsContact C-N 3.31Å; A326-S328 PolarHBondContact O-N 2.75Å; A326-L329 PolarHBondContact O-N 3.43Å; A326-I330 WeakPolarHBondContact O-CG1 3.19Å; A326-I330 PolarHBondContact O-N 2.93Å; A326-W468 HydrophobicContact CB-CB 4.49Å; A326-A469 HydrophobicContact CB-CB 3.95Å
327	L	98.9	Very high	98.6	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-42	174.3	-89.2	63.3	0	0	0	111.2	L114 A286 I288 L300 W324 E325 L329 I330 K331 L341 A343	L114-L327 HydrophobicContact CD1-CB 3.94Å; L114-L327 HydrophobicContact CD1-CD2 4.05Å; L114-L327 HydrophobicContact CD2-CB 3.98Å; L114-L327 HydrophobicContact CD2-CD2 4.31Å; A286-L327 HydrophobicContact CB-CD2 4.23Å; A286-L327 WeakPolarHBondContact O-CD2 3.17Å; I288-L327 HydrophobicContact CD1-CB 4.14Å; I288-L327 HydrophobicContact CD1-CG 4.15Å; I288-L327 VanDerWaalsContact CD1-O 3.29Å; I288-L327 WeakPolarHBondContact CD1-O 3.34Å; I288-L327 HydrophobicContact CG1-CB 4.47Å; I288-L327 HydrophobicContact CG1-CD2 4.49Å; I288-L327 HydrophobicContact CG1-CG 4.16Å; L300-L327 HydrophobicContact CD1-CD1 3.61Å; L300-L327 HydrophobicContact CD2-CD1 3.98Å; L300-L327 HydrophobicContact CG-CD1 4.13Å; W324-L327 PolarHBondContact O-N 2.91Å; E325-L327 PolarHBondContact O-N 2.78Å; L327-L329 PolarHBondContact O-N 3.23Å; L327-I330 PolarHBondContact O-N 2.87Å; L327-K331 WeakPolarHBondContact O-CB 3.3Å; L327-K331 PolarHBondContact O-N 3.42Å; L327-L341 HydrophobicContact CD1-CB 4.26Å; L327-A343 HydrophobicContact CD1-CB 4.04Å; L327-A343 HydrophobicContact CD2-CB 3.94Å
328	S	98.8	Very high	98.7	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.021	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-46.9	-179.6	-53.7	0	0	0	0	111.9	R80 D112 W324 E325 A326 K331 D332	R80-S328 PolarHBondContact NH1-OG 3.3Å; D112-S328 PolarHBondContact OD2-OG 3.01Å; W324-S328 PolarHBondContact NE1-OG 3.11Å; W324-S328 PolarHBondContact O-N 3.19Å; W324-S328 PolarHBondContact O-OG 3.44Å; E325-S328 WeakPolarHBondContact O-CA 3.4Å; E325-S328 WeakPolarHBondContact O-CB 3.3Å; E325-S328 PolarHBondContact O-N 3.04Å; A326-S328 VanDerWaalsContact C-N 3.31Å; A326-S328 PolarHBondContact O-N 2.75Å; S328-K331 PolarHBondContact O-N 3.18Å; S328-D332 WeakPolarHBondContact O-CB 3.38Å; S328-D332 PolarHBondContact O-N 3.37Å
329	L	98.9	Very high	98.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-45.7	178.2	-69	168.4	0	0	0	112.3	L67 A68 A73 E325 A326 L327 K331 D332 L333 A469	L67-L329 HydrophobicContact CB-CD2 4.37Å; L67-L329 HydrophobicContact CD2-CD2 3.78Å; L67-L329 HydrophobicContact CG-CD2 3.76Å; A68-L329 HydrophobicContact CB-CD1 3.75Å; A68-L329 HydrophobicContact CB-CD2 3.97Å; A73-L329 HydrophobicContact CB-CD2 3.53Å; E325-L329 HydrophobicContact CG-CD1 4.02Å; E325-L329 HydrophobicContact CG-CG 4.16Å; E325-L329 WeakPolarHBondContact O-CG 3.28Å; E325-L329 PolarHBondContact O-N 2.88Å; A326-L329 PolarHBondContact O-N 3.43Å; L327-L329 PolarHBondContact O-N 3.23Å; L329-K331 VanDerWaalsContact C-N 3.28Å; L329-K331 PolarHBondContact O-N 2.91Å; L329-D332 PolarHBondContact O-N 2.66Å; L329-L333 WeakPolarHBondContact O-CG 3.44Å; L329-L333 PolarHBondContact O-N 3Å; L329-A469 HydrophobicContact CD1-CB 4.03Å
330	I	98.8	Very high	98.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-43.1	177.1	-65.4	-45.5	0	0	0	110.4	I64 I288 A326 L327 L333 L335 L341 Y473	I64-I330 HydrophobicContact CD1-CD1 3.46Å; I64-I330 VanDerWaalsContact CD1-CD1 3.46Å; I64-I330 HydrophobicContact CG1-CD1 3.94Å; I288-I330 HydrophobicContact CD1-CB 3.99Å; I288-I330 HydrophobicContact CD1-CG2 3.83Å; A326-I330 WeakPolarHBondContact O-CG1 3.19Å; A326-I330 PolarHBondContact O-N 2.93Å; L327-I330 PolarHBondContact O-N 2.87Å; I330-L333 PolarHBondContact O-N 2.76Å; I330-L335 HydrophobicContact CD1-CD1 4.13Å; I330-L335 HydrophobicContact CG2-CB 3.82Å; I330-L335 WeakPolarHBondContact O-CB 3.21Å; I330-L335 PolarHBondContact O-N 2.69Å; I330-L341 HydrophobicContact CB-CD1 4.41Å; I330-L341 HydrophobicContact CG1-CD1 4.07Å; I330-L341 HydrophobicContact CG2-CD1 4.06Å; I330-Y473 HydrophobicContact CD1-CD2 3.73Å; I330-Y473 HydrophobicContact CD1-CG 3.79Å; I330-Y473 HydrophobicContact CG1-CD2 4.15Å; I330-Y473 HydrophobicContact CG2-CD2 3.8Å; I330-Y473 HydrophobicContact CG2-CE2 4.24Å
331	K	98.4	Very high	98.7	Very high	82 Å²	82	23.8 Å²	23.8	36%	0.357	13%	0.125	S	C	.	.	H	α-helix	trans	-67.2	-44.3	179.1	-173	172.3	179.1	-176.9	0	113.1	D112 G113 L114 I288 L327 S328 L329 L333 G334	D112-K331 WeakPolarHBondContact O-CD 3.35Å; D112-K331 WeakPolarHBondContact O-CE 3.17Å; D112-K331 PolarHBondContact O-NZ 3.44Å; G113-K331 PolarHBondContact O-NZ 2.88Å; L114-K331 HydrophobicContact CD2-CD 4.05Å; I288-K331 HydrophobicContact CD1-CB 4.13Å; L327-K331 WeakPolarHBondContact O-CB 3.3Å; L327-K331 PolarHBondContact O-N 3.42Å; S328-K331 PolarHBondContact O-N 3.18Å; L329-K331 VanDerWaalsContact C-N 3.28Å; L329-K331 PolarHBondContact O-N 2.91Å; K331-L333 PolarHBondContact O-N 2.96Å; K331-G334 WeakPolarHBondContact O-CA 3.28Å; K331-G334 PolarHBondContact O-N 3.48Å
332	D	98.6	Very high	98.7	Very high	92 Å²	92	25.5 Å²	25.5	49%	0.492	13%	0.132	S	C	.	.	H	α-helix	trans	-59.6	-33.8	179.2	-71.7	-25.6	0	0	0	112.2	L67 R76 S328 L329 G334	L67-D332 HydrophobicContact CD2-CB 3.84Å; R76-D332 IonicContact CZ-OD2 2.67Å; R76-D332 IonicContact NH1-OD2 2.85Å; R76-D332 PolarHBondContact NH1-OD2 2.9Å; R76-D332 IonicContact NH2-OD2 3.6Å; R76-D332 PolarHBondContact NH2-OD2 3.19Å; S328-D332 WeakPolarHBondContact O-CB 3.38Å; S328-D332 PolarHBondContact O-N 3.37Å; L329-D332 PolarHBondContact O-N 2.66Å; D332-G334 PolarHBondContact O-N 2.79Å
333	L	98.7	Very high	98.7	Very high	32 Å²	32	25.6 Å²	25.6	17%	0.168	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-2	176	-67.8	173.8	0	0	0	113.8	R63 I64 L67 L329 I330 K331 L335	R63-L333 HydrophobicContact CB-CD1 4.3Å; R63-L333 HydrophobicContact CB-CD2 4.41Å; R63-L333 PolarHBondContact NH2-O 2.94Å; I64-L333 HydrophobicContact CB-CD1 4.29Å; I64-L333 HydrophobicContact CG1-CD1 3.56Å; L67-L333 HydrophobicContact CB-CD2 4.43Å; L67-L333 HydrophobicContact CD2-CD1 4.28Å; L67-L333 HydrophobicContact CD2-CD2 3.88Å; L67-L333 HydrophobicContact CD2-CG 3.72Å; L329-L333 WeakPolarHBondContact O-CG 3.44Å; L329-L333 PolarHBondContact O-N 3Å; I330-L333 PolarHBondContact O-N 2.76Å; K331-L333 PolarHBondContact O-N 2.96Å; L333-L335 HydrophobicContact CB-CD1 3.83Å; L333-L335 HydrophobicContact CB-CG 3.73Å; L333-L335 HydrophobicContact CD1-CD1 3.9Å; L333-L335 PolarHBondContact O-N 2.89Å
334	G	98.2	Very high	98.7	Very high	68 Å²	68	25.6 Å²	25.6	70%	0.701	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	21.6	-175.4	0	0	0	0	0	113.2	K331 D332	K331-G334 WeakPolarHBondContact O-CA 3.28Å; K331-G334 PolarHBondContact O-N 3.48Å; D332-G334 PolarHBondContact O-N 2.79Å
335	L	98.5	Very high	98.7	Very high	25 Å²	25	25.2 Å²	25.2	13%	0.131	13%	0.131	C	C	.	.			trans	-81.9	146.6	-179	-62.3	173	0	0	0	110.2	V60 I64 I330 L333 Y473	V60-L335 HydrophobicContact CG1-CD1 3.68Å; V60-L335 HydrophobicContact CG1-CD2 4.34Å; I64-L335 HydrophobicContact CD1-CD1 4.27Å; I64-L335 HydrophobicContact CG1-CD1 4.26Å; I330-L335 HydrophobicContact CD1-CD1 4.13Å; I330-L335 HydrophobicContact CG2-CB 3.82Å; I330-L335 WeakPolarHBondContact O-CB 3.21Å; I330-L335 PolarHBondContact O-N 2.69Å; L333-L335 HydrophobicContact CB-CD1 3.83Å; L333-L335 HydrophobicContact CB-CG 3.73Å; L333-L335 HydrophobicContact CD1-CD1 3.9Å; L333-L335 PolarHBondContact O-N 2.89Å; L335-Y473 HydrophobicContact CB-CD2 4.26Å; L335-Y473 HydrophobicContact CB-CE2 3.6Å; L335-Y473 HydrophobicContact CD1-CD2 4.43Å; L335-Y473 HydrophobicContact CD1-CE2 4.2Å; L335-Y473 HydrophobicContact CG-CE2 4.36Å
336	R	98.2	Very high	98.7	Very high	127 Å²	127	25 Å²	25	48%	0.479	13%	0.13	S	C	.	.			trans	-145.5	112	175.6	-173.1	176.3	180	-167	-5.2	108.9	R289 G290 W291	R289-R336 PolarHBondContact O-NE 2.84Å; R289-R336 PolarHBondContact O-NH2 3.12Å; G290-R336 PolarHBondContact O-NH2 3.45Å; W291-R336 HydrophobicContact CB-CG 4.29Å
337	P	98.6	Very high	98.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.			trans	-76.5	164.6	-177.8	24.2	-24.1	0	0	0	112.5	G290 W291 R339 L341 Y473 A476 D477	G290-P337 VanDerWaalsContact CA-O 3.3Å; G290-P337 WeakPolarHBondContact CA-O 3.27Å; W291-P337 PolarHBondContact N-O 3.06Å; W291-P337 VanDerWaalsContact N-O 3.09Å; P337-R339 VanDerWaalsContact C-N 3.34Å; P337-R339 WeakPolarHBondContact CG-O 3.31Å; P337-R339 PolarHBondContact O-N 2.9Å; P337-L341 HydrophobicContact CG-CD1 3.87Å; P337-L341 HydrophobicContact CG-CG 3.77Å; P337-Y473 HydrophobicContact CB-CD2 4.21Å; P337-Y473 HydrophobicContact CB-CE2 4.01Å; P337-Y473 HydrophobicContact CG-CD2 4.21Å; P337-Y473 HydrophobicContact CG-CE2 4.25Å; P337-A476 HydrophobicContact CB-CB 3.68Å; P337-A476 HydrophobicContact CG-CB 3.94Å; P337-D477 VanDerWaalsContact CA-OD1 3.29Å; P337-D477 WeakPolarHBondContact CA-OD1 3.38Å; P337-D477 HydrophobicContact CB-CB 3.94Å
338	R	98.8	Very high	98.6	Very high	52 Å²	52	25 Å²	25	20%	0.196	13%	0.13	C	C	.	.	S	Bend	trans	-56	-46.5	173.4	-73.1	174.2	-167.5	-127.4	12.3	112.1	G290 W291 Q292 H293 A476 D477	G290-R338 CarbonylContact C-O 3.47Å; G290-R338 WeakPolarHBondContact CA-O 3.25Å; W291-R338 HydrophobicContact CZ2-CG 3.62Å; W291-R338 PolarHBondContact N-O 2.8Å; Q292-R338 HydrophobicContact CB-CB 4.05Å; Q292-R338 HydrophobicContact CB-CG 4.1Å; Q292-R338 PolarHBondContact N-O 3.1Å; Q292-R338 VanDerWaalsContact N-O 3.1Å; Q292-R338 VanDerWaalsContact OE1-CD 3.23Å; H293-R338 PolarHBondContact N-O 2.75Å; R338-A476 PolarHBondContact N-O 3.06Å; R338-D477 VanDerWaalsContact CD-O 3.26Å; R338-D477 WeakPolarHBondContact CD-O 3.35Å; R338-D477 WeakPolarHBondContact CG-OD1 3.11Å; R338-D477 PolarHBondContact N-OD1 2.91Å; R338-D477 PolarHBondContact NE-O 2.98Å
339	R	98.8	Very high	98.6	Very high	3 Å²	3	25.7 Å²	25.7	1%	0.011	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	163.7	178.7	-56.5	-177.8	179.1	83.1	22.1	111.4	G290 H293 Q296 P337 D371 V475 A476 L478 E479	G290-R339 VanDerWaalsContact CA-C 3.45Å; G290-R339 VanDerWaalsContact CA-O 3.26Å; G290-R339 WeakPolarHBondContact CA-O 3.36Å; H293-R339 HydrophobicContact CB-CG 4.28Å; Q296-R339 HydrophobicContact CB-CB 4.12Å; Q296-R339 HydrophobicContact CB-CG 3.76Å; P337-R339 VanDerWaalsContact C-N 3.34Å; P337-R339 WeakPolarHBondContact CG-O 3.31Å; P337-R339 PolarHBondContact O-N 2.9Å; R339-D371 VanDerWaalsContact CD-OD2 3.26Å; R339-D371 WeakPolarHBondContact CD-OD2 3.31Å; R339-D371 IonicContact CZ-OD2 3.6Å; R339-D371 IonicContact NE-OD2 3.24Å; R339-D371 PolarHBondContact NE-OD2 3.35Å; R339-D371 IonicContact NH1-OD2 2.85Å; R339-D371 PolarHBondContact NH1-OD2 2.92Å; R339-V475 PolarHBondContact NH1-O 2.76Å; R339-A476 HydrophobicContact CB-CB 4.27Å; R339-A476 WeakPolarHBondContact CB-O 3.38Å; R339-A476 WeakPolarHBondContact CG-O 3.36Å; R339-A476 PolarHBondContact N-O 2.94Å; R339-L478 PolarHBondContact NH1-O 2.91Å; R339-L478 PolarHBondContact NH2-O 3.36Å; R339-E479 PolarHBondContact NH2-O 3.44Å
340	T	98.9	Very high	98.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.2	175.1	-65.9	0	0	0	0	110.4	E287 I288 G290 P294 Q296 V297 V298	E287-T340 HydrophobicContact CB-CG2 4.14Å; E287-T340 HydrophobicContact CG-CG2 4.14Å; I288-T340 WeakPolarHBondContact O-CA 3.35Å; G290-T340 PolarHBondContact N-OG1 3.44Å; P294-T340 WeakPolarHBondContact CA-OG1 3.24Å; P294-T340 PolarHBondContact O-OG1 2.92Å; Q296-T340 WeakPolarHBondContact O-CB 3.43Å; Q296-T340 PolarHBondContact O-N 3.12Å; V297-T340 WeakPolarHBondContact CA-O 3.31Å; V298-T340 PolarHBondContact N-O 3.38Å
341	L	98.9	Very high	98.3	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.9	162.8	-67.9	174.9	0	0	0	108	E287 I288 V298 L300 L327 I330 P337 A472 A476	E287-L341 VanDerWaalsContact CA-O 3.24Å; E287-L341 WeakPolarHBondContact CA-O 3.17Å; I288-L341 HydrophobicContact CB-CB 4.38Å; I288-L341 PolarHBondContact N-O 3.29Å; I288-L341 PolarHBondContact O-N 2.64Å; V298-L341 HydrophobicContact CB-CD2 4.06Å; V298-L341 HydrophobicContact CG1-CD2 4.16Å; L300-L341 HydrophobicContact CD2-CD2 4.34Å; L327-L341 HydrophobicContact CD1-CB 4.26Å; I330-L341 HydrophobicContact CB-CD1 4.41Å; I330-L341 HydrophobicContact CG1-CD1 4.07Å; I330-L341 HydrophobicContact CG2-CD1 4.06Å; P337-L341 HydrophobicContact CG-CD1 3.87Å; P337-L341 HydrophobicContact CG-CG 3.77Å; L341-A472 HydrophobicContact CD2-CB 3.95Å; L341-A472 WeakPolarHBondContact CD2-O 3.39Å; L341-A476 HydrophobicContact CD2-CB 3.56Å; L341-A476 HydrophobicContact CG-CB 4.18Å
342	R	98.9	Very high	98	Very high	36 Å²	36	24.9 Å²	24.9	14%	0.136	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	113.7	179.4	-177.7	-179.4	-69.6	179.9	-0.3	110	V285 A286 E287 V297 V298 L299 L300 V344 Y359	V285-R342 HydrophobicContact CG1-CG 3.65Å; A286-R342 CarbonylContact O-C 3.51Å; A286-R342 WeakPolarHBondContact O-CA 3.29Å; E287-R342 HydrophobicContact CG-CB 4.2Å; E287-R342 HydrophobicContact CG-CG 4.04Å; E287-R342 IonicContact OE1-CZ 2.77Å; E287-R342 IonicContact OE1-NE 2.64Å; E287-R342 PolarHBondContact OE1-NE 2.77Å; E287-R342 IonicContact OE1-NH2 3.92Å; E287-R342 PolarHBondContact OE1-NH2 3.4Å; V297-R342 HydrophobicContact CG1-CB 3.66Å; V298-R342 PolarHBondContact O-N 3.28Å; L299-R342 CarbonylContact C-O 3.55Å; L299-R342 VanDerWaalsContact CA-O 3.29Å; L299-R342 WeakPolarHBondContact CA-O 3.44Å; L300-R342 PolarHBondContact N-O 3.2Å; R342-V344 HydrophobicContact CG-CG2 3.82Å; R342-Y359 WeakPolarHBondContact CD-OH 3.42Å; R342-Y359 PolarHBondContact NH1-OH 3.48Å
343	A	98.8	Very high	97.9	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.008	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	129.9	163.8	0	0	0	0	0	109.2	V285 A286 L300 L327	V285-A343 WeakPolarHBondContact CA-O 3.38Å; A286-A343 HydrophobicContact CB-CB 4.47Å; A286-A343 PolarHBondContact N-O 2.73Å; A286-A343 PolarHBondContact O-N 3.48Å; L300-A343 HydrophobicContact CD1-CB 4.43Å; L300-A343 CarbonylContact O-C 3.06Å; L300-A343 VanDerWaalsContact O-CA 3.23Å; L300-A343 WeakPolarHBondContact O-CA 3.24Å; L327-A343 HydrophobicContact CD1-CB 4.04Å; L327-A343 HydrophobicContact CD2-CB 3.94Å
344	V	98.8	Very high	97.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.2	168.6	-167.5	0	0	0	0	109.3	N283 V285 L299 L300 S301 R342 W346 Y359	N283-V344 HydrophobicContact CB-CG1 4.28Å; V285-V344 HydrophobicContact CG1-CG2 4.39Å; V285-V344 HydrophobicContact CG2-CG1 4.04Å; V285-V344 HydrophobicContact CG2-CG2 4.31Å; L299-V344 HydrophobicContact CD1-CG2 3.68Å; L299-V344 HydrophobicContact CG-CG2 4.07Å; L300-V344 PolarHBondContact O-N 3.42Å; S301-V344 VanDerWaalsContact CA-O 3.29Å; S301-V344 WeakPolarHBondContact CA-O 3.47Å; S301-V344 WeakPolarHBondContact CB-O 3.38Å; R342-V344 HydrophobicContact CG-CG2 3.82Å; V344-W346 HydrophobicContact CB-CD2 4.42Å; V344-W346 HydrophobicContact CB-CE3 4.2Å; V344-W346 HydrophobicContact CB-CH2 3.66Å; V344-W346 HydrophobicContact CB-CZ2 3.93Å; V344-W346 HydrophobicContact CB-CZ3 3.82Å; V344-W346 HydrophobicContact CG1-CD2 3.99Å; V344-W346 HydrophobicContact CG1-CE3 3.39Å; V344-W346 HydrophobicContact CG1-CH2 3.58Å; V344-W346 HydrophobicContact CG1-CZ2 4.17Å; V344-W346 HydrophobicContact CG1-CZ3 3.16Å; V344-W346 HydrophobicContact CG2-CH2 4.07Å; V344-W346 HydrophobicContact CG2-CZ3 4.43Å; V344-Y359 HydrophobicContact CG2-CE2 4.33Å
345	L	98.8	Very high	97.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.8	175.1	-47.1	-177.2	0	0	0	107.8	M105 M109 T284 G302 L304 A320	M105-L345 HydrophobicContact CB-CD1 4.11Å; M105-L345 HydrophobicContact CE-CD1 3.44Å; M105-L345 VanDerWaalsContact CE-CD1 3.44Å; M105-L345 HydrophobicContact CG-CD1 4.05Å; M109-L345 HydrophobicContact CE-CD1 3.92Å; M109-L345 HydrophobicContact SD-CD1 4.44Å; T284-L345 PolarHBondContact N-O 2.88Å; T284-L345 PolarHBondContact O-N 2.97Å; G302-L345 WeakPolarHBondContact O-CA 3.43Å; L304-L345 HydrophobicContact CB-CB 4.12Å; L304-L345 HydrophobicContact CD2-CB 4.48Å; A320-L345 HydrophobicContact CB-CD2 3.93Å
