A0A087YRE1_POEFO Loading...

Hexosyltransferase

AlphaFold DB , UniProt , Accession A0A087YRE1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 332 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	K	36.9	Very low	45.4	Very low	270 Å²	270	154.1 Å²	154.1	100%	1.174	81%	0.809	S	S	*	*				0	128.8	0	-89.8	174.8	172.4	175.8	0	108.3
2	R	42.8	Very low	46.2	Very low	262 Å²	262	152.8 Å²	152.8	99%	0.989	80%	0.802	S	S	*	*			trans	-61.3	156.9	-179.5	-78.5	173.2	170.3	167.9	-3.8	112.9
3	G	35.4	Very low	47	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	79%	0.793	S	S	*	*			trans	171	63.6	161.2	0	0	0	0	0	117.9
4	N	43.7	Very low	47.8	Very low	144 Å²	144	141.2 Å²	141.2	77%	0.77	77%	0.768	S	S	*	*			trans	13.8	132.2	140.4	-121.8	9.8	0	0	0	121.9
5	R	44.5	Very low	48.7	Very low	208 Å²	208	140.3 Å²	140.3	79%	0.785	76%	0.76	S	S	*	*				140.2	113.9	113.6	-92.7	-177.4	-174.1	-173.9	1.7	116.9
6	T	43.2	Very low	49.5	Very low	131 Å²	131	139.3 Å²	139.3	80%	0.804	75%	0.753	S	S	*	*				49.4	118.9	128.5	59.7	0	0	0	0	122.4
7	G	41.7	Very low	50.3	Low	73 Å²	73	134.3 Å²	134.3	75%	0.753	74%	0.736	S	S	*	*				91.6	93.8	108.1	0	0	0	0	0	119.2
8	I	47.2	Very low	51.1	Low	147 Å²	147	131.4 Å²	131.4	75%	0.754	73%	0.726	S	S	*	*			trans	-134.9	81.7	152.4	-53.6	176.8	0	0	0	107.3
9	F	53.3	Low	52	Low	205 Å²	205	127.5 Å²	127.5	90%	0.899	71%	0.713	S	S	*	*			trans	-133.7	36.2	178.1	-119.2	-79	0	0	0	115.7
10	P	53.6	Low	52.8	Low	109 Å²	109	123.8 Å²	123.8	71%	0.708	70%	0.699	S	S	*	*	S	Bend	trans	-120.6	-8.3	161.8	20.8	-0.6	0	0	0	116.4
11	S	56.6	Low	53.6	Low	71 Å²	71	122 Å²	122	50%	0.497	69%	0.691	S	S	.	*	H	α-helix	trans	-91	-22.3	-170.7	42	0	0	0	0	115.7
12	L	55.3	Low	55.1	Low	138 Å²	138	115 Å²	115	72%	0.723	67%	0.665	S	S	*	*	H	α-helix	trans	-81.5	-27	177.9	-106.1	92.9	0	0	0	113.8
13	C	57.3	Low	56.3	Low	101 Å²	101	105 Å²	105	68%	0.682	64%	0.639	S	S	*	*	H	α-helix	trans	-76	-33.5	-175.8	-148.7	0	0	0	0	112.3	A17	C13-A17 PolarHBondContact O-N 2.64Å
14	G	57.4	Low	57.8	Low	43 Å²	43	106.7 Å²	106.7	44%	0.443	63%	0.629	S	S	.	*	H	α-helix	trans	-69	-32.9	177	0	0	0	0	0	113.9	C18	G14-C18 PolarHBondContact O-N 2.01Å; G14-C18 VanDerWaalsContact O-N 3.14Å
15	I	61.4	Low	58.9	Low	127 Å²	127	104.3 Å²	104.3	65%	0.651	62%	0.616	S	S	*	*	H	α-helix	trans	-72.9	-39.4	-179.6	-61.3	172.9	0	0	0	110.8	A19	I15-A19 PolarHBondContact O-N 3.03Å; I15-A19 VanDerWaalsContact O-N 3.15Å
16	L	61.5	Low	60	Low	124 Å²	124	101 Å²	101	65%	0.649	61%	0.608	S	S	*	*	H	α-helix	trans	-69.2	-36.8	176.5	-77.2	163.4	0	0	0	112.4	A20	L16-A20 PolarHBondContact O-N 3Å; L16-A20 VanDerWaalsContact O-N 3.16Å
17	A	64.2	Low	60.9	Low	55 Å²	55	99.8 Å²	99.8	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-41.7	175.8	0	0	0	0	0	112.4	C13 A20 V21	C13-A17 PolarHBondContact O-N 2.64Å; A17-A20 PolarHBondContact O-N 2.95Å; A17-V21 WeakPolarHBondContact O-CG2 3.44Å; A17-V21 PolarHBondContact O-N 2.8Å; A17-V21 VanDerWaalsContact O-N 3.14Å