346	W	98.7	Very high	97.8	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	162	-171.1	-50.8	122.3	0	0	0	112.5	L299 S301 G302 H303 L304 V344 Y359 E375 D421 I422	L299-W346 HydrophobicContact CD1-CH2 4.08Å; L299-W346 HydrophobicContact CD1-CZ2 4.32Å; L299-W346 HydrophobicContact CD2-CZ2 3.97Å; S301-W346 PolarHBondContact OG-NE1 3.37Å; S301-W346 VanDerWaalsContact OG-NE1 3.09Å; G302-W346 PolarHBondContact O-N 3.03Å; G302-W346 VanDerWaalsContact O-N 3.1Å; H303-W346 HydrophobicContact CB-CB 3.98Å; L304-W346 WeakPolarHBondContact CA-O 3.13Å; L304-W346 VanDerWaalsContact CB-O 3.31Å; L304-W346 WeakPolarHBondContact CB-O 3.06Å; L304-W346 PolarHBondContact N-O 3.46Å; V344-W346 HydrophobicContact CB-CD2 4.42Å; V344-W346 HydrophobicContact CB-CE3 4.2Å; V344-W346 HydrophobicContact CB-CH2 3.66Å; V344-W346 HydrophobicContact CB-CZ2 3.93Å; V344-W346 HydrophobicContact CB-CZ3 3.82Å; V344-W346 HydrophobicContact CG1-CD2 3.99Å; V344-W346 HydrophobicContact CG1-CE3 3.39Å; V344-W346 HydrophobicContact CG1-CH2 3.58Å; V344-W346 HydrophobicContact CG1-CZ2 4.17Å; V344-W346 HydrophobicContact CG1-CZ3 3.16Å; V344-W346 HydrophobicContact CG2-CH2 4.07Å; V344-W346 HydrophobicContact CG2-CZ3 4.43Å; W346-Y359 AromaticContact CH2-CD1 3.63Å; W346-Y359 HydrophobicContact CH2-CD1 3.63Å; W346-Y359 AromaticContact CH2-CE1 3.98Å; W346-Y359 HydrophobicContact CH2-CE1 3.98Å; W346-Y359 AromaticContact CH2-CG 3.96Å; W346-Y359 HydrophobicContact CH2-CG 3.96Å; W346-Y359 AromaticContact CZ3-CD1 3.71Å; W346-Y359 HydrophobicContact CZ3-CD1 3.71Å; W346-Y359 HydrophobicContact CZ3-CD2 4.01Å; W346-Y359 HydrophobicContact CZ3-CE1 4.34Å; W346-Y359 AromaticContact CZ3-CG 3.52Å; W346-Y359 HydrophobicContact CZ3-CG 3.52Å; W346-E375 VanDerWaalsContact CD1-OE1 3.23Å; W346-E375 PolarHBondContact NE1-OE1 3.42Å; W346-D421 HydrophobicContact CB-CB 4.43Å; W346-D421 WeakPolarHBondContact CB-OD2 3.29Å; W346-D421 HydrophobicContact CD2-CB 3.79Å; W346-D421 HydrophobicContact CG-CB 3.63Å; W346-D421 VanDerWaalsContact CG-CG 3.41Å; W346-D421 VanDerWaalsContact CG-OD2 3.29Å; W346-D421 HydrophobicContact CZ2-CB 4.33Å; W346-I422 HydrophobicContact CZ2-CG2 4.43Å
347	T	98.3	Very high	97.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.	S	Bend	trans	-138.4	125.4	177.6	-68.4	0	0	0	0	109.5	L98 V121 I123 F282 N283 G355	L98-T347 HydrophobicContact CD1-CG2 4.31Å; L98-T347 HydrophobicContact CD2-CG2 3.73Å; L98-T347 HydrophobicContact CG-CG2 4.38Å; V121-T347 HydrophobicContact CG1-CG2 4.04Å; I123-T347 HydrophobicContact CD1-CG2 3.88Å; I123-T347 HydrophobicContact CG2-CG2 3.92Å; F282-T347 PolarHBondContact O-OG1 2.9Å; N283-T347 PolarHBondContact OD1-N 2.97Å; T347-G355 WeakPolarHBondContact O-CA 3.29Å; T347-G355 PolarHBondContact O-N 2.78Å
348	G	97.4	Very high	97.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	S	Bend	trans	83.9	28.5	-175.2	0	0	0	0	0	113.9	S93 D305 E350 G353 V354	S93-G348 WeakPolarHBondContact OG-CA 3.4Å; D305-G348 PolarHBondContact OD1-N 3.4Å; D305-G348 VanDerWaalsContact OD2-CA 3.28Å; D305-G348 WeakPolarHBondContact OD2-CA 3.12Å; D305-G348 PolarHBondContact OD2-N 3.09Å; G348-E350 VanDerWaalsContact C-N 3.28Å; G348-G353 PolarHBondContact O-N 2.78Å; G348-V354 WeakPolarHBondContact O-CB 3.26Å; G348-V354 PolarHBondContact O-N 2.84Å
349	E	98.3	Very high	97.8	Very high	17 Å²	17	14.4 Å²	14.4	8%	0.079	8%	0.08	C	C	.	.			trans	-60	-45.8	170.3	-169.4	-71.5	147	0	0	109.4	H303 D305 Q351 G352 G353 T420 D421	H303-E349 HydrophobicContact CB-CB 3.43Å; H303-E349 VanDerWaalsContact CB-CB 3.43Å; H303-E349 HydrophobicContact CB-CG 3.98Å; H303-E349 IonicContact CD2-OE2 3.04Å; H303-E349 VanDerWaalsContact CG-CB 3.48Å; H303-E349 IonicContact NE2-OE2 3.25Å; D305-E349 PolarHBondContact OD1-N 2.98Å; D305-E349 PolarHBondContact OD2-N 3.1Å; E349-Q351 PolarHBondContact O-N 3.05Å; E349-G352 CarbonylContact O-C 3.47Å; E349-G352 WeakPolarHBondContact O-CA 2.96Å; E349-G352 PolarHBondContact O-N 3.12Å; E349-G353 PolarHBondContact O-N 2.99Å; E349-T420 HydrophobicContact CG-CG2 4.24Å; E349-T420 WeakPolarHBondContact OE1-CB 3.4Å; E349-T420 WeakPolarHBondContact OE1-CG2 3.41Å; E349-T420 PolarHBondContact OE1-OG1 3.32Å; E349-D421 WeakPolarHBondContact CB-OD2 3.23Å; E349-D421 WeakPolarHBondContact CG-OD2 3.33Å
350	E	96.5	Very high	97.8	Very high	11 Å²	11	15.3 Å²	15.3	5%	0.051	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-13.9	-170.4	-68.1	-85.6	-133.8	0	0	112.8	W232 H303 D305 S306 W307 G348 H447	W232-E350 WeakPolarHBondContact CB-O 3.25Å; H303-E350 IonicContact CE1-OE1 3.38Å; D305-E350 VanDerWaalsContact OD2-CB 3.3Å; D305-E350 WeakPolarHBondContact OD2-CB 3.45Å; D305-E350 WeakPolarHBondContact OD2-CG 3.4Å; D305-E350 PolarHBondContact OD2-N 3.43Å; D305-E350 VanDerWaalsContact OD2-N 3.14Å; S306-E350 WeakPolarHBondContact CA-OE1 3.47Å; W307-E350 VanDerWaalsContact CD1-OE2 3.28Å; W307-E350 HydrophobicContact CZ2-CB 4.19Å; W307-E350 WeakPolarHBondContact CZ2-O 3.34Å; W307-E350 PolarHBondContact N-OE1 2.87Å; W307-E350 VanDerWaalsContact N-OE1 3.09Å; W307-E350 PolarHBondContact NE1-OE1 3.34Å; W307-E350 PolarHBondContact NE1-OE2 3.2Å; G348-E350 VanDerWaalsContact C-N 3.28Å; E350-H447 IonicContact OE2-CE1 3.13Å; E350-H447 IonicContact OE2-NE2 3.22Å; E350-H447 PolarHBondContact OE2-NE2 3.25Å
351	Q	94.8	Very high	97.7	Very high	14 Å²	14	18.8 Å²	18.8	7%	0.065	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	14.3	174.7	-57.4	80.9	45	0	0	113.1	S93 P124 W232 E349 V354	S93-Q351 PolarHBondContact OG-OE1 3.2Å; P124-Q351 HydrophobicContact CB-CG 4.49Å; P124-Q351 HydrophobicContact CG-CB 4.08Å; W232-Q351 HydrophobicContact CD2-CB 4.05Å; W232-Q351 HydrophobicContact CD2-CG 4.18Å; W232-Q351 HydrophobicContact CE3-CB 3.77Å; W232-Q351 HydrophobicContact CE3-CG 3.38Å; W232-Q351 HydrophobicContact CH2-CB 3.93Å; W232-Q351 HydrophobicContact CH2-CG 3.83Å; W232-Q351 HydrophobicContact CZ2-CB 4.21Å; W232-Q351 HydrophobicContact CZ3-CB 3.72Å; W232-Q351 HydrophobicContact CZ3-CG 3.19Å; E349-Q351 PolarHBondContact O-N 3.05Å; Q351-V354 HydrophobicContact CB-CG2 4.4Å
352	G	92.1	Very high	97.6	Very high	41 Å²	41	24.3 Å²	24.3	42%	0.423	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	104.7	42.8	175.4	0	0	0	0	0	114.7	E349	E349-G352 CarbonylContact O-C 3.47Å; E349-G352 WeakPolarHBondContact O-CA 2.96Å; E349-G352 PolarHBondContact O-N 3.12Å
353	G	96	Very high	97.5	Very high	4 Å²	4	24.3 Å²	24.3	4%	0.041	13%	0.133	C	C	.	.	S	Bend	trans	71.6	34.4	171.9	0	0	0	0	0	114.5	G348 E349 G355 Q357 D421	G348-G353 PolarHBondContact O-N 2.78Å; E349-G353 PolarHBondContact O-N 2.99Å; G353-G355 PolarHBondContact O-N 3.03Å; G353-Q357 WeakPolarHBondContact O-CB 3.45Å; G353-Q357 PolarHBondContact O-N 3.32Å; G353-D421 WeakPolarHBondContact CA-OD1 3.26Å
354	V	97.6	Very high	97.3	Very high	28 Å²	28	28.5 Å²	28.5	17%	0.17	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-41.3	-171.5	176.9	0	0	0	0	111.7	V121 K122 I123 P124 G348 Q351 Q358	V121-V354 HydrophobicContact CG2-CG1 4.33Å; K122-V354 WeakPolarHBondContact O-CG1 3.33Å; I123-V354 HydrophobicContact CG2-CG1 4.25Å; P124-V354 HydrophobicContact CG-CG2 4.24Å; G348-V354 WeakPolarHBondContact O-CB 3.26Å; G348-V354 PolarHBondContact O-N 2.84Å; Q351-V354 HydrophobicContact CB-CG2 4.4Å; V354-Q358 PolarHBondContact O-N 2.99Å; V354-Q358 VanDerWaalsContact O-N 3.12Å
355	G	98.3	Very high	97.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-51.7	177.9	0	0	0	0	0	112.6	N283 T347 G353 Q357 Q358 Y359	N283-G355 PolarHBondContact ND2-O 3.06Å; N283-G355 VanDerWaalsContact ND2-O 3.12Å; T347-G355 WeakPolarHBondContact O-CA 3.29Å; T347-G355 PolarHBondContact O-N 2.78Å; G353-G355 PolarHBondContact O-N 3.03Å; G355-Q357 VanDerWaalsContact C-N 3.33Å; G355-Q357 PolarHBondContact O-N 2.94Å; G355-Q358 PolarHBondContact O-N 3.07Å; G355-Y359 WeakPolarHBondContact O-CB 3.39Å; G355-Y359 PolarHBondContact O-N 3.05Å
356	G	98.2	Very high	96.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-41.7	175.8	0	0	0	0	0	112.4	Q358 Y359 F360 D421	G356-Q358 PolarHBondContact O-N 3.44Å; G356-Y359 PolarHBondContact O-N 3.26Å; G356-F360 WeakPolarHBondContact O-CB 3.39Å; G356-F360 PolarHBondContact O-N 3.38Å; G356-D421 VanDerWaalsContact CA-OD1 3.24Å; G356-D421 WeakPolarHBondContact CA-OD1 3.26Å; G356-D421 PolarHBondContact N-OD1 3.2Å
357	Q	98.4	Very high	96.5	Very high	76 Å²	76	43.1 Å²	43.1	36%	0.355	22%	0.223	S	C	.	.	H	α-helix	trans	-62.4	-43.8	177.7	174.9	61.6	93.4	0	0	112.8	G353 G355 N361 L424	G353-Q357 WeakPolarHBondContact O-CB 3.45Å; G353-Q357 PolarHBondContact O-N 3.32Å; G355-Q357 VanDerWaalsContact C-N 3.33Å; G355-Q357 PolarHBondContact O-N 2.94Å; Q357-N361 PolarHBondContact NE2-ND2 3.49Å; Q357-N361 PolarHBondContact O-N 3.48Å; Q357-N361 VanDerWaalsContact O-N 3.09Å; Q357-N361 PolarHBondContact O-ND2 2.99Å; Q357-N361 VanDerWaalsContact O-ND2 3.13Å; Q357-L424 HydrophobicContact CB-CD1 4.18Å; Q357-L424 HydrophobicContact CG-CD1 4.28Å
358	Q	98.5	Very high	96.4	Very high	66 Å²	66	46.6 Å²	46.6	31%	0.308	25%	0.247	S	C	.	.	H	α-helix	trans	-69.6	-40.8	177.9	-77.6	177.5	66.7	0	0	111.6	V121 K122 V354 G355 G356 N361 L362	V121-Q358 HydrophobicContact CG2-CB 4.36Å; V121-Q358 HydrophobicContact CG2-CG 4.49Å; K122-Q358 PolarHBondContact O-NE2 3.08Å; V354-Q358 PolarHBondContact O-N 2.99Å; V354-Q358 VanDerWaalsContact O-N 3.12Å; G355-Q358 PolarHBondContact O-N 3.07Å; G356-Q358 PolarHBondContact O-N 3.44Å; Q358-N361 PolarHBondContact O-N 3Å; Q358-L362 PolarHBondContact O-N 3.44Å
359	Y	98.5	Very high	96.3	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-47.4	174	-176.4	-89.8	0	0	0	111.7	E119 V285 L299 R342 V344 W346 G355 G356 N361 L362 H363 F370 W425	E119-Y359 WeakPolarHBondContact OE2-CD2 3.34Å; E119-Y359 WeakPolarHBondContact OE2-CE2 3.3Å; V285-Y359 HydrophobicContact CG2-CE2 4.47Å; L299-Y359 HydrophobicContact CD1-CE1 3.93Å; R342-Y359 WeakPolarHBondContact CD-OH 3.42Å; R342-Y359 PolarHBondContact NH1-OH 3.48Å; V344-Y359 HydrophobicContact CG2-CE2 4.33Å; W346-Y359 AromaticContact CH2-CD1 3.63Å; W346-Y359 HydrophobicContact CH2-CD1 3.63Å; W346-Y359 AromaticContact CH2-CE1 3.98Å; W346-Y359 HydrophobicContact CH2-CE1 3.98Å; W346-Y359 AromaticContact CH2-CG 3.96Å; W346-Y359 HydrophobicContact CH2-CG 3.96Å; W346-Y359 AromaticContact CZ3-CD1 3.71Å; W346-Y359 HydrophobicContact CZ3-CD1 3.71Å; W346-Y359 HydrophobicContact CZ3-CD2 4.01Å; W346-Y359 HydrophobicContact CZ3-CE1 4.34Å; W346-Y359 AromaticContact CZ3-CG 3.52Å; W346-Y359 HydrophobicContact CZ3-CG 3.52Å; G355-Y359 WeakPolarHBondContact O-CB 3.39Å; G355-Y359 PolarHBondContact O-N 3.05Å; G356-Y359 PolarHBondContact O-N 3.26Å; Y359-N361 VanDerWaalsContact C-N 3.3Å; Y359-N361 PolarHBondContact O-N 3Å; Y359-L362 PolarHBondContact O-N 3.49Å; Y359-L362 VanDerWaalsContact O-N 3.14Å; Y359-H363 AromaticContact CD1-CD2 3.88Å; Y359-H363 AromaticContact CD2-CD2 3.45Å; Y359-H363 VanDerWaalsContact CD2-CD2 3.45Å; Y359-H363 WeakPolarHBondContact CD2-CD2 3.38Å; Y359-H363 AromaticContact CD2-NE2 3.59Å; Y359-H363 HydrophobicContact CE1-CB 4.41Å; Y359-H363 AromaticContact CE1-CD2 3.78Å; Y359-H363 AromaticContact CE2-CD2 3.35Å; Y359-H363 WeakPolarHBondContact CE2-CD2 3.15Å; Y359-H363 AromaticContact CE2-NE2 3.26Å; Y359-H363 VanDerWaalsContact CE2-NE2 3.26Å; Y359-H363 WeakPolarHBondContact CE2-NE2 3.49Å; Y359-H363 AromaticContact CG-CD2 3.72Å; Y359-H363 AromaticContact CZ-CD2 3.51Å; Y359-H363 AromaticContact CZ-NE2 3.75Å; Y359-H363 PolarHBondContact O-CD2 2.98Å; Y359-H363 PolarHBondContact O-N 3.45Å; Y359-F370 HydrophobicContact CE1-CE1 4.41Å; Y359-F370 HydrophobicContact CE1-CZ 4.39Å; Y359-W425 AromaticContact CD1-CZ2 3.76Å; Y359-W425 HydrophobicContact CD1-CZ2 3.76Å; Y359-W425 AromaticContact CE1-CZ2 3.7Å; Y359-W425 HydrophobicContact CE1-CZ2 3.7Å
360	F	98.3	Very high	96.3	Very high	22 Å²	22	48 Å²	48	10%	0.096	26%	0.255	C	S	.	.	H	α-helix	trans	-54.6	-46.9	174	174.3	-99	0	0	0	111.5	G356 L362 H363 K364 I367 L424 W425 A428	G356-F360 WeakPolarHBondContact O-CB 3.39Å; G356-F360 PolarHBondContact O-N 3.38Å; F360-L362 VanDerWaalsContact C-N 3.28Å; F360-L362 PolarHBondContact O-N 2.98Å; F360-H363 PolarHBondContact O-N 3.03Å; F360-K364 HydrophobicContact CD1-CD 4.12Å; F360-K364 HydrophobicContact CD2-CB 4.37Å; F360-K364 HydrophobicContact CE1-CB 4.27Å; F360-K364 HydrophobicContact CE1-CD 3.67Å; F360-K364 HydrophobicContact CE2-CB 4.04Å; F360-K364 HydrophobicContact CZ-CB 4Å; F360-K364 HydrophobicContact CZ-CD 4.1Å; F360-K364 WeakPolarHBondContact O-CB 3.47Å; F360-K364 WeakPolarHBondContact O-CG 3.38Å; F360-K364 PolarHBondContact O-N 3.41Å; F360-I367 HydrophobicContact CE2-CD1 4.32Å; F360-L424 HydrophobicContact CB-CB 4.35Å; F360-L424 HydrophobicContact CB-CD1 4.21Å; F360-L424 HydrophobicContact CD1-CB 3.86Å; F360-L424 HydrophobicContact CD1-CD1 3.94Å; F360-L424 HydrophobicContact CD1-CG 4.5Å; F360-L424 HydrophobicContact CD2-CB 3.82Å; F360-L424 HydrophobicContact CE1-CB 4.06Å; F360-L424 HydrophobicContact CE2-CB 4.04Å; F360-L424 WeakPolarHBondContact CE2-O 3.3Å; F360-L424 HydrophobicContact CG-CB 3.73Å; F360-L424 HydrophobicContact CG-CD1 4.14Å; F360-L424 HydrophobicContact CZ-CB 4.15Å; F360-W425 HydrophobicContact CB-CZ2 4.4Å; F360-W425 AromaticContact CD2-CD2 3.64Å; F360-W425 HydrophobicContact CD2-CD2 3.64Å; F360-W425 AromaticContact CD2-CE2 3.69Å; F360-W425 HydrophobicContact CD2-CE3 4.02Å; F360-W425 AromaticContact CD2-CG 3.92Å; F360-W425 HydrophobicContact CD2-CG 3.92Å; F360-W425 HydrophobicContact CD2-CH2 4.47Å; F360-W425 HydrophobicContact CD2-CZ2 4.13Å; F360-W425 HydrophobicContact CD2-CZ3 4.42Å; F360-W425 AromaticContact CD2-NE1 3.95Å; F360-W425 HydrophobicContact CE2-CD2 4.22Å; F360-W425 HydrophobicContact CE2-CE3 4.24Å; F360-W425 HydrophobicContact CE2-CG 4.47Å; F360-A428 HydrophobicContact CE2-CB 4.02Å; F360-A428 HydrophobicContact CZ-CB 4.02Å
361	N	98	Very high	96.4	Very high	74 Å²	74	47.6 Å²	47.6	40%	0.396	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-34.5	180	-77.8	-38.2	0	0	0	113.5	Q357 Q358 Y359 K364	Q357-N361 PolarHBondContact NE2-ND2 3.49Å; Q357-N361 PolarHBondContact O-N 3.48Å; Q357-N361 VanDerWaalsContact O-N 3.09Å; Q357-N361 PolarHBondContact O-ND2 2.99Å; Q357-N361 VanDerWaalsContact O-ND2 3.13Å; Q358-N361 PolarHBondContact O-N 3Å; Y359-N361 VanDerWaalsContact C-N 3.3Å; Y359-N361 PolarHBondContact O-N 3Å; N361-K364 PolarHBondContact OD1-NZ 2.93Å
362	L	96.9	Very high	96.6	Very high	117 Å²	117	46.9 Å²	46.9	61%	0.613	25%	0.25	S	S	*	.	H	α-helix	trans	-73.8	-37.6	177.9	-176.4	61.1	0	0	0	112.4	Q358 Y359 F360	Q358-L362 PolarHBondContact O-N 3.44Å; Y359-L362 PolarHBondContact O-N 3.49Å; Y359-L362 VanDerWaalsContact O-N 3.14Å; F360-L362 VanDerWaalsContact C-N 3.28Å; F360-L362 PolarHBondContact O-N 2.98Å
363	H	96.8	Very high	96.9	Very high	36 Å²	36	45 Å²	45	17%	0.167	23%	0.23	C	C	.	.	H	α-helix	trans	-104.9	-11.2	-169.2	-67.3	-81.9	0	0	0	115.1	E119 Y359 F360 E365 N366 F370 W425	E119-H363 IonicContact OE1-CE1 3.31Å; E119-H363 IonicContact OE1-NE2 3.54Å; E119-H363 PolarHBondContact OE1-NE2 2.85Å; E119-H363 IonicContact OE2-CD2 3.11Å; E119-H363 IonicContact OE2-CE1 3.81Å; E119-H363 IonicContact OE2-NE2 3.04Å; E119-H363 PolarHBondContact OE2-NE2 3.15Å; Y359-H363 AromaticContact CD1-CD2 3.88Å; Y359-H363 AromaticContact CD2-CD2 3.45Å; Y359-H363 VanDerWaalsContact CD2-CD2 3.45Å; Y359-H363 WeakPolarHBondContact CD2-CD2 3.38Å; Y359-H363 AromaticContact CD2-NE2 3.59Å; Y359-H363 HydrophobicContact CE1-CB 4.41Å; Y359-H363 AromaticContact CE1-CD2 3.78Å; Y359-H363 AromaticContact CE2-CD2 3.35Å; Y359-H363 WeakPolarHBondContact CE2-CD2 3.15Å; Y359-H363 AromaticContact CE2-NE2 3.26Å; Y359-H363 VanDerWaalsContact CE2-NE2 3.26Å; Y359-H363 WeakPolarHBondContact CE2-NE2 3.49Å; Y359-H363 AromaticContact CG-CD2 3.72Å; Y359-H363 AromaticContact CZ-CD2 3.51Å; Y359-H363 AromaticContact CZ-NE2 3.75Å; Y359-H363 PolarHBondContact O-CD2 2.98Å; Y359-H363 PolarHBondContact O-N 3.45Å; F360-H363 PolarHBondContact O-N 3.03Å; H363-E365 PolarHBondContact O-N 3.39Å; H363-E365 VanDerWaalsContact O-N 3.1Å; H363-N366 PolarHBondContact O-N 2.65Å; H363-N366 VanDerWaalsContact O-N 3.09Å; H363-F370 HydrophobicContact CB-CE2 4.24Å; H363-F370 HydrophobicContact CB-CZ 4.11Å; H363-W425 HydrophobicContact CB-CH2 3.7Å; H363-W425 HydrophobicContact CB-CZ2 4.04Å
364	K	94.8	Very high	97.1	Very high	89 Å²	89	44.8 Å²	44.8	39%	0.387	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-61.2	-19.4	-177.4	66	-174.3	179.1	-168.1	0	115.2	F360 N361 N366 I367	F360-K364 HydrophobicContact CD1-CD 4.12Å; F360-K364 HydrophobicContact CD2-CB 4.37Å; F360-K364 HydrophobicContact CE1-CB 4.27Å; F360-K364 HydrophobicContact CE1-CD 3.67Å; F360-K364 HydrophobicContact CE2-CB 4.04Å; F360-K364 HydrophobicContact CZ-CB 4Å; F360-K364 HydrophobicContact CZ-CD 4.1Å; F360-K364 WeakPolarHBondContact O-CB 3.47Å; F360-K364 WeakPolarHBondContact O-CG 3.38Å; F360-K364 PolarHBondContact O-N 3.41Å; N361-K364 PolarHBondContact OD1-NZ 2.93Å; K364-N366 PolarHBondContact O-N 3.06Å; K364-I367 WeakPolarHBondContact O-CB 3.21Å; K364-I367 WeakPolarHBondContact O-CG2 3.44Å; K364-I367 PolarHBondContact O-N 3.1Å; K364-I367 VanDerWaalsContact O-N 3.12Å
365	E	93.3	Very high	97.1	Very high	174 Å²	174	43.5 Å²	43.5	81%	0.813	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-62.6	-32.4	175.5	-65.3	-167.4	163.9	0	0	111.8	H363	H363-E365 PolarHBondContact O-N 3.39Å; H363-E365 VanDerWaalsContact O-N 3.1Å
366	N	91.8	Very high	97.1	Very high	96 Å²	96	43.5 Å²	43.5	51%	0.513	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-101.5	29.4	175.9	-63.2	-51.3	0	0	0	111.6	H363 K364 S368 N369	H363-N366 PolarHBondContact O-N 2.65Å; H363-N366 VanDerWaalsContact O-N 3.09Å; K364-N366 PolarHBondContact O-N 3.06Å; N366-S368 PolarHBondContact O-N 3.05Å; N366-N369 VanDerWaalsContact O-CB 3.31Å; N366-N369 WeakPolarHBondContact O-CB 3.29Å; N366-N369 PolarHBondContact O-N 3.18Å
367	I	94.6	Very high	97.1	Very high	37 Å²	37	44.7 Å²	44.7	19%	0.19	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-55.2	-29.8	-175.1	-168.1	162.6	0	0	0	112.7	F360 K364 N369 F370 W425 A428 V430 R484	F360-I367 HydrophobicContact CE2-CD1 4.32Å; K364-I367 WeakPolarHBondContact O-CB 3.21Å; K364-I367 WeakPolarHBondContact O-CG2 3.44Å; K364-I367 PolarHBondContact O-N 3.1Å; K364-I367 VanDerWaalsContact O-N 3.12Å; I367-N369 PolarHBondContact O-N 3.04Å; I367-N369 VanDerWaalsContact O-N 3.13Å; I367-F370 PolarHBondContact O-N 3.08Å; I367-W425 HydrophobicContact CB-CZ3 4.43Å; I367-W425 HydrophobicContact CD1-CE3 4.24Å; I367-W425 HydrophobicContact CD1-CZ3 4.43Å; I367-W425 HydrophobicContact CG1-CE3 4.07Å; I367-W425 HydrophobicContact CG1-CZ3 3.97Å; I367-A428 HydrophobicContact CD1-CB 3.29Å; I367-V430 HydrophobicContact CD1-CG2 3.84Å; I367-V430 HydrophobicContact CG1-CG2 3.46Å; I367-V430 VanDerWaalsContact CG1-CG2 3.46Å; I367-R484 VanDerWaalsContact O-CZ 3.28Å; I367-R484 PolarHBondContact O-NH1 3.2Å; I367-R484 PolarHBondContact O-NH2 3.16Å
368	S	94.3	Very high	96.9	Very high	74 Å²	74	42.8 Å²	42.8	52%	0.517	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-60.3	-16.9	175.8	56.4	0	0	0	0	114.3	N366 M481 R484	N366-S368 PolarHBondContact O-N 3.05Å; S368-M481 WeakPolarHBondContact O-CE 3.37Å; S368-R484 VanDerWaalsContact CA-NH2 3.33Å; S368-R484 PolarHBondContact O-NH2 3.23Å
369	N	97.2	Very high	96.7	Very high	41 Å²	41	39.7 Å²	39.7	22%	0.219	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-86.6	-15.9	179.7	-68.2	-1.7	0	0	0	113.3	E295 Q296 V297 N366 I367 D371	E295-N369 VanDerWaalsContact O-CB 3.32Å; E295-N369 WeakPolarHBondContact O-CB 3.25Å; E295-N369 PolarHBondContact O-ND2 3.45Å; Q296-N369 CarbonylContact C-O 3.58Å; Q296-N369 WeakPolarHBondContact CA-O 3.39Å; V297-N369 PolarHBondContact N-O 2.99Å; N366-N369 VanDerWaalsContact O-CB 3.31Å; N366-N369 WeakPolarHBondContact O-CB 3.29Å; N366-N369 PolarHBondContact O-N 3.18Å; I367-N369 PolarHBondContact O-N 3.04Å; I367-N369 VanDerWaalsContact O-N 3.13Å; N369-D371 PolarHBondContact O-N 2.63Å
370	F	98.1	Very high	96.7	Very high	6 Å²	6	39.5 Å²	39.5	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	112.8	179.7	-71.9	-98.2	0	0	0	111	V297 L299 Y359 H363 I367 V373 W425 V430 R484	V297-F370 HydrophobicContact CB-CD1 4.08Å; V297-F370 HydrophobicContact CB-CE1 4.2Å; V297-F370 HydrophobicContact CG1-CD1 4.09Å; V297-F370 HydrophobicContact CG1-CE1 4.01Å; V297-F370 CarbonylContact O-C 3.58Å; V297-F370 WeakPolarHBondContact O-CA 3.42Å; L299-F370 HydrophobicContact CD1-CE1 4.08Å; Y359-F370 HydrophobicContact CE1-CE1 4.41Å; Y359-F370 HydrophobicContact CE1-CZ 4.39Å; H363-F370 HydrophobicContact CB-CE2 4.24Å; H363-F370 HydrophobicContact CB-CZ 4.11Å; I367-F370 PolarHBondContact O-N 3.08Å; F370-V373 HydrophobicContact CD1-CG1 4.27Å; F370-W425 HydrophobicContact CB-CZ3 4.4Å; F370-W425 HydrophobicContact CD1-CE3 4.48Å; F370-W425 HydrophobicContact CD1-CH2 4.26Å; F370-W425 HydrophobicContact CD1-CZ3 4.15Å; F370-W425 HydrophobicContact CD2-CE3 4.31Å; F370-W425 AromaticContact CD2-CH2 3.74Å; F370-W425 HydrophobicContact CD2-CH2 3.74Å; F370-W425 AromaticContact CD2-CZ3 3.42Å; F370-W425 HydrophobicContact CD2-CZ3 3.42Å; F370-W425 VanDerWaalsContact CD2-CZ3 3.42Å; F370-W425 AromaticContact CE1-CH2 3.92Å; F370-W425 HydrophobicContact CE1-CH2 3.92Å; F370-W425 HydrophobicContact CE1-CZ2 4.21Å; F370-W425 HydrophobicContact CE1-CZ3 4.28Å; F370-W425 AromaticContact CE2-CH2 3.36Å; F370-W425 HydrophobicContact CE2-CH2 3.36Å; F370-W425 HydrophobicContact CE2-CZ2 4.35Å; F370-W425 AromaticContact CE2-CZ3 3.58Å; F370-W425 HydrophobicContact CE2-CZ3 3.58Å; F370-W425 HydrophobicContact CG-CE3 4.19Å; F370-W425 HydrophobicContact CG-CH2 4.18Å; F370-W425 AromaticContact CG-CZ3 3.73Å; F370-W425 HydrophobicContact CG-CZ3 3.73Å; F370-W425 AromaticContact CZ-CH2 3.46Å; F370-W425 HydrophobicContact CZ-CH2 3.46Å; F370-W425 VanDerWaalsContact CZ-CH2 3.46Å; F370-W425 HydrophobicContact CZ-CZ2 4.02Å; F370-W425 HydrophobicContact CZ-CZ3 4.01Å; F370-V430 HydrophobicContact CB-CG1 3.96Å; F370-V430 HydrophobicContact CB-CG2 4.32Å; F370-R484 PolarHBondContact O-NH2 2.69Å
371	D	98.4	Very high	96.6	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-49	-177	-162.7	-1.4	0	0	0	111.6	V297 V298 R339 N369 P431 M481 L482	V297-D371 PolarHBondContact O-N 2.89Å; V298-D371 HydrophobicContact CG2-CB 3.9Å; R339-D371 VanDerWaalsContact CD-OD2 3.26Å; R339-D371 WeakPolarHBondContact CD-OD2 3.31Å; R339-D371 IonicContact CZ-OD2 3.6Å; R339-D371 IonicContact NE-OD2 3.24Å; R339-D371 PolarHBondContact NE-OD2 3.35Å; R339-D371 IonicContact NH1-OD2 2.85Å; R339-D371 PolarHBondContact NH1-OD2 2.92Å; N369-D371 PolarHBondContact O-N 2.63Å; D371-P431 WeakPolarHBondContact O-CD 3.24Å; D371-P431 WeakPolarHBondContact O-CG 3.48Å; D371-M481 HydrophobicContact CB-CE 3.61Å; D371-M481 HydrophobicContact CB-CG 4.2Å; D371-M481 WeakPolarHBondContact OD1-CA 3.42Å; D371-M481 WeakPolarHBondContact OD1-CB 3.24Å; D371-L482 WeakPolarHBondContact OD1-CB 3.29Å; D371-L482 PolarHBondContact OD1-N 2.99Å
372	L	98.7	Very high	96.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	139.6	-179.8	178.1	63.6	0	0	0	108.2	V298 L299 M374 F388 P431 A433 V471 V475 L482	V298-L372 WeakPolarHBondContact CA-O 3.47Å; V298-L372 HydrophobicContact CG1-CB 4.28Å; V298-L372 HydrophobicContact CG2-CB 4.38Å; L299-L372 PolarHBondContact N-O 3.44Å; L372-M374 HydrophobicContact CD1-CG 4.4Å; L372-M374 HydrophobicContact CD2-CG 3.67Å; L372-M374 HydrophobicContact CD2-SD 3.6Å; L372-M374 HydrophobicContact CG-CG 3.63Å; L372-M374 HydrophobicContact CG-SD 4.22Å; L372-F388 HydrophobicContact CD1-CD2 4.39Å; L372-F388 HydrophobicContact CD1-CE2 3.94Å; L372-P431 HydrophobicContact CD1-CB 4.04Å; L372-P431 WeakPolarHBondContact CD1-O 3.33Å; L372-A433 HydrophobicContact CD1-CB 4.15Å; L372-V471 HydrophobicContact CD2-CG1 4.34Å; L372-V475 HydrophobicContact CB-CG1 4.09Å; L372-V475 HydrophobicContact CD2-CB 4.34Å; L372-V475 HydrophobicContact CD2-CG1 4.14Å; L372-V475 HydrophobicContact CD2-CG2 4.1Å; L372-L482 HydrophobicContact CB-CD1 4.28Å; L372-L482 HydrophobicContact CD1-CD1 4.34Å
373	V	98.8	Very high	96.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.9	166.7	-61.6	0	0	0	0	108.6	L299 F370 I422 W425 M426 V430 P431 G432 A433	L299-V373 HydrophobicContact CB-CB 4.48Å; L299-V373 HydrophobicContact CB-CG1 4.12Å; L299-V373 HydrophobicContact CD2-CB 4.4Å; L299-V373 CarbonylContact O-C 3.57Å; L299-V373 WeakPolarHBondContact O-CA 3.49Å; F370-V373 HydrophobicContact CD1-CG1 4.27Å; V373-I422 HydrophobicContact CB-CB 4.24Å; V373-I422 HydrophobicContact CB-CG2 4.08Å; V373-I422 HydrophobicContact CG2-CB 3.91Å; V373-I422 HydrophobicContact CG2-CD1 4.16Å; V373-I422 HydrophobicContact CG2-CG2 4.31Å; V373-W425 HydrophobicContact CG1-CB 4.08Å; V373-W425 HydrophobicContact CG1-CD2 4.36Å; V373-W425 HydrophobicContact CG1-CG 4.08Å; V373-W425 HydrophobicContact CG2-CB 3.86Å; V373-M426 HydrophobicContact CG2-CG 4.44Å; V373-V430 HydrophobicContact CG1-CG1 4.05Å; V373-V430 HydrophobicContact CG2-CG1 4.38Å; V373-P431 PolarHBondContact N-O 3.33Å; V373-G432 CarbonylContact O-C 3.55Å; V373-G432 VanDerWaalsContact O-CA 3.27Å; V373-G432 WeakPolarHBondContact O-CA 3.02Å; V373-A433 PolarHBondContact O-N 2.77Å
374	M	98.8	Very high	96.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.6	-174.1	-48.1	175.4	51.6	0	0	110.1	V298 L299 L300 S301 L372 A433 W468 V471 A472	V298-M374 HydrophobicContact CG1-SD 4.34Å; L299-M374 WeakPolarHBondContact O-CB 3.35Å; L299-M374 WeakPolarHBondContact O-CG 3.26Å; L299-M374 PolarHBondContact O-N 3.22Å; L300-M374 CarbonylContact C-O 3.41Å; L300-M374 WeakPolarHBondContact CA-O 3.34Å; L300-M374 HydrophobicContact CB-CB 4.38Å; S301-M374 PolarHBondContact N-O 2.86Å; S301-M374 PolarHBondContact OG-O 2.89Å; L372-M374 HydrophobicContact CD1-CG 4.4Å; L372-M374 HydrophobicContact CD2-CG 3.67Å; L372-M374 HydrophobicContact CD2-SD 3.6Å; L372-M374 HydrophobicContact CG-CG 3.63Å; L372-M374 HydrophobicContact CG-SD 4.22Å; M374-A433 CarbonylContact C-O 3.48Å; M374-A433 VanDerWaalsContact CA-O 3.23Å; M374-A433 WeakPolarHBondContact CA-O 3.32Å; M374-A433 HydrophobicContact CG-CB 4.2Å; M374-W468 HydrophobicContact CB-CH2 3.49Å; M374-W468 VanDerWaalsContact CB-CH2 3.49Å; M374-W468 HydrophobicContact CB-CZ2 3.43Å; M374-W468 VanDerWaalsContact CB-CZ2 3.43Å; M374-W468 HydrophobicContact CB-CZ3 4.28Å; M374-W468 HydrophobicContact CE-CD2 3.74Å; M374-W468 HydrophobicContact CE-CE3 3.48Å; M374-W468 VanDerWaalsContact CE-CE3 3.48Å; M374-W468 HydrophobicContact CE-CH2 3.87Å; M374-W468 HydrophobicContact CE-CZ2 4.11Å; M374-W468 HydrophobicContact CE-CZ3 3.55Å; M374-V471 HydrophobicContact CE-CB 4.05Å; M374-V471 HydrophobicContact CE-CG1 3.66Å; M374-V471 HydrophobicContact SD-CG1 4.07Å; M374-A472 HydrophobicContact SD-CB 4.07Å
375	E	98.8	Very high	96.8	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	139	178.3	-176.7	142	-88.4	0	0	112.1	S301 W346 D377 G419 T420 D421 I422 A433 S434 L435 W468	S301-E375 PolarHBondContact OG-OE1 3.05Å; W346-E375 VanDerWaalsContact CD1-OE1 3.23Å; W346-E375 PolarHBondContact NE1-OE1 3.42Å; E375-D377 HydrophobicContact CG-CB 4.14Å; E375-G419 WeakPolarHBondContact OE2-CA 3.42Å; E375-T420 PolarHBondContact OE2-N 3.27Å; E375-D421 PolarHBondContact OE2-N 2.81Å; E375-I422 HydrophobicContact CB-CD1 3.63Å; E375-I422 HydrophobicContact CB-CG1 3.72Å; E375-I422 HydrophobicContact CB-CG2 4.08Å; E375-I422 PolarHBondContact OE2-N 3.37Å; E375-A433 PolarHBondContact N-O 3.05Å; E375-S434 WeakPolarHBondContact O-CA 3.49Å; E375-S434 WeakPolarHBondContact O-CB 3.35Å; E375-L435 PolarHBondContact O-N 2.99Å; E375-W468 VanDerWaalsContact C-CH2 3.48Å; E375-W468 WeakPolarHBondContact O-CH2 3.49Å
376	S	98.3	Very high	97	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.007	13%	0.129	C	C	.	.			trans	-121.4	111	171.8	173.3	0	0	0	0	108	S301 D316 G319	S301-S376 PolarHBondContact O-N 3.25Å; S301-S376 VanDerWaalsContact O-N 3.12Å; D316-S376 VanDerWaalsContact CG-O 3.25Å; D316-S376 VanDerWaalsContact OD1-O 3.12Å; G319-S376 VanDerWaalsContact CA-O 3.31Å; G319-S376 WeakPolarHBondContact CA-O 3.24Å
377	D	97.2	Very high	97.3	Very high	25 Å²	25	19.2 Å²	19.2	13%	0.134	11%	0.108	C	C	.	.			trans	-147.6	27.9	-173	-171.3	29.4	0	0	0	112.4	H303 D316 E375 Y442	H303-D377 IonicContact CD2-OD1 3.69Å; H303-D377 PolarHBondContact CD2-OD1 3.23Å; H303-D377 IonicContact CD2-OD2 3.76Å; H303-D377 IonicContact NE2-OD1 2.84Å; H303-D377 PolarHBondContact NE2-OD1 3.38Å; D316-D377 WeakPolarHBondContact CB-OD1 3.07Å; E375-D377 HydrophobicContact CG-CB 4.14Å; D377-Y442 PolarHBondContact O-OH 3.04Å
378	L	95	Very high	97.5	Very high	36 Å²	36	17.5 Å²	17.5	19%	0.188	10%	0.1	C	C	.	.	S	Bend	trans	-127.7	35.2	174.8	-72.4	177	0	0	0	110.6	E418 V437 Y442	L378-E418 VanDerWaalsContact CD1-CD 3.41Å; L378-E418 HydrophobicContact CD1-CG 4.32Å; L378-E418 WeakPolarHBondContact CD1-OE1 3.45Å; L378-V437 WeakPolarHBondContact O-CG2 3.35Å; L378-Y442 VanDerWaalsContact C-CE2 3.42Å; L378-Y442 HydrophobicContact CD2-CD1 4.06Å; L378-Y442 HydrophobicContact CD2-CE1 3.74Å
379	G	95.1	Very high	97.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.			trans	76.8	-177.4	-171.6	0	0	0	0	0	113.5	M314	M314-G379 WeakPolarHBondContact O-CA 3.2Å
380	T	97.3	Very high	97.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.			trans	-128	51.5	-179.8	47.8	0	0	0	0	110.2	G318 I322 Q456	G318-T380 VanDerWaalsContact C-CG2 3.41Å; I322-T380 HydrophobicContact CD1-CG2 4.05Å; I322-T380 HydrophobicContact CG1-CG2 4.4Å; I322-T380 HydrophobicContact CG2-CG2 3.96Å; T380-Q456 VanDerWaalsContact OG1-CD 3.28Å; T380-Q456 PolarHBondContact OG1-NE2 3.34Å; T380-Q456 PolarHBondContact OG1-OE1 3.32Å
381	F	97.6	Very high	97.4	Very high	4 Å²	4	15.2 Å²	15.2	2%	0.018	9%	0.086	C	C	.	.			trans	-79.3	179.7	173.8	-49.9	-68.5	0	0	0	111.2	M314 P383 V437 Y442 C464	M314-F381 HydrophobicContact SD-CZ 3.75Å; F381-P383 WeakPolarHBondContact O-CD 3.09Å; F381-V437 HydrophobicContact CB-CB 4.08Å; F381-V437 HydrophobicContact CB-CG2 4.23Å; F381-V437 HydrophobicContact CD2-CG2 3.86Å; F381-V437 WeakPolarHBondContact O-CB 3.41Å; F381-V437 VanDerWaalsContact O-CG1 3.29Å; F381-V437 WeakPolarHBondContact O-CG1 3.24Å; F381-Y442 AromaticContact CE2-CD2 3.84Å; F381-Y442 HydrophobicContact CE2-CD2 3.84Å; F381-Y442 HydrophobicContact CE2-CG 4.43Å; F381-Y442 HydrophobicContact CZ-CD2 4.33Å; F381-C464 PolarHBondContact O-SG 3.37Å
382	T	97.9	Very high	97.2	Very high	67 Å²	67	21.4 Å²	21.4	41%	0.411	12%	0.119	S	C	.	.	S	Bend	trans	-43	114.2	178.2	-50.5	0	0	0	0	111.5	M384 V437 A438 D460	T382-M384 PolarHBondContact O-N 2.93Å; T382-V437 CarbonylContact O-C 3.57Å; T382-V437 WeakPolarHBondContact O-CA 3.42Å; T382-A438 PolarHBondContact O-N 3.04Å; T382-D460 VanDerWaalsContact CA-CG 3.43Å; T382-D460 VanDerWaalsContact CA-OD1 3.23Å; T382-D460 WeakPolarHBondContact CA-OD1 3.21Å; T382-D460 WeakPolarHBondContact CB-OD1 3.45Å; T382-D460 PolarHBondContact N-OD1 3.36Å; T382-D460 PolarHBondContact N-OD2 2.79Å; T382-D460 PolarHBondContact OG1-OD1 3.2Å; T382-D460 PolarHBondContact OG1-OD2 3.43Å