18	C	64.4	Low	61.8	Low	83 Å²	83	101.1 Å²	101.1	56%	0.561	59%	0.586	S	S	*	*	H	α-helix	trans	-64.7	-38.4	175.4	-88.7	0	0	0	0	113	G14 L22	G14-C18 PolarHBondContact O-N 2.01Å; G14-C18 VanDerWaalsContact O-N 3.14Å; C18-L22 WeakPolarHBondContact O-CB 3.35Å; C18-L22 WeakPolarHBondContact O-CG 2.96Å; C18-L22 PolarHBondContact O-N 2.75Å
19	A	67.3	Low	62.6	Low	57 Å²	57	98.9 Å²	98.9	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-66.6	-37.8	177.4	0	0	0	0	0	112.4	I15 A23	I15-A19 PolarHBondContact O-N 3.03Å; I15-A19 VanDerWaalsContact O-N 3.15Å; A19-A23 WeakPolarHBondContact O-CB 2.87Å; A19-A23 PolarHBondContact O-N 3.29Å
20	A	68.4	Low	63	Low	53 Å²	53	92.9 Å²	92.9	44%	0.438	55%	0.551	S	S	.	*	H	α-helix	trans	-68.7	-39.9	177.4	0	0	0	0	0	112.5	L16 A17 A23 L24	L16-A20 PolarHBondContact O-N 3Å; L16-A20 VanDerWaalsContact O-N 3.16Å; A17-A20 PolarHBondContact O-N 2.95Å; A20-A23 PolarHBondContact O-N 3.3Å; A20-L24 WeakPolarHBondContact O-CG 3.48Å; A20-L24 PolarHBondContact O-N 3.3Å
21	V	69.6	Low	63.3	Low	87 Å²	87	94.4 Å²	94.4	53%	0.527	55%	0.548	S	S	.	.	H	α-helix	trans	-67.2	-40.5	176.3	174.6	0	0	0	0	111.2	A17 A23 L24 L25	A17-V21 WeakPolarHBondContact O-CG2 3.44Å; A17-V21 PolarHBondContact O-N 2.8Å; A17-V21 VanDerWaalsContact O-N 3.14Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.35Å; V21-L24 PolarHBondContact O-N 2.99Å; V21-L25 HydrophobicContact CG1-CD1 4.22Å; V21-L25 WeakPolarHBondContact O-CG 3.11Å; V21-L25 PolarHBondContact O-N 3.17Å
22	L	67.4	Low	63.3	Low	122 Å²	122	95.2 Å²	95.2	64%	0.639	55%	0.55	S	S	*	*	H	α-helix	trans	-64.1	-36.5	174.2	-80.4	163	0	0	0	112.6	C18 F26	C18-L22 WeakPolarHBondContact O-CB 3.35Å; C18-L22 WeakPolarHBondContact O-CG 2.96Å; C18-L22 PolarHBondContact O-N 2.75Å; L22-F26 WeakPolarHBondContact O-CB 2.88Å; L22-F26 PolarHBondContact O-N 2.89Å; L22-F26 VanDerWaalsContact O-N 3.07Å
23	A	69.1	Low	63.2	Low	52 Å²	52	97 Å²	97	43%	0.43	55%	0.548	S	S	.	.	H	α-helix	trans	-69	-39	176.8	0	0	0	0	0	112.8	A19 A20 V21 F26 L27	A19-A23 WeakPolarHBondContact O-CB 2.87Å; A19-A23 PolarHBondContact O-N 3.29Å; A20-A23 PolarHBondContact O-N 3.3Å; V21-A23 VanDerWaalsContact C-N 3.34Å; V21-A23 PolarHBondContact O-N 3.35Å; A23-F26 PolarHBondContact O-N 3.48Å; A23-L27 PolarHBondContact O-N 3.41Å; A23-L27 VanDerWaalsContact O-N 3.13Å
24	L	66.6	Low	63.2	Low	110 Å²	110	97.2 Å²	97.2	58%	0.576	55%	0.545	S	S	*	.	H	α-helix	trans	-67.8	-42.1	176.3	-71	169.8	0	0	0	111.7	A20 V21 F26 L27 D28	A20-L24 WeakPolarHBondContact O-CG 3.48Å; A20-L24 PolarHBondContact O-N 3.3Å; V21-L24 PolarHBondContact O-N 2.99Å; L24-F26 PolarHBondContact O-N 3.16Å; L24-L27 PolarHBondContact O-N 3Å; L24-D28 PolarHBondContact O-N 2.69Å; L24-D28 VanDerWaalsContact O-N 3.11Å