383	P	97.8	Very high	97	Very high	8 Å²	8	23 Å²	23	5%	0.052	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.6	-175.4	27.8	-34.2	0	0	0	110.4	F381 V410 L435 L463 L467	F381-P383 WeakPolarHBondContact O-CD 3.09Å; P383-V410 HydrophobicContact CB-CG1 4.2Å; P383-V410 HydrophobicContact CB-CG2 4.35Å; P383-V410 HydrophobicContact CG-CG2 4.01Å; P383-L435 HydrophobicContact CB-CD1 4.34Å; P383-L463 HydrophobicContact CG-CB 3.51Å; P383-L463 HydrophobicContact CG-CD1 4.41Å; P383-L467 HydrophobicContact CB-CD1 4.39Å
384	M	97	Very high	96.8	Very high	88 Å²	88	23 Å²	23	43%	0.433	13%	0.132	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-22	-178.7	-67.6	-171.1	61.8	0	0	112.6	T382 K412 H436 A438	T382-M384 PolarHBondContact O-N 2.93Å; M384-K412 VanDerWaalsContact O-CB 3.29Å; M384-K412 WeakPolarHBondContact O-CB 3.18Å; M384-H436 PolarHBondContact N-O 3.42Å; M384-A438 HydrophobicContact CG-CB 4.29Å; M384-A438 HydrophobicContact SD-CB 3.96Å
385	G	97	Very high	96.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-167.4	-179.4	0	0	0	0	0	113.1	K412 H436	G385-K412 CarbonylContact C-O 3.58Å; G385-K412 VanDerWaalsContact CA-O 3.24Å; G385-K412 WeakPolarHBondContact CA-O 3.35Å; G385-H436 PolarHBondContact N-O 3Å; G385-H436 PolarHBondContact O-N 3.23Å; G385-H436 VanDerWaalsContact O-N 3.15Å
386	L	98.1	Very high	96.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	130.4	167.9	-167.1	78.7	0	0	0	108.6	M398 I402 K412 L413 E414 A433 S434 L467 W468 V471	L386-M398 HydrophobicContact CD2-CE 3.52Å; L386-I402 HydrophobicContact CB-CD1 3.6Å; L386-I402 HydrophobicContact CD2-CD1 4.44Å; L386-K412 PolarHBondContact N-O 2.66Å; L386-L413 HydrophobicContact CB-CD1 4.12Å; L386-L413 HydrophobicContact CD2-CD1 4.11Å; L386-L413 CarbonylContact O-C 3.58Å; L386-L413 WeakPolarHBondContact O-CA 3.14Å; L386-E414 PolarHBondContact O-N 2.82Å; L386-A433 HydrophobicContact CD1-CB 4.06Å; L386-A433 HydrophobicContact CD2-CB 4.03Å; L386-A433 HydrophobicContact CG-CB 4.1Å; L386-S434 WeakPolarHBondContact CD1-O 3.48Å; L386-L467 HydrophobicContact CD1-CD2 4.02Å; L386-W468 HydrophobicContact CD1-CZ3 4.17Å; L386-V471 HydrophobicContact CD2-CG1 4.1Å; L386-V471 HydrophobicContact CD2-CG2 4.36Å
387	Q	98.3	Very high	96.5	Very high	14 Å²	14	31.6 Å²	31.6	7%	0.065	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.5	163.1	-86	168.3	-25.7	0	0	107.8	E414 D416 E418 A433 S434 H436	Q387-E414 HydrophobicContact CG-CB 4.02Å; Q387-D416 CarbonylContact C-O 3.56Å; Q387-D416 VanDerWaalsContact CA-O 3.22Å; Q387-D416 WeakPolarHBondContact CA-O 3.33Å; Q387-D416 WeakPolarHBondContact CB-O 3.29Å; Q387-E418 PolarHBondContact NE2-OE1 3.14Å; Q387-E418 VanDerWaalsContact NE2-OE1 3.1Å; Q387-E418 PolarHBondContact OE1-OE1 2.81Å; Q387-E418 VanDerWaalsContact OE1-OE1 3.06Å; Q387-A433 CarbonylContact O-C 3.56Å; Q387-A433 WeakPolarHBondContact O-CA 3.37Å; Q387-A433 WeakPolarHBondContact O-CB 3.48Å; Q387-S434 WeakPolarHBondContact CB-OG 3.29Å; Q387-S434 PolarHBondContact N-O 3.49Å; Q387-S434 PolarHBondContact O-N 3Å; Q387-S434 PolarHBondContact OE1-OG 3Å; Q387-H436 HydrophobicContact CG-CB 4.15Å
388	F	98.1	Very high	96.6	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.009	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	126.2	-178.7	178.9	-101.6	0	0	0	113.2	L372 A394 R395 M398 L413 E414 T415 D416 P431 G432 A433 L482	L372-F388 HydrophobicContact CD1-CD2 4.39Å; L372-F388 HydrophobicContact CD1-CE2 3.94Å; F388-A394 HydrophobicContact CE1-CB 4.14Å; F388-A394 HydrophobicContact CZ-CB 3.88Å; F388-R395 HydrophobicContact CD1-CB 4.48Å; F388-R395 HydrophobicContact CE1-CB 4.31Å; F388-M398 HydrophobicContact CD1-CB 4.3Å; F388-M398 HydrophobicContact CD1-CG 4.04Å; F388-M398 HydrophobicContact CD2-CE 4.35Å; F388-M398 HydrophobicContact CD2-CG 3.82Å; F388-M398 HydrophobicContact CE1-CB 4.43Å; F388-M398 HydrophobicContact CE1-CG 3.84Å; F388-M398 HydrophobicContact CE2-CG 3.61Å; F388-M398 HydrophobicContact CE2-SD 4.31Å; F388-M398 HydrophobicContact CG-CB 4.4Å; F388-M398 HydrophobicContact CG-CG 4.03Å; F388-M398 HydrophobicContact CZ-CG 3.61Å; F388-L413 HydrophobicContact CB-CD1 3.63Å; F388-L413 HydrophobicContact CB-CG 4.32Å; F388-L413 HydrophobicContact CG-CD1 4.45Å; F388-E414 PolarHBondContact N-O 3.33Å; F388-T415 CarbonylContact O-C 3.53Å; F388-D416 CarbonylContact C-O 3.54Å; F388-D416 PolarHBondContact N-O 3.33Å; F388-P431 HydrophobicContact CE2-CB 3.93Å; F388-P431 HydrophobicContact CZ-CB 3.99Å; F388-G432 WeakPolarHBondContact CA-O 3.39Å; F388-G432 VanDerWaalsContact CD2-O 3.32Å; F388-G432 WeakPolarHBondContact CD2-O 3.29Å; F388-A433 HydrophobicContact CD2-CB 4.28Å; F388-L482 HydrophobicContact CE2-CD1 4.24Å; F388-L482 HydrophobicContact CZ-CD1 4.35Å
389	L	97.3	Very high	96.7	Very high	42 Å²	42	32.3 Å²	32.3	22%	0.22	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	112.3	172.5	-170.6	76.3	0	0	0	110.4	A417 M426 P431 G432	L389-A417 HydrophobicContact CB-CB 3.72Å; L389-M426 HydrophobicContact CB-SD 4.16Å; L389-M426 HydrophobicContact CD2-CB 3.99Å; L389-M426 HydrophobicContact CD2-CG 4.29Å; L389-M426 HydrophobicContact CD2-SD 3.82Å; L389-P431 WeakPolarHBondContact O-CA 3.37Å; L389-G432 PolarHBondContact N-O 3.08Å; L389-G432 PolarHBondContact O-N 3.45Å
390	G	95.3	Very high	96.9	Very high	12 Å²	12	34.7 Å²	34.7	12%	0.124	18%	0.182	C	C	.	.	S	Bend	trans	-161.2	-171.6	177.8	0	0	0	0	0	113.1	R485	G390-R485 VanDerWaalsContact C-NE 3.32Å; G390-R485 VanDerWaalsContact O-CZ 3.29Å; G390-R485 PolarHBondContact O-NE 3.26Å; G390-R485 PolarHBondContact O-NH2 3.38Å
391	S	95	Very high	96.9	Very high	18 Å²	18	34.7 Å²	34.7	13%	0.126	18%	0.182	C	C	.	.			trans	-69.8	160.9	170.1	70.6	0	0	0	0	111	A393 A394 R395 P483	S391-A393 PolarHBondContact O-N 3.48Å; S391-A394 PolarHBondContact O-N 2.99Å; S391-A394 VanDerWaalsContact O-N 3.14Å; S391-A394 WeakPolarHBondContact OG-CB 3.23Å; S391-A394 PolarHBondContact OG-N 3.13Å; S391-R395 PolarHBondContact O-N 3.09Å; S391-P483 PolarHBondContact OG-O 3.17Å
392	D	94.2	Very high	96.9	Very high	132 Å²	132	34.8 Å²	34.8	71%	0.706	18%	0.182	S	C	*	.	H	α-helix	trans	-57.8	-32.8	174.5	-69.4	-12.4	0	0	0	112.4	K396	D392-K396 WeakPolarHBondContact O-CG 3.22Å; D392-K396 PolarHBondContact O-N 2.92Å
393	A	93.8	Very high	97	Very high	33 Å²	33	36.7 Å²	36.7	27%	0.273	19%	0.185	S	C	.	.	H	α-helix	trans	-71	-44.1	177.2	0	0	0	0	0	111.4	T44 S391 R395 K396 V397 P483	T44-A393 HydrophobicContact CG2-CB 4.43Å; S391-A393 PolarHBondContact O-N 3.48Å; A393-R395 VanDerWaalsContact C-N 3.31Å; A393-R395 PolarHBondContact O-N 3.38Å; A393-K396 PolarHBondContact O-N 2.86Å; A393-V397 PolarHBondContact O-N 3.26Å; A393-P483 HydrophobicContact CB-CB 3.87Å; A393-P483 HydrophobicContact CB-CG 3.88Å
394	A	96.1	Very high	97	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-37.8	173.5	0	0	0	0	0	112	F388 S391 K396 V397 M398 L482 P483	F388-A394 HydrophobicContact CE1-CB 4.14Å; F388-A394 HydrophobicContact CZ-CB 3.88Å; S391-A394 PolarHBondContact O-N 2.99Å; S391-A394 VanDerWaalsContact O-N 3.14Å; S391-A394 WeakPolarHBondContact OG-CB 3.23Å; S391-A394 PolarHBondContact OG-N 3.13Å; A394-K396 VanDerWaalsContact C-N 3.32Å; A394-K396 PolarHBondContact O-N 3.2Å; A394-V397 WeakPolarHBondContact O-CB 3.23Å; A394-V397 PolarHBondContact O-N 2.95Å; A394-V397 VanDerWaalsContact O-N 3.08Å; A394-M398 WeakPolarHBondContact O-CG 3.27Å; A394-M398 PolarHBondContact O-N 2.8Å; A394-L482 HydrophobicContact CB-CB 4.1Å; A394-L482 HydrophobicContact CB-CD2 4.43Å; A394-P483 WeakPolarHBondContact CB-O 3.49Å
395	R	96	Very high	97.1	Very high	51 Å²	51	33.1 Å²	33.1	19%	0.192	17%	0.167	C	C	.	.	H	α-helix	trans	-58.1	-44	176.2	-174.3	179.4	178.4	81.5	3.9	111.9	F388 S391 A393 V397 M398 E399 L413 E414	F388-R395 HydrophobicContact CD1-CB 4.48Å; F388-R395 HydrophobicContact CE1-CB 4.31Å; S391-R395 PolarHBondContact O-N 3.09Å; A393-R395 VanDerWaalsContact C-N 3.31Å; A393-R395 PolarHBondContact O-N 3.38Å; R395-V397 PolarHBondContact O-N 3.46Å; R395-M398 CarbonylContact O-C 3.42Å; R395-M398 PolarHBondContact O-N 2.91Å; R395-M398 VanDerWaalsContact O-N 3.1Å; R395-E399 HydrophobicContact CG-CG 4.37Å; R395-E399 IonicContact NE-OE1 3.56Å; R395-E399 PolarHBondContact NE-OE1 2.95Å; R395-E399 WeakPolarHBondContact O-CG 3.5Å; R395-E399 PolarHBondContact O-N 3.45Å; R395-L413 HydrophobicContact CG-CD2 4.1Å; R395-L413 PolarHBondContact NH2-O 2.65Å; R395-E414 PolarHBondContact NH1-O 3.3Å
396	K	95.6	Very high	97.1	Very high	117 Å²	117	36 Å²	36	51%	0.509	19%	0.19	S	C	.	.	H	α-helix	trans	-60.9	-33.8	176.6	-71.7	170.2	-175.8	172.3	0	112.9	D392 A393 A394 E400	D392-K396 WeakPolarHBondContact O-CG 3.22Å; D392-K396 PolarHBondContact O-N 2.92Å; A393-K396 PolarHBondContact O-N 2.86Å; A394-K396 VanDerWaalsContact C-N 3.32Å; A394-K396 PolarHBondContact O-N 3.2Å; K396-E400 PolarHBondContact O-N 3.34Å
397	V	97.8	Very high	97.1	Very high	15 Å²	15	39.7 Å²	39.7	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-66	-49.8	172.4	-179.3	0	0	0	0	109.9	V50 A393 A394 R395 E399 E400 V401 L478 L482	V50-V397 HydrophobicContact CG1-CB 4.15Å; V50-V397 HydrophobicContact CG1-CG1 4.31Å; V50-V397 HydrophobicContact CG1-CG2 3.83Å; V50-V397 HydrophobicContact CG2-CG2 4.21Å; A393-V397 PolarHBondContact O-N 3.26Å; A394-V397 WeakPolarHBondContact O-CB 3.23Å; A394-V397 PolarHBondContact O-N 2.95Å; A394-V397 VanDerWaalsContact O-N 3.08Å; R395-V397 PolarHBondContact O-N 3.46Å; V397-E399 VanDerWaalsContact C-N 3.28Å; V397-E399 PolarHBondContact O-N 3.09Å; V397-E400 PolarHBondContact O-N 3.03Å; V397-V401 HydrophobicContact CG1-CG2 4.37Å; V397-V401 WeakPolarHBondContact O-CG2 3.37Å; V397-V401 PolarHBondContact O-N 3.47Å; V397-L478 HydrophobicContact CG1-CD1 3.61Å; V397-L482 HydrophobicContact CB-CD2 3.91Å; V397-L482 HydrophobicContact CG1-CD2 3.74Å; V397-L482 HydrophobicContact CG2-CD2 4.44Å
398	M	98.1	Very high	97.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-31.3	-179.8	-65.4	-54.9	-63	0	0	113.5	L386 F388 A394 R395 E400 V401 I402 L413 V471 V475 L482	L386-M398 HydrophobicContact CD2-CE 3.52Å; F388-M398 HydrophobicContact CD1-CB 4.3Å; F388-M398 HydrophobicContact CD1-CG 4.04Å; F388-M398 HydrophobicContact CD2-CE 4.35Å; F388-M398 HydrophobicContact CD2-CG 3.82Å; F388-M398 HydrophobicContact CE1-CB 4.43Å; F388-M398 HydrophobicContact CE1-CG 3.84Å; F388-M398 HydrophobicContact CE2-CG 3.61Å; F388-M398 HydrophobicContact CE2-SD 4.31Å; F388-M398 HydrophobicContact CG-CB 4.4Å; F388-M398 HydrophobicContact CG-CG 4.03Å; F388-M398 HydrophobicContact CZ-CG 3.61Å; A394-M398 WeakPolarHBondContact O-CG 3.27Å; A394-M398 PolarHBondContact O-N 2.8Å; R395-M398 CarbonylContact O-C 3.42Å; R395-M398 PolarHBondContact O-N 2.91Å; R395-M398 VanDerWaalsContact O-N 3.1Å; M398-E400 VanDerWaalsContact C-N 3.27Å; M398-E400 PolarHBondContact O-N 3.2Å; M398-V401 PolarHBondContact O-N 3.47Å; M398-V401 HydrophobicContact SD-CG2 4.46Å; M398-I402 WeakPolarHBondContact O-CB 3.49Å; M398-I402 PolarHBondContact O-N 3.43Å; M398-L413 HydrophobicContact CB-CD1 4.21Å; M398-L413 HydrophobicContact CB-CD2 3.82Å; M398-V471 HydrophobicContact CE-CG1 3.83Å; M398-V475 HydrophobicContact CE-CG2 4.45Å; M398-V475 HydrophobicContact SD-CG2 3.82Å; M398-L482 HydrophobicContact SD-CD1 4.17Å; M398-L482 HydrophobicContact SD-CD2 4.4Å
399	E	97.8	Very high	97	Very high	76 Å²	76	46.5 Å²	46.5	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-31.6	172.5	-75.9	172.2	178.1	0	0	112.3	R395 V397 K403 L413	R395-E399 HydrophobicContact CG-CG 4.37Å; R395-E399 IonicContact NE-OE1 3.56Å; R395-E399 PolarHBondContact NE-OE1 2.95Å; R395-E399 WeakPolarHBondContact O-CG 3.5Å; R395-E399 PolarHBondContact O-N 3.45Å; V397-E399 VanDerWaalsContact C-N 3.28Å; V397-E399 PolarHBondContact O-N 3.09Å; E399-K403 VanDerWaalsContact O-CE 3.3Å; E399-K403 WeakPolarHBondContact O-CE 3.43Å; E399-K403 WeakPolarHBondContact O-CG 3.32Å; E399-L413 HydrophobicContact CB-CD2 4.47Å; E399-L413 HydrophobicContact CG-CD2 3.64Å
400	E	98.2	Very high	96.9	Very high	49 Å²	49	44.7 Å²	44.7	23%	0.229	24%	0.242	C	C	.	.	H	α-helix	trans	-79	-39.6	171.4	-61.6	-55.2	140.1	0	0	111.4	V50 A51 V54 K396 V397 M398 I402 K403	V50-E400 HydrophobicContact CG1-CG 4.13Å; A51-E400 HydrophobicContact CB-CG 4.14Å; V54-E400 HydrophobicContact CB-CB 3.97Å; V54-E400 HydrophobicContact CG1-CB 3.94Å; V54-E400 HydrophobicContact CG2-CB 4.05Å; K396-E400 PolarHBondContact O-N 3.34Å; V397-E400 PolarHBondContact O-N 3.03Å; M398-E400 VanDerWaalsContact C-N 3.27Å; M398-E400 PolarHBondContact O-N 3.2Å; E400-I402 PolarHBondContact O-N 3.49Å; E400-K403 WeakPolarHBondContact O-CB 3.2Å; E400-K403 PolarHBondContact O-N 2.82Å; E400-K403 IonicContact OE1-NZ 3.17Å; E400-K403 PolarHBondContact OE1-NZ 2.98Å; E400-K403 IonicContact OE2-NZ 2.97Å; E400-K403 PolarHBondContact OE2-NZ 3.17Å
401	V	98.5	Very high	96.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-45.3	179.1	174.9	0	0	0	0	111	V54 V397 M398 K403 L404 V471 V474	V54-V401 HydrophobicContact CG1-CG2 4.19Å; V54-V401 HydrophobicContact CG2-CG2 4.18Å; V397-V401 HydrophobicContact CG1-CG2 4.37Å; V397-V401 WeakPolarHBondContact O-CG2 3.37Å; V397-V401 PolarHBondContact O-N 3.47Å; M398-V401 PolarHBondContact O-N 3.47Å; M398-V401 HydrophobicContact SD-CG2 4.46Å; V401-K403 PolarHBondContact O-N 3.12Å; V401-L404 VanDerWaalsContact O-CB 3.28Å; V401-L404 WeakPolarHBondContact O-CB 3.5Å; V401-L404 WeakPolarHBondContact O-CG 3.32Å; V401-L404 PolarHBondContact O-N 2.94Å; V401-V471 HydrophobicContact CG1-CG2 4.33Å; V401-V474 HydrophobicContact CG1-CB 4.32Å; V401-V474 HydrophobicContact CG1-CG1 4.22Å; V401-V474 HydrophobicContact CG2-CG1 3.86Å
402	I	98	Very high	97	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-65.2	-23.5	-177.4	-152.1	78.3	0	0	0	112.6	L386 M398 E400 L404 L405 T411 L413	L386-I402 HydrophobicContact CB-CD1 3.6Å; L386-I402 HydrophobicContact CD2-CD1 4.44Å; M398-I402 WeakPolarHBondContact O-CB 3.49Å; M398-I402 PolarHBondContact O-N 3.43Å; E400-I402 PolarHBondContact O-N 3.49Å; I402-L404 PolarHBondContact O-N 3.15Å; I402-L405 HydrophobicContact CD1-CD1 3.56Å; I402-L405 HydrophobicContact CG1-CD1 4.13Å; I402-L405 WeakPolarHBondContact O-CB 3.49Å; I402-L405 PolarHBondContact O-N 2.89Å; I402-L405 VanDerWaalsContact O-N 3.15Å; I402-T411 WeakPolarHBondContact CG2-O 3.34Å; I402-L413 HydrophobicContact CG2-CB 4.3Å
403	K	98.3	Very high	97.2	Very high	108 Å²	108	46.1 Å²	46.1	47%	0.47	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-66.5	-24.8	175.9	-67.3	171.6	-165	171.7	0	112.4	E399 E400 V401 L405 A406	E399-K403 VanDerWaalsContact O-CE 3.3Å; E399-K403 WeakPolarHBondContact O-CE 3.43Å; E399-K403 WeakPolarHBondContact O-CG 3.32Å; E400-K403 WeakPolarHBondContact O-CB 3.2Å; E400-K403 PolarHBondContact O-N 2.82Å; E400-K403 IonicContact OE1-NZ 3.17Å; E400-K403 PolarHBondContact OE1-NZ 2.98Å; E400-K403 IonicContact OE2-NZ 2.97Å; E400-K403 PolarHBondContact OE2-NZ 3.17Å; V401-K403 PolarHBondContact O-N 3.12Å; K403-L405 PolarHBondContact O-N 2.94Å; K403-L405 VanDerWaalsContact O-N 3.17Å; K403-A406 VanDerWaalsContact O-CB 3.29Å; K403-A406 WeakPolarHBondContact O-CB 3.29Å; K403-A406 PolarHBondContact O-N 3.41Å; K403-A406 VanDerWaalsContact O-N 3.08Å
404	L	98.7	Very high	97.3	Very high	20 Å²	20	46.2 Å²	46.2	11%	0.105	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-63.9	-17.9	175.9	-58.3	178.8	0	0	0	112.3	V54 E58 A61 V401 I402 A406 P407 V470 V474	V54-L404 HydrophobicContact CG1-CD1 3.87Å; V54-L404 HydrophobicContact CG1-CD2 4.48Å; V54-L404 HydrophobicContact CG1-CG 4.18Å; E58-L404 HydrophobicContact CB-CD2 4.32Å; A61-L404 HydrophobicContact CB-CB 3.83Å; A61-L404 HydrophobicContact CB-CD1 4.3Å; V401-L404 VanDerWaalsContact O-CB 3.28Å; V401-L404 WeakPolarHBondContact O-CB 3.5Å; V401-L404 WeakPolarHBondContact O-CG 3.32Å; V401-L404 PolarHBondContact O-N 2.94Å; I402-L404 PolarHBondContact O-N 3.15Å; L404-A406 VanDerWaalsContact C-N 3.31Å; L404-P407 VanDerWaalsContact O-CD 3.29Å; L404-P407 WeakPolarHBondContact O-CD 3.14Å; L404-V470 HydrophobicContact CB-CG1 4.27Å; L404-V474 HydrophobicContact CD1-CG1 4.27Å; L404-V474 HydrophobicContact CD1-CG2 3.84Å
405	L	98.5	Very high	97.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-87.9	5.9	176.8	-57.5	170.1	0	0	0	113.5	I65 I402 K403 P407 I408 N409 V410 L467 V470 V471	I65-L405 HydrophobicContact CD1-CD2 4.44Å; I402-L405 HydrophobicContact CD1-CD1 3.56Å; I402-L405 HydrophobicContact CG1-CD1 4.13Å; I402-L405 WeakPolarHBondContact O-CB 3.49Å; I402-L405 PolarHBondContact O-N 2.89Å; I402-L405 VanDerWaalsContact O-N 3.15Å; K403-L405 PolarHBondContact O-N 2.94Å; K403-L405 VanDerWaalsContact O-N 3.17Å; L405-P407 VanDerWaalsContact C-N 3.26Å; L405-I408 HydrophobicContact CB-CG1 4.21Å; L405-I408 HydrophobicContact CD2-CD1 4.16Å; L405-I408 VanDerWaalsContact O-CG1 3.24Å; L405-I408 WeakPolarHBondContact O-CG1 3.43Å; L405-I408 PolarHBondContact O-N 2.67Å; L405-N409 PolarHBondContact O-N 2.97Å; L405-V410 WeakPolarHBondContact CB-O 3.39Å; L405-V410 WeakPolarHBondContact CD1-O 3.38Å; L405-V410 PolarHBondContact O-N 2.7Å; L405-L467 HydrophobicContact CD1-CB 4.32Å; L405-L467 HydrophobicContact CD1-CD1 3.93Å; L405-L467 HydrophobicContact CD1-CG 3.65Å; L405-L467 HydrophobicContact CD2-CB 4.35Å; L405-V470 HydrophobicContact CD2-CB 3.84Å; L405-V470 HydrophobicContact CD2-CG1 3.86Å; L405-V470 HydrophobicContact CD2-CG2 4.16Å; L405-V470 HydrophobicContact CG-CG1 4.48Å; L405-V471 HydrophobicContact CD1-CG2 4.35Å
406	A	97.9	Very high	96.7	Very high	60 Å²	60	52.6 Å²	52.6	50%	0.496	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-50.4	-36.8	174.5	0	0	0	0	0	114.4	K403 L404 I408 N409 T411	K403-A406 VanDerWaalsContact O-CB 3.29Å; K403-A406 WeakPolarHBondContact O-CB 3.29Å; K403-A406 PolarHBondContact O-N 3.41Å; K403-A406 VanDerWaalsContact O-N 3.08Å; L404-A406 VanDerWaalsContact C-N 3.31Å; A406-I408 PolarHBondContact O-N 3.08Å; A406-N409 PolarHBondContact O-N 3.5Å; A406-T411 HydrophobicContact CB-CG2 3.98Å
407	P	97.6	Very high	96.5	Very high	78 Å²	78	47.9 Å²	47.9	51%	0.506	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-60.5	-24.2	177.3	-26.2	36.7	0	0	0	115.2	I65 L404 L405	I65-P407 HydrophobicContact CD1-CB 4.27Å; I65-P407 HydrophobicContact CD1-CG 4.24Å; L404-P407 VanDerWaalsContact O-CD 3.29Å; L404-P407 WeakPolarHBondContact O-CD 3.14Å; L405-P407 VanDerWaalsContact C-N 3.26Å
408	I	97.5	Very high	96.2	Very high	19 Å²	19	51.2 Å²	51.2	10%	0.097	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-107.8	6.6	175.9	59.7	167.6	0	0	0	113	I65 V69 L405 A406 V410 L463 A466 L467	I65-I408 HydrophobicContact CG2-CG2 3.51Å; V69-I408 HydrophobicContact CG2-CG2 4.35Å; L405-I408 HydrophobicContact CB-CG1 4.21Å; L405-I408 HydrophobicContact CD2-CD1 4.16Å; L405-I408 VanDerWaalsContact O-CG1 3.24Å; L405-I408 WeakPolarHBondContact O-CG1 3.43Å; L405-I408 PolarHBondContact O-N 2.67Å; A406-I408 PolarHBondContact O-N 3.08Å; I408-V410 VanDerWaalsContact C-N 3.31Å; I408-V410 HydrophobicContact CB-CG2 4.48Å; I408-V410 HydrophobicContact CD1-CB 4.35Å; I408-V410 HydrophobicContact CD1-CG2 3.95Å; I408-V410 HydrophobicContact CG1-CB 4.3Å; I408-V410 HydrophobicContact CG1-CG2 3.94Å; I408-V410 WeakPolarHBondContact O-CG2 3.28Å; I408-V410 PolarHBondContact O-N 3.32Å; I408-L463 HydrophobicContact CB-CD2 3.92Å; I408-L463 HydrophobicContact CG2-CD2 3.81Å; I408-A466 HydrophobicContact CD1-CB 4.39Å; I408-L467 HydrophobicContact CD1-CB 4.48Å
409	N	96.8	Very high	96	Very high	141 Å²	141	52 Å²	52	75%	0.754	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	33.1	178.5	-165.6	50.6	0	0	0	114.7	L405 A406	L405-N409 PolarHBondContact O-N 2.97Å; A406-N409 PolarHBondContact O-N 3.5Å
410	V	95.1	Very high	95.9	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.018	29%	0.285	C	S	.	.			trans	-116.5	61.8	178.9	-164	0	0	0	0	111.2	P383 L405 I408 L467	P383-V410 HydrophobicContact CB-CG1 4.2Å; P383-V410 HydrophobicContact CB-CG2 4.35Å; P383-V410 HydrophobicContact CG-CG2 4.01Å; L405-V410 WeakPolarHBondContact CB-O 3.39Å; L405-V410 WeakPolarHBondContact CD1-O 3.38Å; L405-V410 PolarHBondContact O-N 2.7Å; I408-V410 VanDerWaalsContact C-N 3.31Å; I408-V410 HydrophobicContact CB-CG2 4.48Å; I408-V410 HydrophobicContact CD1-CB 4.35Å; I408-V410 HydrophobicContact CD1-CG2 3.95Å; I408-V410 HydrophobicContact CG1-CB 4.3Å; I408-V410 HydrophobicContact CG1-CG2 3.94Å; I408-V410 WeakPolarHBondContact O-CG2 3.28Å; I408-V410 PolarHBondContact O-N 3.32Å; V410-L467 HydrophobicContact CB-CD1 4.11Å; V410-L467 HydrophobicContact CG1-CD1 3.4Å
411	T	96	Very high	95.9	Very high	67 Å²	67	48.9 Å²	48.9	41%	0.411	28%	0.275	S	S	.	.			trans	-101.7	13.2	-173.4	63.7	0	0	0	0	114	I402 A406	I402-T411 WeakPolarHBondContact CG2-O 3.34Å; A406-T411 HydrophobicContact CB-CG2 3.98Å
412	K	97.6	Very high	95.8	Very high	103 Å²	103	48.9 Å²	48.9	45%	0.448	28%	0.275	S	S	.	.			trans	-84.7	132.5	-178.3	-165.9	-174.4	-178.5	-161.7	0	110.3	M384 G385 L386 E414	M384-K412 VanDerWaalsContact O-CB 3.29Å; M384-K412 WeakPolarHBondContact O-CB 3.18Å; G385-K412 CarbonylContact C-O 3.58Å; G385-K412 VanDerWaalsContact CA-O 3.24Å; G385-K412 WeakPolarHBondContact CA-O 3.35Å; L386-K412 PolarHBondContact N-O 2.66Å; K412-E414 HydrophobicContact CD-CG 4.35Å; K412-E414 VanDerWaalsContact CD-OE1 3.32Å; K412-E414 WeakPolarHBondContact CD-OE1 3.12Å; K412-E414 WeakPolarHBondContact CE-OE1 3.22Å; K412-E414 HydrophobicContact CG-CG 4.39Å; K412-E414 IonicContact NZ-OE1 2.65Å; K412-E414 PolarHBondContact NZ-OE1 2.97Å
413	L	97.7	Very high	95.8	Very high	22 Å²	22	53.6 Å²	53.6	12%	0.115	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	118.2	173.7	-172.6	75.8	0	0	0	110.8	L386 F388 R395 M398 E399 I402	L386-L413 HydrophobicContact CB-CD1 4.12Å; L386-L413 HydrophobicContact CD2-CD1 4.11Å; L386-L413 CarbonylContact O-C 3.58Å; L386-L413 WeakPolarHBondContact O-CA 3.14Å; F388-L413 HydrophobicContact CB-CD1 3.63Å; F388-L413 HydrophobicContact CB-CG 4.32Å; F388-L413 HydrophobicContact CG-CD1 4.45Å; R395-L413 HydrophobicContact CG-CD2 4.1Å; R395-L413 PolarHBondContact NH2-O 2.65Å; M398-L413 HydrophobicContact CB-CD1 4.21Å; M398-L413 HydrophobicContact CB-CD2 3.82Å; E399-L413 HydrophobicContact CB-CD2 4.47Å; E399-L413 HydrophobicContact CG-CD2 3.64Å; I402-L413 HydrophobicContact CG2-CB 4.3Å
414	E	96.1	Very high	95.7	Very high	36 Å²	36	50.1 Å²	50.1	17%	0.168	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	167.6	-178.6	-59.3	-175.6	-166.3	0	0	111.4	L386 Q387 F388 R395 K412 H436	L386-E414 PolarHBondContact O-N 2.82Å; Q387-E414 HydrophobicContact CG-CB 4.02Å; F388-E414 PolarHBondContact N-O 3.33Å; R395-E414 PolarHBondContact NH1-O 3.3Å; K412-E414 HydrophobicContact CD-CG 4.35Å; K412-E414 VanDerWaalsContact CD-OE1 3.32Å; K412-E414 WeakPolarHBondContact CD-OE1 3.12Å; K412-E414 WeakPolarHBondContact CE-OE1 3.22Å; K412-E414 HydrophobicContact CG-CG 4.39Å; K412-E414 IonicContact NZ-OE1 2.65Å; K412-E414 PolarHBondContact NZ-OE1 2.97Å; E414-H436 VanDerWaalsContact CD-ND1 3.35Å; E414-H436 IonicContact OE1-CE1 3.92Å; E414-H436 PolarHBondContact OE1-CE1 3.47Å; E414-H436 IonicContact OE1-CG 2.77Å; E414-H436 IonicContact OE1-ND1 3.7Å; E414-H436 PolarHBondContact OE1-ND1 3.49Å; E414-H436 IonicContact OE2-CE1 3.9Å; E414-H436 IonicContact OE2-ND1 3.49Å
415	T	90.9	Very high	95.7	Very high	104 Å²	104	49.1 Å²	49.1	64%	0.638	28%	0.276	S	S	*	.	S	Bend	trans	-97.9	-3.4	-167.3	46.8	0	0	0	0	114.7	F388	F388-T415 CarbonylContact O-C 3.53Å
416	D	88.9	Confident	95.6	Very high	80 Å²	80	49.9 Å²	49.9	43%	0.428	28%	0.28	S	S	.	.			trans	-116.8	165.2	177	47.4	1.6	0	0	0	110	Q387 F388	Q387-D416 CarbonylContact C-O 3.56Å; Q387-D416 VanDerWaalsContact CA-O 3.22Å; Q387-D416 WeakPolarHBondContact CA-O 3.33Å; Q387-D416 WeakPolarHBondContact CB-O 3.29Å; F388-D416 CarbonylContact C-O 3.54Å; F388-D416 PolarHBondContact N-O 3.33Å
417	A	91.4	Very high	95.5	Very high	18 Å²	18	53.4 Å²	53.4	15%	0.149	29%	0.286	C	S	.	.			trans	-144.9	148.5	165.7	0	0	0	0	0	108.4	L389 M426 S434	L389-A417 HydrophobicContact CB-CB 3.72Å; A417-M426 HydrophobicContact CB-SD 3.85Å; A417-S434 WeakPolarHBondContact CA-OG 3.4Å
418	E	91.7	Very high	95.3	Very high	85 Å²	85	52 Å²	52	40%	0.397	28%	0.281	S	S	.	.			trans	-125	177.1	179.1	65.8	-163.4	139.9	0	0	111	L378 Q387 S434	L378-E418 VanDerWaalsContact CD1-CD 3.41Å; L378-E418 HydrophobicContact CD1-CG 4.32Å; L378-E418 WeakPolarHBondContact CD1-OE1 3.45Å; Q387-E418 PolarHBondContact NE2-OE1 3.14Å; Q387-E418 VanDerWaalsContact NE2-OE1 3.1Å; Q387-E418 PolarHBondContact OE1-OE1 2.81Å; Q387-E418 VanDerWaalsContact OE1-OE1 3.06Å; E418-S434 PolarHBondContact N-OG 3.14Å; E418-S434 WeakPolarHBondContact O-CB 3.43Å
419	G	93.4	Very high	95.2	Very high	16 Å²	16	51.9 Å²	51.9	17%	0.165	29%	0.285	C	S	.	.			trans	133.9	115.6	-175.1	0	0	0	0	0	111.3	E375 F423	E375-G419 WeakPolarHBondContact OE2-CA 3.42Å; G419-F423 WeakPolarHBondContact O-CB 3.39Å; G419-F423 PolarHBondContact O-N 2.99Å; G419-F423 VanDerWaalsContact O-N 3.07Å
420	T	94.9	Very high	95.2	Very high	60 Å²	60	45.3 Å²	45.3	37%	0.368	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-46.6	-177	-60.1	0	0	0	0	111.4	E349 E375	E349-T420 HydrophobicContact CG-CG2 4.24Å; E349-T420 WeakPolarHBondContact OE1-CB 3.4Å; E349-T420 WeakPolarHBondContact OE1-CG2 3.41Å; E349-T420 PolarHBondContact OE1-OG1 3.32Å; E375-T420 PolarHBondContact OE2-N 3.27Å
421	D	97.9	Very high	95.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-21.2	-172.4	-73.2	-63.7	0	0	0	112.5	W346 E349 G353 G356 E375	W346-D421 HydrophobicContact CB-CB 4.43Å; W346-D421 WeakPolarHBondContact CB-OD2 3.29Å; W346-D421 HydrophobicContact CD2-CB 3.79Å; W346-D421 HydrophobicContact CG-CB 3.63Å; W346-D421 VanDerWaalsContact CG-CG 3.41Å; W346-D421 VanDerWaalsContact CG-OD2 3.29Å; W346-D421 HydrophobicContact CZ2-CB 4.33Å; E349-D421 WeakPolarHBondContact CB-OD2 3.23Å; E349-D421 WeakPolarHBondContact CG-OD2 3.33Å; G353-D421 WeakPolarHBondContact CA-OD1 3.26Å; G356-D421 VanDerWaalsContact CA-OD1 3.24Å; G356-D421 WeakPolarHBondContact CA-OD1 3.26Å; G356-D421 PolarHBondContact N-OD1 3.2Å; E375-D421 PolarHBondContact OE2-N 2.81Å
422	I	97.8	Very high	95.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-7.2	174.5	65.4	160.4	0	0	0	114.3	L299 W346 V373 E375 L424 W425 M426	L299-I422 HydrophobicContact CD2-CG2 4.27Å; W346-I422 HydrophobicContact CZ2-CG2 4.43Å; V373-I422 HydrophobicContact CB-CB 4.24Å; V373-I422 HydrophobicContact CB-CG2 4.08Å; V373-I422 HydrophobicContact CG2-CB 3.91Å; V373-I422 HydrophobicContact CG2-CD1 4.16Å; V373-I422 HydrophobicContact CG2-CG2 4.31Å; E375-I422 HydrophobicContact CB-CD1 3.63Å; E375-I422 HydrophobicContact CB-CG1 3.72Å; E375-I422 HydrophobicContact CB-CG2 4.08Å; E375-I422 PolarHBondContact OE2-N 3.37Å; I422-L424 VanDerWaalsContact C-N 3.32Å; I422-L424 PolarHBondContact O-N 3.01Å; I422-W425 WeakPolarHBondContact O-CB 3.39Å; I422-W425 PolarHBondContact O-N 3.09Å; I422-W425 VanDerWaalsContact O-N 3.08Å; I422-M426 HydrophobicContact CD1-CE 4.23Å; I422-M426 HydrophobicContact CD1-SD 4.44Å; I422-M426 HydrophobicContact CG1-CE 4.13Å; I422-M426 PolarHBondContact O-N 3.09Å
423	F	96.9	Very high	95.5	Very high	105 Å²	105	37.2 Å²	37.2	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-53.1	-43.5	-174.7	177	-108.9	0	0	0	114.3	G419 W425 M426 Q427	G419-F423 WeakPolarHBondContact O-CB 3.39Å; G419-F423 PolarHBondContact O-N 2.99Å; G419-F423 VanDerWaalsContact O-N 3.07Å; F423-W425 VanDerWaalsContact C-N 3.32Å; F423-W425 PolarHBondContact O-N 3.1Å; F423-M426 WeakPolarHBondContact O-CB 3.36Å; F423-M426 PolarHBondContact O-N 2.91Å; F423-Q427 HydrophobicContact CD1-CG 4.29Å; F423-Q427 VanDerWaalsContact CE1-CD 3.41Å; F423-Q427 HydrophobicContact CE1-CG 3.89Å; F423-Q427 HydrophobicContact CE2-CG 4.24Å; F423-Q427 HydrophobicContact CZ-CG 3.89Å; F423-Q427 PolarHBondContact O-N 2.92Å
424	L	97.3	Very high	95.5	Very high	34 Å²	34	36.3 Å²	36.3	18%	0.178	21%	0.205	C	C	.	.	H	α-helix	trans	-70	-31	-177.3	-63.8	166.6	0	0	0	112.8	Q357 F360 I422 Q427 A428	Q357-L424 HydrophobicContact CB-CD1 4.18Å; Q357-L424 HydrophobicContact CG-CD1 4.28Å; F360-L424 HydrophobicContact CB-CB 4.35Å; F360-L424 HydrophobicContact CB-CD1 4.21Å; F360-L424 HydrophobicContact CD1-CB 3.86Å; F360-L424 HydrophobicContact CD1-CD1 3.94Å; F360-L424 HydrophobicContact CD1-CG 4.5Å; F360-L424 HydrophobicContact CD2-CB 3.82Å; F360-L424 HydrophobicContact CE1-CB 4.06Å; F360-L424 HydrophobicContact CE2-CB 4.04Å; F360-L424 WeakPolarHBondContact CE2-O 3.3Å; F360-L424 HydrophobicContact CG-CB 3.73Å; F360-L424 HydrophobicContact CG-CD1 4.14Å; F360-L424 HydrophobicContact CZ-CB 4.15Å; I422-L424 VanDerWaalsContact C-N 3.32Å; I422-L424 PolarHBondContact O-N 3.01Å; L424-Q427 PolarHBondContact O-N 2.75Å; L424-A428 VanDerWaalsContact O-CB 3.29Å; L424-A428 WeakPolarHBondContact O-CB 3.49Å; L424-A428 PolarHBondContact O-N 2.81Å
425	W	97.5	Very high	95.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65	-45.1	173	-66	97.9	0	0	0	110.6	Y359 F360 H363 I367 F370 V373 I422 F423 A428 G429 V430	Y359-W425 AromaticContact CD1-CZ2 3.76Å; Y359-W425 HydrophobicContact CD1-CZ2 3.76Å; Y359-W425 AromaticContact CE1-CZ2 3.7Å; Y359-W425 HydrophobicContact CE1-CZ2 3.7Å; F360-W425 HydrophobicContact CB-CZ2 4.4Å; F360-W425 AromaticContact CD2-CD2 3.64Å; F360-W425 HydrophobicContact CD2-CD2 3.64Å; F360-W425 AromaticContact CD2-CE2 3.69Å; F360-W425 HydrophobicContact CD2-CE3 4.02Å; F360-W425 AromaticContact CD2-CG 3.92Å; F360-W425 HydrophobicContact CD2-CG 3.92Å; F360-W425 HydrophobicContact CD2-CH2 4.47Å; F360-W425 HydrophobicContact CD2-CZ2 4.13Å; F360-W425 HydrophobicContact CD2-CZ3 4.42Å; F360-W425 AromaticContact CD2-NE1 3.95Å; F360-W425 HydrophobicContact CE2-CD2 4.22Å; F360-W425 HydrophobicContact CE2-CE3 4.24Å; F360-W425 HydrophobicContact CE2-CG 4.47Å; H363-W425 HydrophobicContact CB-CH2 3.7Å; H363-W425 HydrophobicContact CB-CZ2 4.04Å; I367-W425 HydrophobicContact CB-CZ3 4.43Å; I367-W425 HydrophobicContact CD1-CE3 4.24Å; I367-W425 HydrophobicContact CD1-CZ3 4.43Å; I367-W425 HydrophobicContact CG1-CE3 4.07Å; I367-W425 HydrophobicContact CG1-CZ3 3.97Å; F370-W425 HydrophobicContact CB-CZ3 4.4Å; F370-W425 HydrophobicContact CD1-CE3 4.48Å; F370-W425 HydrophobicContact CD1-CH2 4.26Å; F370-W425 HydrophobicContact CD1-CZ3 4.15Å; F370-W425 HydrophobicContact CD2-CE3 4.31Å; F370-W425 AromaticContact CD2-CH2 3.74Å; F370-W425 HydrophobicContact CD2-CH2 3.74Å; F370-W425 AromaticContact CD2-CZ3 3.42Å; F370-W425 HydrophobicContact CD2-CZ3 3.42Å; F370-W425 VanDerWaalsContact CD2-CZ3 3.42Å; F370-W425 AromaticContact CE1-CH2 3.92Å; F370-W425 HydrophobicContact CE1-CH2 3.92Å; F370-W425 HydrophobicContact CE1-CZ2 4.21Å; F370-W425 HydrophobicContact CE1-CZ3 4.28Å; F370-W425 AromaticContact CE2-CH2 3.36Å; F370-W425 HydrophobicContact CE2-CH2 3.36Å; F370-W425 HydrophobicContact CE2-CZ2 4.35Å; F370-W425 AromaticContact CE2-CZ3 3.58Å; F370-W425 HydrophobicContact CE2-CZ3 3.58Å; F370-W425 HydrophobicContact CG-CE3 4.19Å; F370-W425 HydrophobicContact CG-CH2 4.18Å; F370-W425 AromaticContact CG-CZ3 3.73Å; F370-W425 HydrophobicContact CG-CZ3 3.73Å; F370-W425 AromaticContact CZ-CH2 3.46Å; F370-W425 HydrophobicContact CZ-CH2 3.46Å; F370-W425 VanDerWaalsContact CZ-CH2 3.46Å; F370-W425 HydrophobicContact CZ-CZ2 4.02Å; F370-W425 HydrophobicContact CZ-CZ3 4.01Å; V373-W425 HydrophobicContact CG1-CB 4.08Å; V373-W425 HydrophobicContact CG1-CD2 4.36Å; V373-W425 HydrophobicContact CG1-CG 4.08Å; V373-W425 HydrophobicContact CG2-CB 3.86Å; I422-W425 WeakPolarHBondContact O-CB 3.39Å; I422-W425 PolarHBondContact O-N 3.09Å; I422-W425 VanDerWaalsContact O-N 3.08Å; F423-W425 VanDerWaalsContact C-N 3.32Å; F423-W425 PolarHBondContact O-N 3.1Å; W425-A428 CarbonylContact O-C 3.52Å; W425-A428 PolarHBondContact O-N 2.87Å; W425-A428 VanDerWaalsContact O-N 3.16Å; W425-G429 PolarHBondContact O-N 2.91Å; W425-V430 HydrophobicContact CB-CB 4.33Å; W425-V430 HydrophobicContact CE3-CG2 4.14Å; W425-V430 WeakPolarHBondContact O-CB 3.15Å; W425-V430 PolarHBondContact O-N 3.49Å
426	M	96.3	Very high	95.9	Very high	16 Å²	16	31.4 Å²	31.4	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-61.9	-44.4	175.2	-70.9	-165.8	-70.8	0	0	112.2	V373 L389 A417 I422 F423 A428 G429 V430	V373-M426 HydrophobicContact CG2-CG 4.44Å; L389-M426 HydrophobicContact CB-SD 4.16Å; L389-M426 HydrophobicContact CD2-CB 3.99Å; L389-M426 HydrophobicContact CD2-CG 4.29Å; L389-M426 HydrophobicContact CD2-SD 3.82Å; A417-M426 HydrophobicContact CB-SD 3.85Å; I422-M426 HydrophobicContact CD1-CE 4.23Å; I422-M426 HydrophobicContact CD1-SD 4.44Å; I422-M426 HydrophobicContact CG1-CE 4.13Å; I422-M426 PolarHBondContact O-N 3.09Å; F423-M426 WeakPolarHBondContact O-CB 3.36Å; F423-M426 PolarHBondContact O-N 2.91Å; M426-A428 PolarHBondContact O-N 2.84Å; M426-G429 PolarHBondContact O-N 3.49Å; M426-V430 WeakPolarHBondContact CA-O 3.29Å
427	Q	95.2	Very high	96.3	Very high	133 Å²	133	27.7 Å²	27.7	62%	0.621	16%	0.155	S	C	*	.	H	α-helix	trans	-59.4	-35.9	173.9	-78.1	-160.2	-16.9	0	0	112.6	F423 L424 G429	F423-Q427 HydrophobicContact CD1-CG 4.29Å; F423-Q427 VanDerWaalsContact CE1-CD 3.41Å; F423-Q427 HydrophobicContact CE1-CG 3.89Å; F423-Q427 HydrophobicContact CE2-CG 4.24Å; F423-Q427 HydrophobicContact CZ-CG 3.89Å; F423-Q427 PolarHBondContact O-N 2.92Å; L424-Q427 PolarHBondContact O-N 2.75Å; Q427-G429 PolarHBondContact O-N 2.82Å
428	A	95.2	Very high	96.6	Very high	48 Å²	48	28.4 Å²	28.4	40%	0.397	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	10.6	178.1	0	0	0	0	0	113.6	F360 I367 L424 W425 M426	F360-A428 HydrophobicContact CE2-CB 4.02Å; F360-A428 HydrophobicContact CZ-CB 4.02Å; I367-A428 HydrophobicContact CD1-CB 3.29Å; L424-A428 VanDerWaalsContact O-CB 3.29Å; L424-A428 WeakPolarHBondContact O-CB 3.49Å; L424-A428 PolarHBondContact O-N 2.81Å; W425-A428 CarbonylContact O-C 3.52Å; W425-A428 PolarHBondContact O-N 2.87Å; W425-A428 VanDerWaalsContact O-N 3.16Å; M426-A428 PolarHBondContact O-N 2.84Å
429	G	94.8	Very high	96.6	Very high	18 Å²	18	27 Å²	27	19%	0.186	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	6.8	169.1	0	0	0	0	0	115.4	W425 M426 Q427	W425-G429 PolarHBondContact O-N 2.91Å; M426-G429 PolarHBondContact O-N 3.49Å; Q427-G429 PolarHBondContact O-N 2.82Å
430	V	97.4	Very high	96.6	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.018	18%	0.18	C	C	.	.			trans	-74.9	132.5	170.8	-176.2	0	0	0	0	108.9	I367 F370 V373 W425 M426 G432	I367-V430 HydrophobicContact CD1-CG2 3.84Å; I367-V430 HydrophobicContact CG1-CG2 3.46Å; I367-V430 VanDerWaalsContact CG1-CG2 3.46Å; F370-V430 HydrophobicContact CB-CG1 3.96Å; F370-V430 HydrophobicContact CB-CG2 4.32Å; V373-V430 HydrophobicContact CG1-CG1 4.05Å; V373-V430 HydrophobicContact CG2-CG1 4.38Å; W425-V430 HydrophobicContact CB-CB 4.33Å; W425-V430 HydrophobicContact CE3-CG2 4.14Å; W425-V430 WeakPolarHBondContact O-CB 3.15Å; W425-V430 PolarHBondContact O-N 3.49Å; M426-V430 WeakPolarHBondContact CA-O 3.29Å; V430-G432 PolarHBondContact O-N 2.77Å
431	P	98	Very high	96.5	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.013	18%	0.183	C	C	.	.			trans	-53.3	134.3	171.1	-26.8	35.6	0	0	0	111.5	D371 L372 V373 F388 L389 L482	D371-P431 WeakPolarHBondContact O-CD 3.24Å; D371-P431 WeakPolarHBondContact O-CG 3.48Å; L372-P431 HydrophobicContact CD1-CB 4.04Å; L372-P431 WeakPolarHBondContact CD1-O 3.33Å; V373-P431 PolarHBondContact N-O 3.33Å; F388-P431 HydrophobicContact CE2-CB 3.93Å; F388-P431 HydrophobicContact CZ-CB 3.99Å; L389-P431 WeakPolarHBondContact O-CA 3.37Å; P431-L482 HydrophobicContact CB-CD1 4.15Å; P431-L482 HydrophobicContact CG-CB 4.03Å; P431-L482 HydrophobicContact CG-CD1 4.43Å
432	G	98.2	Very high	96.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	148.8	179.1	0	0	0	0	0	111.9	V373 F388 L389 V430	V373-G432 CarbonylContact O-C 3.55Å; V373-G432 VanDerWaalsContact O-CA 3.27Å; V373-G432 WeakPolarHBondContact O-CA 3.02Å; F388-G432 WeakPolarHBondContact CA-O 3.39Å; F388-G432 VanDerWaalsContact CD2-O 3.32Å; F388-G432 WeakPolarHBondContact CD2-O 3.29Å; L389-G432 PolarHBondContact N-O 3.08Å; L389-G432 PolarHBondContact O-N 3.45Å; V430-G432 PolarHBondContact O-N 2.77Å
433	A	98.5	Very high	96.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.6	172	0	0	0	0	0	112	L372 V373 M374 E375 L386 Q387 F388	L372-A433 HydrophobicContact CD1-CB 4.15Å; V373-A433 PolarHBondContact O-N 2.77Å; M374-A433 CarbonylContact C-O 3.48Å; M374-A433 VanDerWaalsContact CA-O 3.23Å; M374-A433 WeakPolarHBondContact CA-O 3.32Å; M374-A433 HydrophobicContact CG-CB 4.2Å; E375-A433 PolarHBondContact N-O 3.05Å; L386-A433 HydrophobicContact CD1-CB 4.06Å; L386-A433 HydrophobicContact CD2-CB 4.03Å; L386-A433 HydrophobicContact CG-CB 4.1Å; Q387-A433 CarbonylContact O-C 3.56Å; Q387-A433 WeakPolarHBondContact O-CA 3.37Å; Q387-A433 WeakPolarHBondContact O-CB 3.48Å; F388-A433 HydrophobicContact CD2-CB 4.28Å
434	S	98.2	Very high	96.5	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.6	172	44.9	0	0	0	0	111.5	E375 L386 Q387 A417 E418 H436	E375-S434 WeakPolarHBondContact O-CA 3.49Å; E375-S434 WeakPolarHBondContact O-CB 3.35Å; L386-S434 WeakPolarHBondContact CD1-O 3.48Å; Q387-S434 WeakPolarHBondContact CB-OG 3.29Å; Q387-S434 PolarHBondContact N-O 3.49Å; Q387-S434 PolarHBondContact O-N 3Å; Q387-S434 PolarHBondContact OE1-OG 3Å; A417-S434 WeakPolarHBondContact CA-OG 3.4Å; E418-S434 PolarHBondContact N-OG 3.14Å; E418-S434 WeakPolarHBondContact O-CB 3.43Å; S434-H436 PolarHBondContact O-N 3.06Å
435	L	97.8	Very high	96.5	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.031	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.9	176.3	-176.8	69.4	0	0	0	109.5	I322 E375 P383 V437 C464 L467 W468	I322-L435 HydrophobicContact CD1-CD2 3.76Å; E375-L435 PolarHBondContact O-N 2.99Å; P383-L435 HydrophobicContact CB-CD1 4.34Å; L435-V437 HydrophobicContact CD2-CG1 3.65Å; L435-V437 HydrophobicContact CG-CG1 3.67Å; L435-C464 HydrophobicContact CD2-CB 3.9Å; L435-L467 HydrophobicContact CD1-CD1 4.07Å; L435-L467 HydrophobicContact CD1-CD2 3.72Å; L435-L467 HydrophobicContact CD1-CG 4.39Å; L435-W468 HydrophobicContact CB-CE3 4.31Å; L435-W468 HydrophobicContact CB-CH2 4.41Å; L435-W468 HydrophobicContact CB-CZ3 3.81Å; L435-W468 HydrophobicContact CD1-CE3 4.45Å
436	H	97.3	Very high	96.6	Very high	31 Å²	31	36 Å²	36	14%	0.144	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.1	171.8	179.3	-158.3	0	0	0	109.9	M384 G385 Q387 E414 S434	M384-H436 PolarHBondContact N-O 3.42Å; G385-H436 PolarHBondContact N-O 3Å; G385-H436 PolarHBondContact O-N 3.23Å; G385-H436 VanDerWaalsContact O-N 3.15Å; Q387-H436 HydrophobicContact CG-CB 4.15Å; E414-H436 VanDerWaalsContact CD-ND1 3.35Å; E414-H436 IonicContact OE1-CE1 3.92Å; E414-H436 PolarHBondContact OE1-CE1 3.47Å; E414-H436 IonicContact OE1-CG 2.77Å; E414-H436 IonicContact OE1-ND1 3.7Å; E414-H436 PolarHBondContact OE1-ND1 3.49Å; E414-H436 IonicContact OE2-CE1 3.9Å; E414-H436 IonicContact OE2-ND1 3.49Å; S434-H436 PolarHBondContact O-N 3.06Å
437	V	97	Very high	96.7	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	167.4	-178.8	-58.1	0	0	0	0	111.3	L378 F381 T382 L435 D439	L378-V437 WeakPolarHBondContact O-CG2 3.35Å; F381-V437 HydrophobicContact CB-CB 4.08Å; F381-V437 HydrophobicContact CB-CG2 4.23Å; F381-V437 HydrophobicContact CD2-CG2 3.86Å; F381-V437 WeakPolarHBondContact O-CB 3.41Å; F381-V437 VanDerWaalsContact O-CG1 3.29Å; F381-V437 WeakPolarHBondContact O-CG1 3.24Å; T382-V437 CarbonylContact O-C 3.57Å; T382-V437 WeakPolarHBondContact O-CA 3.42Å; L435-V437 HydrophobicContact CD2-CG1 3.65Å; L435-V437 HydrophobicContact CG-CG1 3.67Å; V437-D439 HydrophobicContact CG2-CB 4.04Å; V437-D439 PolarHBondContact O-N 3.24Å
438	A	96.5	Very high	96.8	Very high	34 Å²	34	29.4 Å²	29.4	28%	0.281	16%	0.16	S	C	.	.			trans	-72.5	67.2	172.6	0	0	0	0	0	112.1	T382 M384 S440	T382-A438 PolarHBondContact O-N 3.04Å; M384-A438 HydrophobicContact CG-CB 4.29Å; M384-A438 HydrophobicContact SD-CB 3.96Å; A438-S440 VanDerWaalsContact C-N 3.27Å; A438-S440 PolarHBondContact O-N 3.04Å
439	D	92.6	Very high	96.9	Very high	56 Å²	56	32.9 Å²	32.9	30%	0.299	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-76.3	6.1	-168.7	72.8	-18.6	0	0	0	115.9	V437 R441 Y442	V437-D439 HydrophobicContact CG2-CB 4.04Å; V437-D439 PolarHBondContact O-N 3.24Å; D439-R441 PolarHBondContact O-N 2.99Å; D439-Y442 WeakPolarHBondContact O-CB 3.2Å; D439-Y442 PolarHBondContact O-N 2.91Å
440	S	93.7	Very high	97.1	Very high	94 Å²	94	33.2 Å²	33.2	66%	0.657	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-53.1	-20.5	-176.2	62.6	0	0	0	0	115.7	A438	A438-S440 VanDerWaalsContact C-N 3.27Å; A438-S440 PolarHBondContact O-N 3.04Å
441	R	93.5	Very high	97.1	Very high	114 Å²	114	33.3 Å²	33.3	43%	0.43	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-106.4	-3.2	177.6	-61.3	-175.7	-64.6	165.4	2.5	113.7	D439 F443 W444 F445	D439-R441 PolarHBondContact O-N 2.99Å; R441-F443 PolarHBondContact O-N 3.39Å; R441-W444 HydrophobicContact CB-CD2 4.06Å; R441-W444 HydrophobicContact CB-CE3 4.17Å; R441-W444 HydrophobicContact CB-CG 4.35Å; R441-W444 HydrophobicContact CG-CD2 4.04Å; R441-W444 HydrophobicContact CG-CE3 3.95Å; R441-W444 HydrophobicContact CG-CH2 3.98Å; R441-W444 HydrophobicContact CG-CZ2 4.05Å; R441-W444 HydrophobicContact CG-CZ3 3.92Å; R441-W444 VanDerWaalsContact O-CB 3.23Å; R441-W444 WeakPolarHBondContact O-CB 3.46Å; R441-W444 PolarHBondContact O-N 3.26Å; R441-F445 HydrophobicContact CB-CE2 4.38Å; R441-F445 WeakPolarHBondContact O-CD2 3.34Å
442	Y	97.1	Very high	97.1	Very high	5 Å²	5	34.7 Å²	34.7	2%	0.02	18%	0.18	C	C	.	.	H	α-helix	trans	-53.3	-54.1	-177.8	-175.1	-110.4	0	0	0	111	M314 D315 D377 L378 F381 D439 W444 F445 H446	M314-Y442 HydrophobicContact CE-CD2 3.73Å; M314-Y442 HydrophobicContact CE-CE2 3.82Å; M314-Y442 HydrophobicContact CE-CG 4.36Å; M314-Y442 VanDerWaalsContact CE-O 3.25Å; M314-Y442 WeakPolarHBondContact CE-O 2.93Å; M314-Y442 HydrophobicContact CG-CD2 4.25Å; M314-Y442 HydrophobicContact CG-CE2 3.99Å; M314-Y442 HydrophobicContact SD-CD2 3.79Å; M314-Y442 HydrophobicContact SD-CE2 4.1Å; D315-Y442 HydrophobicContact CB-CE2 4.48Å; D315-Y442 WeakPolarHBondContact CB-OH 3.06Å; D315-Y442 PolarHBondContact OD2-OH 3.45Å; D377-Y442 PolarHBondContact O-OH 3.04Å; L378-Y442 VanDerWaalsContact C-CE2 3.42Å; L378-Y442 HydrophobicContact CD2-CD1 4.06Å; L378-Y442 HydrophobicContact CD2-CE1 3.74Å; F381-Y442 AromaticContact CE2-CD2 3.84Å; F381-Y442 HydrophobicContact CE2-CD2 3.84Å; F381-Y442 HydrophobicContact CE2-CG 4.43Å; F381-Y442 HydrophobicContact CZ-CD2 4.33Å; D439-Y442 WeakPolarHBondContact O-CB 3.2Å; D439-Y442 PolarHBondContact O-N 2.91Å; Y442-W444 PolarHBondContact O-N 3.26Å; Y442-F445 PolarHBondContact O-N 3.16Å; Y442-H446 HydrophobicContact CD1-CB 4.13Å; Y442-H446 HydrophobicContact CE1-CB 3.98Å; Y442-H446 AromaticContact CE1-CD2 3.38Å; Y442-H446 WeakPolarHBondContact CE1-CD2 3.44Å; Y442-H446 AromaticContact CE1-CG 3.94Å; Y442-H446 AromaticContact CZ-CD2 3.76Å; Y442-H446 WeakPolarHBondContact O-CB 3.48Å; Y442-H446 PolarHBondContact O-N 3.32Å
443	F	97.8	Very high	97.1	Very high	35 Å²	35	35.5 Å²	35.5	15%	0.154	18%	0.184	C	C	.	.	H	α-helix	trans	-69.2	-3.4	-179.5	-61.8	-61.7	0	0	0	115.1	F190 Y193 T221 P222 H229 R441 F445 H446	F190-F443 HydrophobicContact CZ-CB 4.49Å; F190-F443 HydrophobicContact CZ-CD2 4.36Å; Y193-F443 VanDerWaalsContact CB-CZ 3.46Å; Y193-F443 AromaticContact CD1-CE1 3.73Å; Y193-F443 HydrophobicContact CD1-CE1 3.73Å; Y193-F443 AromaticContact CD1-CZ 3.77Å; Y193-F443 HydrophobicContact CD1-CZ 3.77Å; Y193-F443 AromaticContact CD2-CD1 3.44Å; Y193-F443 HydrophobicContact CD2-CD1 3.44Å; Y193-F443 VanDerWaalsContact CD2-CD1 3.44Å; Y193-F443 AromaticContact CD2-CE1 3.25Å; Y193-F443 HydrophobicContact CD2-CE1 3.25Å; Y193-F443 HydrophobicContact CD2-CG 4.23Å; Y193-F443 AromaticContact CD2-CZ 3.9Å; Y193-F443 HydrophobicContact CD2-CZ 3.9Å; Y193-F443 HydrophobicContact CE1-CE1 4.03Å; Y193-F443 HydrophobicContact CE1-CZ 4.42Å; Y193-F443 AromaticContact CE2-CD1 3.87Å; Y193-F443 HydrophobicContact CE2-CD1 3.87Å; Y193-F443 AromaticContact CE2-CE1 3.62Å; Y193-F443 HydrophobicContact CE2-CE1 3.62Å; Y193-F443 AromaticContact CG-CD1 3.91Å; Y193-F443 HydrophobicContact CG-CD1 3.91Å; Y193-F443 AromaticContact CG-CE1 3.3Å; Y193-F443 HydrophobicContact CG-CE1 3.3Å; Y193-F443 HydrophobicContact CG-CE2 4.16Å; Y193-F443 AromaticContact CG-CZ 3.45Å; Y193-F443 HydrophobicContact CG-CZ 3.45Å; Y193-F443 VanDerWaalsContact CG-CZ 3.45Å; Y193-F443 AromaticContact CZ-CE1 3.97Å; T221-F443 VanDerWaalsContact CB-O 3.3Å; T221-F443 WeakPolarHBondContact CB-O 3.4Å; T221-F443 PolarHBondContact OG1-O 3.33Å; P222-F443 HydrophobicContact CG-CB 4.32Å; H229-F443 PolarHBondContact CE1-O 3.32Å; R441-F443 PolarHBondContact O-N 3.39Å; F443-F445 VanDerWaalsContact C-N 3.31Å; F443-H446 HydrophobicContact CD1-CB 4.24Å
444	W	97.3	Very high	97	Very high	89 Å²	89	41.6 Å²	41.6	34%	0.337	22%	0.221	S	C	.	.	H	α-helix	trans	-74	-25.9	171.4	-60.8	10.4	0	0	0	111.8	F223 H229 R441 Y442	F223-W444 HydrophobicContact CB-CD2 4.06Å; F223-W444 HydrophobicContact CB-CG 3.85Å; F223-W444 HydrophobicContact CD1-CB 4.34Å; F223-W444 HydrophobicContact CD1-CD2 4.01Å; F223-W444 HydrophobicContact CD1-CE3 4.09Å; F223-W444 HydrophobicContact CD1-CG 4.14Å; F223-W444 HydrophobicContact CE1-CE3 4.5Å; F223-W444 HydrophobicContact CG-CD2 4.19Å; F223-W444 HydrophobicContact CG-CG 4.35Å; H229-W444 PolarHBondContact CE1-O 3.11Å; R441-W444 HydrophobicContact CB-CD2 4.06Å; R441-W444 HydrophobicContact CB-CE3 4.17Å; R441-W444 HydrophobicContact CB-CG 4.35Å; R441-W444 HydrophobicContact CG-CD2 4.04Å; R441-W444 HydrophobicContact CG-CE3 3.95Å; R441-W444 HydrophobicContact CG-CH2 3.98Å; R441-W444 HydrophobicContact CG-CZ2 4.05Å; R441-W444 HydrophobicContact CG-CZ3 3.92Å; R441-W444 VanDerWaalsContact O-CB 3.23Å; R441-W444 WeakPolarHBondContact O-CB 3.46Å; R441-W444 PolarHBondContact O-N 3.26Å; Y442-W444 PolarHBondContact O-N 3.26Å
445	F	97.8	Very high	96.9	Very high	56 Å²	56	42.1 Å²	42.1	25%	0.246	22%	0.224	C	C	.	.	H	α-helix	trans	-122	-24.2	-173.9	-49.9	-74.7	0	0	0	113.4	M314 R441 Y442 F443 H447 S448 V455	M314-F445 HydrophobicContact CE-CB 3.67Å; M314-F445 HydrophobicContact SD-CB 4.13Å; R441-F445 HydrophobicContact CB-CE2 4.38Å; R441-F445 WeakPolarHBondContact O-CD2 3.34Å; Y442-F445 PolarHBondContact O-N 3.16Å; F443-F445 VanDerWaalsContact C-N 3.31Å; F445-H447 PolarHBondContact O-N 3.06Å; F445-S448 WeakPolarHBondContact O-CB 3.48Å; F445-S448 PolarHBondContact O-N 3.45Å; F445-S448 PolarHBondContact O-OG 3.32Å; F445-V455 HydrophobicContact CB-CG1 4.22Å; F445-V455 HydrophobicContact CD1-CG1 3.87Å; F445-V455 HydrophobicContact CD2-CB 4.25Å; F445-V455 HydrophobicContact CD2-CG1 3.7Å; F445-V455 HydrophobicContact CE1-CG1 4.11Å; F445-V455 HydrophobicContact CE2-CB 4.41Å; F445-V455 HydrophobicContact CE2-CG1 3.94Å; F445-V455 HydrophobicContact CG-CG1 3.66Å; F445-V455 HydrophobicContact CZ-CG1 4.14Å
446	H	98.1	Very high	96.9	Very high	10 Å²	10	42.4 Å²	42.4	5%	0.046	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	129.2	-173.7	153.6	-75.6	0	0	0	111.8	Y193 H229 M314 D315 Y442 F443 S448	Y193-H446 AromaticContact CE2-CE1 3.5Å; Y193-H446 VanDerWaalsContact CE2-CE1 3.5Å; Y193-H446 WeakPolarHBondContact CE2-CE1 3.45Å; Y193-H446 AromaticContact CZ-CE1 3.5Å; Y193-H446 AromaticContact CZ-NE2 3.73Å; Y193-H446 PolarHBondContact OH-CE1 2.96Å; Y193-H446 PolarHBondContact OH-NE2 2.84Å; H229-H446 PolarHBondContact ND1-O 3.18Å; M314-H446 HydrophobicContact CE-CB 3.67Å; D315-H446 IonicContact OD2-CD2 3.42Å; D315-H446 PolarHBondContact OD2-CD2 2.89Å; D315-H446 IonicContact OD2-CG 3.85Å; D315-H446 IonicContact OD2-NE2 3.76Å; Y442-H446 HydrophobicContact CD1-CB 4.13Å; Y442-H446 HydrophobicContact CE1-CB 3.98Å; Y442-H446 AromaticContact CE1-CD2 3.38Å; Y442-H446 WeakPolarHBondContact CE1-CD2 3.44Å; Y442-H446 AromaticContact CE1-CG 3.94Å; Y442-H446 AromaticContact CZ-CD2 3.76Å; Y442-H446 WeakPolarHBondContact O-CB 3.48Å; Y442-H446 PolarHBondContact O-N 3.32Å; F443-H446 HydrophobicContact CD1-CB 4.24Å; H446-S448 VanDerWaalsContact C-N 3.3Å; H446-S448 PolarHBondContact O-N 2.89Å
447	H	98.3	Very high	97	Very high	11 Å²	11	44.3 Å²	44.3	5%	0.051	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	30.8	-175.2	-55.6	-172.4	0	0	0	115.3	H229 T230 G231 W307 D315 E350 F445	H229-H447 CarbonylContact C-O 3.49Å; H229-H447 VanDerWaalsContact CA-O 3.32Å; H229-H447 WeakPolarHBondContact CA-O 3.43Å; T230-H447 HydrophobicContact CG2-CB 4.09Å; T230-H447 PolarHBondContact N-O 2.91Å; T230-H447 WeakPolarHBondContact O-CB 3.48Å; T230-H447 PolarHBondContact O-ND1 3.24Å; G231-H447 VanDerWaalsContact CA-ND1 3.29Å; G231-H447 WeakPolarHBondContact CA-ND1 3.44Å; W307-H447 AromaticContact CD1-CD2 3.16Å; W307-H447 AromaticContact CD1-CE1 3.74Å; W307-H447 AromaticContact CD1-CG 3.34Å; W307-H447 AromaticContact CD1-ND1 3.71Å; W307-H447 AromaticContact CD1-NE2 3.43Å; W307-H447 HydrophobicContact CG-CB 4.42Å; W307-H447 AromaticContact NE1-CD2 3.37Å; W307-H447 PolarHBondContact NE1-CD2 3.24Å; W307-H447 AromaticContact NE1-CE1 3.1Å; W307-H447 PolarHBondContact NE1-CE1 3.19Å; W307-H447 AromaticContact NE1-CG 3.52Å; W307-H447 AromaticContact NE1-ND1 3.37Å; W307-H447 PolarHBondContact NE1-ND1 3.11Å; W307-H447 AromaticContact NE1-NE2 3.11Å; W307-H447 PolarHBondContact NE1-NE2 3.06Å; W307-H447 VanDerWaalsContact NE1-NE2 3.11Å; D315-H447 IonicContact OD2-CD2 3.62Å; D315-H447 PolarHBondContact OD2-CD2 3.45Å; D315-H447 VanDerWaalsContact OD2-CD2 3.24Å; D315-H447 IonicContact OD2-NE2 3.08Å; E350-H447 IonicContact OE2-CE1 3.13Å; E350-H447 IonicContact OE2-NE2 3.22Å; E350-H447 PolarHBondContact OE2-NE2 3.25Å; F445-H447 PolarHBondContact O-N 3.06Å
448	S	98.5	Very high	97	Very high	1 Å²	1	46 Å²	46	1%	0.007	25%	0.248	C	C	.	.	S	Bend	trans	-130.1	169.5	177.8	79.5	0	0	0	0	111.9	S227 P228 F445 H446 G450 D451	S227-S448 WeakPolarHBondContact OG-CB 3.32Å; P228-S448 WeakPolarHBondContact O-CB 3.49Å; F445-S448 WeakPolarHBondContact O-CB 3.48Å; F445-S448 PolarHBondContact O-N 3.45Å; F445-S448 PolarHBondContact O-OG 3.32Å; H446-S448 VanDerWaalsContact C-N 3.3Å; H446-S448 PolarHBondContact O-N 2.89Å; S448-G450 PolarHBondContact O-N 3.25Å; S448-G450 PolarHBondContact OG-N 3.43Å; S448-G450 VanDerWaalsContact OG-N 3.09Å; S448-D451 PolarHBondContact O-N 3.01Å; S448-D451 VanDerWaalsContact O-N 3.14Å
449	E	97.8	Very high	97.1	Very high	120 Å²	120	48.7 Å²	48.7	56%	0.561	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.5	171.1	-63.6	-69	-178.2	0	0	113.4	V309 G310 T452	V309-E449 HydrophobicContact CB-CG 4.29Å; G310-E449 PolarHBondContact N-OE2 2.82Å; E449-T452 WeakPolarHBondContact O-CG2 3.48Å
450	G	97.6	Very high	97.4	Very high	25 Å²	25	46.9 Å²	46.9	26%	0.258	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-17.6	177.2	0	0	0	0	0	114.5	S448 T452 V455	S448-G450 PolarHBondContact O-N 3.25Å; S448-G450 PolarHBondContact OG-N 3.43Å; S448-G450 VanDerWaalsContact OG-N 3.09Å; G450-T452 PolarHBondContact O-N 2.82Å; G450-T452 PolarHBondContact O-OG1 3.03Å; G450-V455 WeakPolarHBondContact O-CG1 3.37Å
451	D	98.4	Very high	97.7	Very high	5 Å²	5	42.4 Å²	42.4	3%	0.027	21%	0.213	C	C	.	.			trans	-72.5	93	176.4	-177.6	5.2	0	0	0	110.2	Q311 G312 A313 M314 D315 S448	Q311-D451 PolarHBondContact N-O 2.77Å; G312-D451 VanDerWaalsContact CA-OD2 3.23Å; G312-D451 WeakPolarHBondContact CA-OD2 3.38Å; A313-D451 WeakPolarHBondContact CA-OD1 3.42Å; A313-D451 PolarHBondContact N-OD1 3.42Å; A313-D451 PolarHBondContact N-OD2 3.3Å; M314-D451 WeakPolarHBondContact CG-OD1 3.45Å; M314-D451 PolarHBondContact N-OD1 3.21Å; D315-D451 PolarHBondContact N-OD2 3.1Å; S448-D451 PolarHBondContact O-N 3.01Å; S448-D451 VanDerWaalsContact O-N 3.14Å
452	T	98	Very high	97.9	Very high	31 Å²	31	37.1 Å²	37.1	19%	0.19	19%	0.194	C	C	.	.	S	Bend	trans	-143.6	169.4	-174.7	62.7	0	0	0	0	109.5	Q311 A313 E449 G450 T454 V455	Q311-T452 HydrophobicContact CG-CG2 4.27Å; Q311-T452 VanDerWaalsContact OE1-CA 3.28Å; A313-T452 VanDerWaalsContact CB-C 3.43Å; E449-T452 WeakPolarHBondContact O-CG2 3.48Å; G450-T452 PolarHBondContact O-N 2.82Å; G450-T452 PolarHBondContact O-OG1 3.03Å; T452-T454 PolarHBondContact O-N 3.43Å; T452-T454 WeakPolarHBondContact OG1-CB 3.49Å; T452-T454 PolarHBondContact OG1-N 3.13Å; T452-T454 PolarHBondContact OG1-OG1 2.89Å; T452-V455 VanDerWaalsContact O-CG2 3.3Å; T452-V455 WeakPolarHBondContact O-CG2 3.45Å; T452-V455 PolarHBondContact O-N 3.02Å
453	M	98	Very high	98	Very high	18 Å²	18	37.8 Å²	37.8	9%	0.089	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-52.5	-21.2	174.8	-74.7	-56.3	-54.8	0	0	115	Y78 L81 A82 T85 Q311 A313 V455 Q456	Y78-M453 HydrophobicContact CD1-CE 4.17Å; Y78-M453 HydrophobicContact CD2-CE 3.73Å; Y78-M453 HydrophobicContact CE1-CE 3.78Å; Y78-M453 HydrophobicContact CE2-CE 3.3Å; Y78-M453 HydrophobicContact CG-CE 4.15Å; L81-M453 HydrophobicContact CB-CE 4.49Å; L81-M453 HydrophobicContact CB-SD 4.19Å; L81-M453 HydrophobicContact CD2-CE 4.28Å; L81-M453 HydrophobicContact CD2-SD 3.8Å; L81-M453 HydrophobicContact CG-CE 4.3Å; L81-M453 HydrophobicContact CG-SD 3.52Å; L81-M453 VanDerWaalsContact CG-SD 3.52Å; A82-M453 HydrophobicContact CB-CE 3.84Å; A82-M453 HydrophobicContact CB-CG 4.26Å; A82-M453 HydrophobicContact CB-SD 4.19Å; T85-M453 WeakPolarHBondContact OG1-CG 3.18Å; Q311-M453 VanDerWaalsContact OE1-N 3.12Å; A313-M453 HydrophobicContact CB-SD 4.28Å; M453-V455 PolarHBondContact O-N 3.12Å; M453-Q456 HydrophobicContact CE-CB 4.22Å; M453-Q456 PolarHBondContact O-N 3.12Å
454	T	96.2	Very high	98	Very high	128 Å²	128	36.1 Å²	36.1	79%	0.785	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-59.6	-26.6	176.8	-48	0	0	0	0	113.2	T452	T452-T454 PolarHBondContact O-N 3.43Å; T452-T454 WeakPolarHBondContact OG1-CB 3.49Å; T452-T454 PolarHBondContact OG1-N 3.13Å; T452-T454 PolarHBondContact OG1-OG1 2.89Å
455	V	96.1	Very high	98.1	Very high	15 Å²	15	32 Å²	32	9%	0.091	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-84.4	-17.1	-178.1	-47.2	0	0	0	0	112.7	M314 F445 G450 T452 M453	M314-V455 HydrophobicContact CB-CG2 3.88Å; M314-V455 HydrophobicContact CG-CG2 4.16Å; M314-V455 HydrophobicContact SD-CG2 3.88Å; F445-V455 HydrophobicContact CB-CG1 4.22Å; F445-V455 HydrophobicContact CD1-CG1 3.87Å; F445-V455 HydrophobicContact CD2-CB 4.25Å; F445-V455 HydrophobicContact CD2-CG1 3.7Å; F445-V455 HydrophobicContact CE1-CG1 4.11Å; F445-V455 HydrophobicContact CE2-CB 4.41Å; F445-V455 HydrophobicContact CE2-CG1 3.94Å; F445-V455 HydrophobicContact CG-CG1 3.66Å; F445-V455 HydrophobicContact CZ-CG1 4.14Å; G450-V455 WeakPolarHBondContact O-CG1 3.37Å; T452-V455 VanDerWaalsContact O-CG2 3.3Å; T452-V455 WeakPolarHBondContact O-CG2 3.45Å; T452-V455 PolarHBondContact O-N 3.02Å; M453-V455 PolarHBondContact O-N 3.12Å
456	Q	97.7	Very high	98.2	Very high	11 Å²	11	29.3 Å²	29.3	5%	0.051	16%	0.163	C	C	.	.			trans	-89.3	142.2	-175.6	-68.4	-73	14.3	0	0	111.2	Y78 L81 A313 T380 M453 M461	Y78-Q456 HydrophobicContact CD2-CB 4.14Å; Y78-Q456 HydrophobicContact CE2-CB 3.76Å; L81-Q456 HydrophobicContact CD2-CG 3.88Å; A313-Q456 PolarHBondContact O-NE2 2.72Å; T380-Q456 VanDerWaalsContact OG1-CD 3.28Å; T380-Q456 PolarHBondContact OG1-NE2 3.34Å; T380-Q456 PolarHBondContact OG1-OE1 3.32Å; M453-Q456 HydrophobicContact CE-CB 4.22Å; M453-Q456 PolarHBondContact O-N 3.12Å; Q456-M461 HydrophobicContact CB-SD 4.39Å
457	D	98.3	Very high	98.2	Very high	72 Å²	72	28.8 Å²	28.8	39%	0.385	16%	0.161	S	C	.	.			trans	-111.6	126.8	172.7	-178	-82.3	0	0	0	109.8	H459 D460 M461	D457-H459 VanDerWaalsContact C-N 3.29Å; D457-H459 PolarHBondContact O-N 3.18Å; D457-H459 WeakPolarHBondContact OD1-CA 3.3Å; D457-H459 VanDerWaalsContact OD1-CB 3.24Å; D457-H459 WeakPolarHBondContact OD1-CB 3.2Å; D457-H459 PolarHBondContact OD1-N 3.19Å; D457-D460 HydrophobicContact CB-CB 4.01Å; D457-D460 PolarHBondContact O-N 3.47Å; D457-D460 PolarHBondContact OD1-N 2.6Å; D457-M461 PolarHBondContact O-N 3.22Å; D457-M461 VanDerWaalsContact O-N 3.09Å
458	P	98.6	Very high	98.2	Very high	37 Å²	37	28.3 Å²	28.3	24%	0.24	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-37.4	-179.3	-22.6	29.7	0	0	0	114.2	N75 Y78 D462	N75-P458 HydrophobicContact CB-CB 4.28Å; N75-P458 WeakPolarHBondContact OD1-CB 3.47Å; Y78-P458 HydrophobicContact CD1-CB 4.18Å; Y78-P458 HydrophobicContact CD1-CG 3.82Å; Y78-P458 HydrophobicContact CD2-CB 3.94Å; Y78-P458 HydrophobicContact CD2-CG 3.63Å; Y78-P458 HydrophobicContact CE1-CG 3.89Å; Y78-P458 HydrophobicContact CE2-CB 4.49Å; Y78-P458 HydrophobicContact CE2-CG 3.68Å; Y78-P458 HydrophobicContact CG-CB 3.76Å; Y78-P458 HydrophobicContact CG-CG 3.7Å; P458-D462 PolarHBondContact O-N 3.34Å; P458-D462 VanDerWaalsContact O-N 3.11Å
459	H	98.6	Very high	98.2	Very high	90 Å²	90	28.2 Å²	28.2	42%	0.417	16%	0.158	S	C	.	.	H	α-helix	trans	-71.6	-42.5	-179.3	-179.2	53	0	0	0	111.2	D457 M461 D462 L463	D457-H459 VanDerWaalsContact C-N 3.29Å; D457-H459 PolarHBondContact O-N 3.18Å; D457-H459 WeakPolarHBondContact OD1-CA 3.3Å; D457-H459 VanDerWaalsContact OD1-CB 3.24Å; D457-H459 WeakPolarHBondContact OD1-CB 3.2Å; D457-H459 PolarHBondContact OD1-N 3.19Å; H459-M461 VanDerWaalsContact C-N 3.31Å; H459-M461 PolarHBondContact O-N 3.31Å; H459-D462 WeakPolarHBondContact O-CB 3.26Å; H459-D462 PolarHBondContact O-N 3.21Å; H459-L463 WeakPolarHBondContact O-CG 3.32Å; H459-L463 PolarHBondContact O-N 2.66Å
460	D	98.6	Very high	98.3	Very high	18 Å²	18	22.5 Å²	22.5	10%	0.096	13%	0.131	C	C	.	.	H	α-helix	trans	-57.5	-45.8	174.2	-74.6	-19.5	0	0	0	111.1	T382 D457 D462 L463 C464	T382-D460 VanDerWaalsContact CA-CG 3.43Å; T382-D460 VanDerWaalsContact CA-OD1 3.23Å; T382-D460 WeakPolarHBondContact CA-OD1 3.21Å; T382-D460 WeakPolarHBondContact CB-OD1 3.45Å; T382-D460 PolarHBondContact N-OD1 3.36Å; T382-D460 PolarHBondContact N-OD2 2.79Å; T382-D460 PolarHBondContact OG1-OD1 3.2Å; T382-D460 PolarHBondContact OG1-OD2 3.43Å; D457-D460 HydrophobicContact CB-CB 4.01Å; D457-D460 PolarHBondContact O-N 3.47Å; D457-D460 PolarHBondContact OD1-N 2.6Å; D460-D462 VanDerWaalsContact C-N 3.33Å; D460-D462 PolarHBondContact O-N 3.45Å; D460-L463 WeakPolarHBondContact O-CB 3.31Å; D460-L463 PolarHBondContact O-N 3.02Å; D460-L463 VanDerWaalsContact O-N 3.14Å; D460-C464 PolarHBondContact O-N 3.25Å; D460-C464 PolarHBondContact O-SG 2.83Å
461	M	98.8	Very high	98.4	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.7	-35.7	177.4	-71.2	-167.2	75.4	0	0	113.3	Y78 L81 M321 I322 Q456 D457 H459 S465	Y78-M461 HydrophobicContact CD2-SD 3.82Å; Y78-M461 HydrophobicContact CG-SD 4.34Å; L81-M461 HydrophobicContact CB-CE 4.23Å; L81-M461 HydrophobicContact CD2-CE 3.74Å; L81-M461 HydrophobicContact CD2-SD 3.83Å; M321-M461 HydrophobicContact CB-CE 4.33Å; I322-M461 HydrophobicContact CG2-CE 4.35Å; Q456-M461 HydrophobicContact CB-SD 4.39Å; D457-M461 PolarHBondContact O-N 3.22Å; D457-M461 VanDerWaalsContact O-N 3.09Å; H459-M461 VanDerWaalsContact C-N 3.31Å; H459-M461 PolarHBondContact O-N 3.31Å; M461-S465 WeakPolarHBondContact O-CB 3.43Å; M461-S465 PolarHBondContact O-N 3.19Å; M461-S465 PolarHBondContact O-OG 2.72Å
462	D	98.9	Very high	98.4	Very high	3 Å²	3	21.1 Å²	21.1	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-64.2	-42.5	173.6	-74.1	-14.9	0	0	0	111.2	V69 Q74 N75 P458 H459 D460 S465 A466	V69-D462 HydrophobicContact CG2-CB 4.47Å; Q74-D462 WeakPolarHBondContact CG-OD2 3.4Å; N75-D462 VanDerWaalsContact CA-OD1 3.29Å; N75-D462 WeakPolarHBondContact CA-OD1 3.31Å; N75-D462 VanDerWaalsContact N-CG 3.25Å; N75-D462 PolarHBondContact N-OD1 2.92Å; N75-D462 PolarHBondContact N-OD2 2.91Å; N75-D462 PolarHBondContact OD1-OD2 3.29Å; P458-D462 PolarHBondContact O-N 3.34Å; P458-D462 VanDerWaalsContact O-N 3.11Å; H459-D462 WeakPolarHBondContact O-CB 3.26Å; H459-D462 PolarHBondContact O-N 3.21Å; D460-D462 VanDerWaalsContact C-N 3.33Å; D460-D462 PolarHBondContact O-N 3.45Å; D462-S465 PolarHBondContact O-N 2.88Å; D462-A466 WeakPolarHBondContact O-CB 3.44Å; D462-A466 PolarHBondContact O-N 2.99Å
463	L	98.9	Very high	98.4	Very high	18 Å²	18	20.2 Å²	20.2	9%	0.094	11%	0.111	C	C	.	.	H	α-helix	trans	-64.8	-43.9	176.3	-63.4	174.7	0	0	0	111.7	V69 P383 I408 H459 D460 A466 L467	V69-L463 HydrophobicContact CG1-CD2 4.13Å; V69-L463 HydrophobicContact CG2-CD2 4.08Å; P383-L463 HydrophobicContact CG-CB 3.51Å; P383-L463 HydrophobicContact CG-CD1 4.41Å; I408-L463 HydrophobicContact CB-CD2 3.92Å; I408-L463 HydrophobicContact CG2-CD2 3.81Å; H459-L463 WeakPolarHBondContact O-CG 3.32Å; H459-L463 PolarHBondContact O-N 2.66Å; D460-L463 WeakPolarHBondContact O-CB 3.31Å; D460-L463 PolarHBondContact O-N 3.02Å; D460-L463 VanDerWaalsContact O-N 3.14Å; L463-A466 PolarHBondContact O-N 3.02Å; L463-L467 PolarHBondContact O-N 3.49Å
464	C	98.8	Very high	98.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-47.3	174.7	-64.1	0	0	0	0	110.9	I322 F381 L435 D460 A466 L467 W468	I322-C464 HydrophobicContact CD1-CB 4.15Å; I322-C464 HydrophobicContact CG2-CB 4.13Å; F381-C464 PolarHBondContact O-SG 3.37Å; L435-C464 HydrophobicContact CD2-CB 3.9Å; D460-C464 PolarHBondContact O-N 3.25Å; D460-C464 PolarHBondContact O-SG 2.83Å; C464-A466 VanDerWaalsContact C-N 3.34Å; C464-A466 PolarHBondContact O-N 3.41Å; C464-L467 PolarHBondContact O-N 3.28Å; C464-W468 VanDerWaalsContact O-CB 3.3Å; C464-W468 WeakPolarHBondContact O-CB 3.26Å; C464-W468 PolarHBondContact O-N 3.42Å
465	S	98.9	Very high	98.6	Very high	2 Å²	2	13.3 Å²	13.3	1%	0.014	7%	0.07	C	C	.	.	H	α-helix	trans	-60.9	-42.1	179	-55.9	0	0	0	0	111.8	S77 M461 D462 A469	S77-S465 PolarHBondContact OG-OG 2.92Å; M461-S465 WeakPolarHBondContact O-CB 3.43Å; M461-S465 PolarHBondContact O-N 3.19Å; M461-S465 PolarHBondContact O-OG 2.72Å; D462-S465 PolarHBondContact O-N 2.88Å; S465-A469 VanDerWaalsContact O-CB 3.25Å; S465-A469 WeakPolarHBondContact O-CB 3.32Å; S465-A469 PolarHBondContact O-N 3.1Å
466	A	98.9	Very high	98.7	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-63.2	-48.4	176.8	0	0	0	0	0	112	I65 A68 V69 I408 D462 L463 C464 W468 A469 V470	I65-A466 HydrophobicContact CG1-CB 4.22Å; A68-A466 HydrophobicContact CB-CB 3.92Å; V69-A466 HydrophobicContact CG2-CB 3.95Å; I408-A466 HydrophobicContact CD1-CB 4.39Å; D462-A466 WeakPolarHBondContact O-CB 3.44Å; D462-A466 PolarHBondContact O-N 2.99Å; L463-A466 PolarHBondContact O-N 3.02Å; C464-A466 VanDerWaalsContact C-N 3.34Å; C464-A466 PolarHBondContact O-N 3.41Å; A466-W468 PolarHBondContact O-N 3.32Å; A466-A469 PolarHBondContact O-N 3.08Å; A466-V470 WeakPolarHBondContact O-CB 3.46Å; A466-V470 VanDerWaalsContact O-CG2 3.26Å; A466-V470 WeakPolarHBondContact O-CG2 3.49Å; A466-V470 PolarHBondContact O-N 3.48Å
467	L	98.8	Very high	98.8	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-57.3	-50.6	176.3	178.6	157.2	0	0	0	111.1	P383 L386 L405 I408 V410 L435 L463 C464 A469 V470 V471	P383-L467 HydrophobicContact CB-CD1 4.39Å; L386-L467 HydrophobicContact CD1-CD2 4.02Å; L405-L467 HydrophobicContact CD1-CB 4.32Å; L405-L467 HydrophobicContact CD1-CD1 3.93Å; L405-L467 HydrophobicContact CD1-CG 3.65Å; L405-L467 HydrophobicContact CD2-CB 4.35Å; I408-L467 HydrophobicContact CD1-CB 4.48Å; V410-L467 HydrophobicContact CB-CD1 4.11Å; V410-L467 HydrophobicContact CG1-CD1 3.4Å; L435-L467 HydrophobicContact CD1-CD1 4.07Å; L435-L467 HydrophobicContact CD1-CD2 3.72Å; L435-L467 HydrophobicContact CD1-CG 4.39Å; L463-L467 PolarHBondContact O-N 3.49Å; C464-L467 PolarHBondContact O-N 3.28Å; L467-A469 PolarHBondContact O-N 3.22Å; L467-V470 PolarHBondContact O-N 2.85Å; L467-V471 HydrophobicContact CD2-CG2 4.31Å; L467-V471 WeakPolarHBondContact O-CG2 3.33Å; L467-V471 PolarHBondContact O-N 3.38Å
468	W	98.7	Very high	98.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-59.8	-47	-176.7	-149	-127	0	0	0	111.5	L300 I322 S323 A326 M374 E375 L386 L435 C464 A466 A472	L300-W468 HydrophobicContact CB-CZ2 4.47Å; I322-W468 HydrophobicContact CD1-CD2 4.36Å; I322-W468 HydrophobicContact CD1-CG 4.23Å; S323-W468 PolarHBondContact OG-NE1 3.35Å; A326-W468 HydrophobicContact CB-CB 4.49Å; M374-W468 HydrophobicContact CB-CH2 3.49Å; M374-W468 VanDerWaalsContact CB-CH2 3.49Å; M374-W468 HydrophobicContact CB-CZ2 3.43Å; M374-W468 VanDerWaalsContact CB-CZ2 3.43Å; M374-W468 HydrophobicContact CB-CZ3 4.28Å; M374-W468 HydrophobicContact CE-CD2 3.74Å; M374-W468 HydrophobicContact CE-CE3 3.48Å; M374-W468 VanDerWaalsContact CE-CE3 3.48Å; M374-W468 HydrophobicContact CE-CH2 3.87Å; M374-W468 HydrophobicContact CE-CZ2 4.11Å; M374-W468 HydrophobicContact CE-CZ3 3.55Å; E375-W468 VanDerWaalsContact C-CH2 3.48Å; E375-W468 WeakPolarHBondContact O-CH2 3.49Å; L386-W468 HydrophobicContact CD1-CZ3 4.17Å; L435-W468 HydrophobicContact CB-CE3 4.31Å; L435-W468 HydrophobicContact CB-CH2 4.41Å; L435-W468 HydrophobicContact CB-CZ3 3.81Å; L435-W468 HydrophobicContact CD1-CE3 4.45Å; C464-W468 VanDerWaalsContact O-CB 3.3Å; C464-W468 WeakPolarHBondContact O-CB 3.26Å; C464-W468 PolarHBondContact O-N 3.42Å; A466-W468 PolarHBondContact O-N 3.32Å; W468-A472 VanDerWaalsContact O-CB 3.23Å; W468-A472 WeakPolarHBondContact O-CB 3.39Å; W468-A472 PolarHBondContact O-N 3.21Å
469	A	98.9	Very high	98.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-65.3	-44.5	178.9	0	0	0	0	0	113.1	I64 A326 L329 S465 A466 L467 Y473	I64-A469 HydrophobicContact CG2-CB 3.6Å; A326-A469 HydrophobicContact CB-CB 3.95Å; L329-A469 HydrophobicContact CD1-CB 4.03Å; S465-A469 VanDerWaalsContact O-CB 3.25Å; S465-A469 WeakPolarHBondContact O-CB 3.32Å; S465-A469 PolarHBondContact O-N 3.1Å; A466-A469 PolarHBondContact O-N 3.08Å; L467-A469 PolarHBondContact O-N 3.22Å; A469-Y473 VanDerWaalsContact O-CB 3.22Å; A469-Y473 WeakPolarHBondContact O-CB 3.49Å; A469-Y473 PolarHBondContact O-N 2.84Å
470	V	98.9	Very high	98.5	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.5	-50.5	179.3	168.1	0	0	0	0	110.5	A61 I64 I65 L404 L405 A466 L467 V474	A61-V470 HydrophobicContact CB-CG1 3.84Å; A61-V470 HydrophobicContact CB-CG2 4.1Å; I64-V470 HydrophobicContact CB-CG2 3.91Å; I64-V470 HydrophobicContact CD1-CG2 4.21Å; I64-V470 HydrophobicContact CG2-CG2 3.74Å; I65-V470 HydrophobicContact CD1-CG2 4.48Å; I65-V470 HydrophobicContact CG1-CG2 4.11Å; L404-V470 HydrophobicContact CB-CG1 4.27Å; L405-V470 HydrophobicContact CD2-CB 3.84Å; L405-V470 HydrophobicContact CD2-CG1 3.86Å; L405-V470 HydrophobicContact CD2-CG2 4.16Å; L405-V470 HydrophobicContact CG-CG1 4.48Å; A466-V470 WeakPolarHBondContact O-CB 3.46Å; A466-V470 VanDerWaalsContact O-CG2 3.26Å; A466-V470 WeakPolarHBondContact O-CG2 3.49Å; A466-V470 PolarHBondContact O-N 3.48Å; L467-V470 PolarHBondContact O-N 2.85Å; V470-V474 HydrophobicContact CG1-CG2 4.34Å; V470-V474 WeakPolarHBondContact O-CB 3.4Å; V470-V474 WeakPolarHBondContact O-CG2 3.48Å; V470-V474 PolarHBondContact O-N 2.83Å
471	V	98.9	Very high	98.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-60.7	-51	-179.1	171	0	0	0	0	110.4	L372 M374 L386 M398 V401 L405 L467 Y473 V474 V475	L372-V471 HydrophobicContact CD2-CG1 4.34Å; M374-V471 HydrophobicContact CE-CB 4.05Å; M374-V471 HydrophobicContact CE-CG1 3.66Å; M374-V471 HydrophobicContact SD-CG1 4.07Å; L386-V471 HydrophobicContact CD2-CG1 4.1Å; L386-V471 HydrophobicContact CD2-CG2 4.36Å; M398-V471 HydrophobicContact CE-CG1 3.83Å; V401-V471 HydrophobicContact CG1-CG2 4.33Å; L405-V471 HydrophobicContact CD1-CG2 4.35Å; L467-V471 HydrophobicContact CD2-CG2 4.31Å; L467-V471 WeakPolarHBondContact O-CG2 3.33Å; L467-V471 PolarHBondContact O-N 3.38Å; V471-Y473 PolarHBondContact O-N 2.77Å; V471-V474 PolarHBondContact O-N 3.3Å; V471-V475 VanDerWaalsContact O-CG2 3.32Å; V471-V475 WeakPolarHBondContact O-CG2 3.38Å; V471-V475 PolarHBondContact O-N 3.14Å; V471-V475 VanDerWaalsContact O-N 3.12Å
472	A	98.9	Very high	98.3	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.008	6%	0.063	C	C	.	.	H	α-helix	trans	-60.7	-47.7	-177.9	0	0	0	0	0	112	V298 L300 L341 M374 W468 A476	V298-A472 HydrophobicContact CG1-CB 4.19Å; L300-A472 HydrophobicContact CD2-CB 3.89Å; L341-A472 HydrophobicContact CD2-CB 3.95Å; L341-A472 WeakPolarHBondContact CD2-O 3.39Å; M374-A472 HydrophobicContact SD-CB 4.07Å; W468-A472 VanDerWaalsContact O-CB 3.23Å; W468-A472 WeakPolarHBondContact O-CB 3.39Å; W468-A472 PolarHBondContact O-N 3.21Å; A472-A476 WeakPolarHBondContact O-CB 3.49Å; A472-A476 PolarHBondContact O-N 2.69Å
473	Y	98.9	Very high	98	Very high	12 Å²	12	14.6 Å²	14.6	5%	0.047	8%	0.077	C	C	.	.	H	α-helix	trans	-63.7	-48.6	-179.2	178.7	-90	0	0	0	112.3	Y57 V60 I64 I330 L335 P337 A469 V471 V475 A476 D477	Y57-Y473 HydrophobicContact CD1-CE1 4.07Å; Y57-Y473 HydrophobicContact CE1-CE1 4.12Å; V60-Y473 HydrophobicContact CG1-CD1 3.83Å; V60-Y473 HydrophobicContact CG1-CE1 3.61Å; I64-Y473 HydrophobicContact CD1-CG 4.43Å; I330-Y473 HydrophobicContact CD1-CD2 3.73Å; I330-Y473 HydrophobicContact CD1-CG 3.79Å; I330-Y473 HydrophobicContact CG1-CD2 4.15Å; I330-Y473 HydrophobicContact CG2-CD2 3.8Å; I330-Y473 HydrophobicContact CG2-CE2 4.24Å; L335-Y473 HydrophobicContact CB-CD2 4.26Å; L335-Y473 HydrophobicContact CB-CE2 3.6Å; L335-Y473 HydrophobicContact CD1-CD2 4.43Å; L335-Y473 HydrophobicContact CD1-CE2 4.2Å; L335-Y473 HydrophobicContact CG-CE2 4.36Å; P337-Y473 HydrophobicContact CB-CD2 4.21Å; P337-Y473 HydrophobicContact CB-CE2 4.01Å; P337-Y473 HydrophobicContact CG-CD2 4.21Å; P337-Y473 HydrophobicContact CG-CE2 4.25Å; A469-Y473 VanDerWaalsContact O-CB 3.22Å; A469-Y473 WeakPolarHBondContact O-CB 3.49Å; A469-Y473 PolarHBondContact O-N 2.84Å; V471-Y473 PolarHBondContact O-N 2.77Å; Y473-V475 PolarHBondContact O-N 2.64Å; Y473-A476 PolarHBondContact O-N 2.85Å; Y473-D477 HydrophobicContact CE1-CB 4.11Å; Y473-D477 WeakPolarHBondContact O-CB 3.3Å; Y473-D477 PolarHBondContact O-N 3.18Å; Y473-D477 PolarHBondContact OH-OD2 3.12Å
474	V	98.8	Very high	97.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.5	-48.4	-176.1	172.6	0	0	0	0	109.8	Y57 V401 L404 V470 V471 A476 D477 L478	Y57-V474 HydrophobicContact CD1-CG2 4.36Å; Y57-V474 HydrophobicContact CD2-CG1 3.95Å; Y57-V474 HydrophobicContact CE2-CG1 4.42Å; Y57-V474 HydrophobicContact CG-CG1 4.17Å; Y57-V474 HydrophobicContact CG-CG2 4.04Å; V401-V474 HydrophobicContact CG1-CB 4.32Å; V401-V474 HydrophobicContact CG1-CG1 4.22Å; V401-V474 HydrophobicContact CG2-CG1 3.86Å; L404-V474 HydrophobicContact CD1-CG1 4.27Å; L404-V474 HydrophobicContact CD1-CG2 3.84Å; V470-V474 HydrophobicContact CG1-CG2 4.34Å; V470-V474 WeakPolarHBondContact O-CB 3.4Å; V470-V474 WeakPolarHBondContact O-CG2 3.48Å; V470-V474 PolarHBondContact O-N 2.83Å; V471-V474 PolarHBondContact O-N 3.3Å; V474-A476 VanDerWaalsContact C-N 3.34Å; V474-A476 PolarHBondContact O-N 2.83Å; V474-D477 PolarHBondContact O-N 3.5Å; V474-D477 VanDerWaalsContact O-N 3.14Å; V474-L478 WeakPolarHBondContact O-CG 3.38Å; V474-L478 PolarHBondContact O-N 2.86Å
475	V	98.8	Very high	96.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.8	-43.4	177.6	176.1	0	0	0	0	111.2	V298 R339 L372 M398 V471 Y473 D477 L478 L482	V298-V475 HydrophobicContact CG2-CB 4.35Å; V298-V475 HydrophobicContact CG2-CG1 3.85Å; R339-V475 PolarHBondContact NH1-O 2.76Å; L372-V475 HydrophobicContact CB-CG1 4.09Å; L372-V475 HydrophobicContact CD2-CB 4.34Å; L372-V475 HydrophobicContact CD2-CG1 4.14Å; L372-V475 HydrophobicContact CD2-CG2 4.1Å; M398-V475 HydrophobicContact CE-CG2 4.45Å; M398-V475 HydrophobicContact SD-CG2 3.82Å; V471-V475 VanDerWaalsContact O-CG2 3.32Å; V471-V475 WeakPolarHBondContact O-CG2 3.38Å; V471-V475 PolarHBondContact O-N 3.14Å; V471-V475 VanDerWaalsContact O-N 3.12Å; Y473-V475 PolarHBondContact O-N 2.64Å; V475-D477 PolarHBondContact O-N 3.06Å; V475-L478 PolarHBondContact O-N 3.33Å; V475-L482 HydrophobicContact CG1-CD1 3.91Å; V475-L482 HydrophobicContact CG1-CG 4.04Å
476	A	98.8	Very high	94.3	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.8	-21.5	178.9	0	0	0	0	0	113.8	V298 P337 R338 R339 L341 A472 Y473 V474	V298-A476 HydrophobicContact CB-CB 4.1Å; V298-A476 HydrophobicContact CG2-CB 3.79Å; P337-A476 HydrophobicContact CB-CB 3.68Å; P337-A476 HydrophobicContact CG-CB 3.94Å; R338-A476 PolarHBondContact N-O 3.06Å; R339-A476 HydrophobicContact CB-CB 4.27Å; R339-A476 WeakPolarHBondContact CB-O 3.38Å; R339-A476 WeakPolarHBondContact CG-O 3.36Å; R339-A476 PolarHBondContact N-O 2.94Å; L341-A476 HydrophobicContact CD2-CB 3.56Å; L341-A476 HydrophobicContact CG-CB 4.18Å; A472-A476 WeakPolarHBondContact O-CB 3.49Å; A472-A476 PolarHBondContact O-N 2.69Å; Y473-A476 PolarHBondContact O-N 2.85Å; V474-A476 VanDerWaalsContact C-N 3.34Å; V474-A476 PolarHBondContact O-N 2.83Å
477	D	98.8	Very high	94.1	Very high	21 Å²	21	33.6 Å²	33.6	11%	0.112	17%	0.174	C	C	.	.	H	α-helix	trans	-103.9	-8.3	-177.6	-149.8	34.8	0	0	0	114.1	Y57 P337 R338 Y473 V474 V475	Y57-D477 HydrophobicContact CE1-CB 3.86Å; Y57-D477 WeakPolarHBondContact CE1-OD2 2.99Å; Y57-D477 PolarHBondContact OH-O 3.05Å; P337-D477 VanDerWaalsContact CA-OD1 3.29Å; P337-D477 WeakPolarHBondContact CA-OD1 3.38Å; P337-D477 HydrophobicContact CB-CB 3.94Å; R338-D477 VanDerWaalsContact CD-O 3.26Å; R338-D477 WeakPolarHBondContact CD-O 3.35Å; R338-D477 WeakPolarHBondContact CG-OD1 3.11Å; R338-D477 PolarHBondContact N-OD1 2.91Å; R338-D477 PolarHBondContact NE-O 2.98Å; Y473-D477 HydrophobicContact CE1-CB 4.11Å; Y473-D477 WeakPolarHBondContact O-CB 3.3Å; Y473-D477 PolarHBondContact O-N 3.18Å; Y473-D477 PolarHBondContact OH-OD2 3.12Å; V474-D477 PolarHBondContact O-N 3.5Å; V474-D477 VanDerWaalsContact O-N 3.14Å; V475-D477 PolarHBondContact O-N 3.06Å
478	L	98.3	Very high	93.8	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.031	18%	0.183	C	C	.	.	S	Bend	trans	-53.6	145.8	171.6	-71.8	177.4	0	0	0	111.4	E53 V54 Y57 R339 V397 V474 V475 D480 L482	E53-L478 HydrophobicContact CG-CD2 3.83Å; V54-L478 HydrophobicContact CG2-CD2 4.14Å; Y57-L478 HydrophobicContact CE2-CD2 4.19Å; R339-L478 PolarHBondContact NH1-O 2.91Å; R339-L478 PolarHBondContact NH2-O 3.36Å; V397-L478 HydrophobicContact CG1-CD1 3.61Å; V474-L478 WeakPolarHBondContact O-CG 3.38Å; V474-L478 PolarHBondContact O-N 2.86Å; V475-L478 PolarHBondContact O-N 3.33Å; L478-D480 VanDerWaalsContact C-N 3.3Å; L478-D480 WeakPolarHBondContact CB-O 3.31Å; L478-D480 PolarHBondContact O-N 3.14Å; L478-L482 HydrophobicContact CD1-CD2 4.46Å
479	E	96.3	Very high	93.6	Very high	70 Å²	70	37.3 Å²	37.3	33%	0.327	19%	0.194	S	C	.	.	S	Bend	trans	-58.9	-42.7	179	-73.9	166.3	-168.7	0	0	111.9	K45 E53 R56 R339	K45-E479 IonicContact NZ-OE2 2.86Å; K45-E479 PolarHBondContact NZ-OE2 3.08Å; E53-E479 VanDerWaalsContact OE1-CB 3.31Å; E53-E479 WeakPolarHBondContact OE1-CB 3.37Å; E53-E479 VanDerWaalsContact OE1-CG 3.3Å; E53-E479 WeakPolarHBondContact OE1-CG 3.37Å; E53-E479 PolarHBondContact OE1-N 3.24Å; R56-E479 IonicContact CZ-OE1 2.83Å; R56-E479 IonicContact NH1-OE1 3.8Å; R56-E479 IonicContact NH2-OE1 3.64Å; R56-E479 PolarHBondContact NH2-OE1 3.49Å; R339-E479 PolarHBondContact NH2-O 3.44Å
480	D	95.3	Very high	93.3	Very high	81 Å²	81	39.5 Å²	39.5	43%	0.433	21%	0.205	S	C	.	.	S	Bend	trans	-114.3	152	179.4	-58	-63.2	0	0	0	110.6	K45 L478	K45-D480 WeakPolarHBondContact CE-OD2 3.48Å; K45-D480 IonicContact NZ-OD2 3.72Å; K45-D480 PolarHBondContact NZ-OD2 2.99Å; L478-D480 VanDerWaalsContact C-N 3.3Å; L478-D480 WeakPolarHBondContact CB-O 3.31Å; L478-D480 PolarHBondContact O-N 3.14Å
481	M	96.8	Very high	92.9	Very high	44 Å²	44	41.9 Å²	41.9	22%	0.217	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-66.2	156.8	169.8	-70.1	175.7	76.6	0	0	110.3	Q296 S368 D371	Q296-M481 VanDerWaalsContact CD-SD 3.56Å; Q296-M481 HydrophobicContact CG-SD 4.01Å; S368-M481 WeakPolarHBondContact O-CE 3.37Å; D371-M481 HydrophobicContact CB-CE 3.61Å; D371-M481 HydrophobicContact CB-CG 4.2Å; D371-M481 WeakPolarHBondContact OD1-CA 3.42Å; D371-M481 WeakPolarHBondContact OD1-CB 3.24Å
482	L	96.7	Very high	92.5	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-56.5	132.1	171.8	-67.3	179.4	0	0	0	110.6	D371 L372 F388 A394 V397 M398 P431 V475 L478 R484	D371-L482 WeakPolarHBondContact OD1-CB 3.29Å; D371-L482 PolarHBondContact OD1-N 2.99Å; L372-L482 HydrophobicContact CB-CD1 4.28Å; L372-L482 HydrophobicContact CD1-CD1 4.34Å; F388-L482 HydrophobicContact CE2-CD1 4.24Å; F388-L482 HydrophobicContact CZ-CD1 4.35Å; A394-L482 HydrophobicContact CB-CB 4.1Å; A394-L482 HydrophobicContact CB-CD2 4.43Å; V397-L482 HydrophobicContact CB-CD2 3.91Å; V397-L482 HydrophobicContact CG1-CD2 3.74Å; V397-L482 HydrophobicContact CG2-CD2 4.44Å; M398-L482 HydrophobicContact SD-CD1 4.17Å; M398-L482 HydrophobicContact SD-CD2 4.4Å; P431-L482 HydrophobicContact CB-CD1 4.15Å; P431-L482 HydrophobicContact CG-CB 4.03Å; P431-L482 HydrophobicContact CG-CD1 4.43Å; V475-L482 HydrophobicContact CG1-CD1 3.91Å; V475-L482 HydrophobicContact CG1-CG 4.04Å; L478-L482 HydrophobicContact CD1-CD2 4.46Å; L482-R484 PolarHBondContact O-N 3.17Å
483	P	92.6	Very high	92.1	Very high	45 Å²	45	47.9 Å²	47.9	29%	0.292	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-60	127.6	176.3	-25.8	34.3	0	0	0	112.1	S391 A393 A394	S391-P483 PolarHBondContact OG-O 3.17Å; A393-P483 HydrophobicContact CB-CB 3.87Å; A393-P483 HydrophobicContact CB-CG 3.88Å; A394-P483 WeakPolarHBondContact CB-O 3.49Å
484	R	86.9	Confident	91.5	Very high	75 Å²	75	50.6 Å²	50.6	28%	0.283	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-80.2	163.7	-179.2	-65	-167.7	177.5	-158.9	-0.5	113.1	I367 S368 F370 L482	I367-R484 VanDerWaalsContact O-CZ 3.28Å; I367-R484 PolarHBondContact O-NH1 3.2Å; I367-R484 PolarHBondContact O-NH2 3.16Å; S368-R484 VanDerWaalsContact CA-NH2 3.33Å; S368-R484 PolarHBondContact O-NH2 3.23Å; F370-R484 PolarHBondContact O-NH2 2.69Å; L482-R484 PolarHBondContact O-N 3.17Å
485	R	74.4	Confident	90.9	Very high	114 Å²	114	54.8 Å²	54.8	43%	0.43	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-71.9	144	163.8	-68.1	-178.2	176.1	175.9	0.6	109.1	G390	G390-R485 VanDerWaalsContact C-NE 3.32Å; G390-R485 VanDerWaalsContact O-CZ 3.29Å; G390-R485 PolarHBondContact O-NE 3.26Å; G390-R485 PolarHBondContact O-NH2 3.38Å
486	P	57.6	Low	90.2	Very high	196 Å²	196	59.8 Å²	59.8	100%	1.273	31%	0.312	S	S	*	.			trans	-57.6	0	176.2	-21.4	31.2	0	0	0	114

Retrieved 486 of 486 residues in 214.2 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).