25	L	67.8	Low	63.1	Low	94 Å²	94	100.4 Å²	100.4	49%	0.492	56%	0.556	S	S	.	*	H	α-helix	trans	-62.1	-32	173.2	-70.2	175.8	0	0	0	112.5	V21 I29	V21-L25 HydrophobicContact CG1-CD1 4.22Å; V21-L25 WeakPolarHBondContact O-CG 3.11Å; V21-L25 PolarHBondContact O-N 3.17Å; L25-I29 WeakPolarHBondContact O-CD1 2.97Å; L25-I29 WeakPolarHBondContact O-CG1 3.35Å; L25-I29 PolarHBondContact O-N 3.17Å
26	F	66.1	Low	62.6	Low	139 Å²	139	99.2 Å²	99.2	61%	0.61	56%	0.559	S	S	*	*	H	α-helix	trans	-73	-32.9	177	-154.8	-95.4	0	0	0	112.7	L22 A23 L24 I30	L22-F26 WeakPolarHBondContact O-CB 2.88Å; L22-F26 PolarHBondContact O-N 2.89Å; L22-F26 VanDerWaalsContact O-N 3.07Å; A23-F26 PolarHBondContact O-N 3.48Å; L24-F26 PolarHBondContact O-N 3.16Å; F26-I30 HydrophobicContact CD1-CD1 3.88Å; F26-I30 HydrophobicContact CE1-CD1 3.96Å; F26-I30 WeakPolarHBondContact O-CG1 3.31Å; F26-I30 PolarHBondContact O-N 2.74Å
27	L	63.3	Low	61.8	Low	105 Å²	105	98.5 Å²	98.5	55%	0.55	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-40.7	175.1	-70.6	172.1	0	0	0	112	A23 L24 I29 I30 E31	A23-L27 PolarHBondContact O-N 3.41Å; A23-L27 VanDerWaalsContact O-N 3.13Å; L24-L27 PolarHBondContact O-N 3Å; L27-I29 VanDerWaalsContact C-N 3.29Å; L27-I29 PolarHBondContact O-N 2.89Å; L27-I30 PolarHBondContact O-N 2.6Å; L27-I30 VanDerWaalsContact O-N 3.14Å; L27-E31 PolarHBondContact O-N 2.85Å
28	D	60.2	Low	61.1	Low	102 Å²	102	99.3 Å²	99.3	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-63.7	-35.2	175.9	-77.9	-24.2	0	0	0	112.3	L24 I30 E31 T32	L24-D28 PolarHBondContact O-N 2.69Å; L24-D28 VanDerWaalsContact O-N 3.11Å; D28-I30 VanDerWaalsContact C-N 3.35Å; D28-E31 PolarHBondContact O-N 2.89Å; D28-T32 PolarHBondContact O-N 3.47Å; D28-T32 PolarHBondContact O-OG1 2.88Å
29	I	63.7	Low	60.2	Low	99 Å²	99	103.5 Å²	103.5	51%	0.508	58%	0.581	S	S	.	*	H	α-helix	trans	-67	-35.8	174.9	-69.4	166.6	0	0	0	111.3	L25 L27 T32 W33	L25-I29 WeakPolarHBondContact O-CD1 2.97Å; L25-I29 WeakPolarHBondContact O-CG1 3.35Å; L25-I29 PolarHBondContact O-N 3.17Å; L27-I29 VanDerWaalsContact C-N 3.29Å; L27-I29 PolarHBondContact O-N 2.89Å; I29-T32 WeakPolarHBondContact CA-OG1 3.4Å; I29-T32 PolarHBondContact O-OG1 2.62Å; I29-W33 WeakPolarHBondContact O-CB 3.41Å; I29-W33 PolarHBondContact O-N 2.86Å
30	I	62.8	Low	58.9	Low	80 Å²	80	106.4 Å²	106.4	41%	0.41	60%	0.598	S	S	.	*	H	α-helix	trans	-70.4	-43.2	176.6	-68	167.8	0	0	0	110.6	F26 L27 D28 T32 W33 V34	F26-I30 HydrophobicContact CD1-CD1 3.88Å; F26-I30 HydrophobicContact CE1-CD1 3.96Å; F26-I30 WeakPolarHBondContact O-CG1 3.31Å; F26-I30 PolarHBondContact O-N 2.74Å; L27-I30 PolarHBondContact O-N 2.6Å; L27-I30 VanDerWaalsContact O-N 3.14Å; D28-I30 VanDerWaalsContact C-N 3.35Å; I30-T32 VanDerWaalsContact C-N 3.35Å; I30-T32 PolarHBondContact O-N 3.09Å; I30-W33 PolarHBondContact O-N 3.17Å; I30-V34 HydrophobicContact CG2-CG2 4.18Å; I30-V34 WeakPolarHBondContact O-CB 3.35Å; I30-V34 VanDerWaalsContact O-CG2 3.25Å; I30-V34 WeakPolarHBondContact O-CG2 3.04Å; I30-V34 PolarHBondContact O-N 3.47Å
31	E	58.3	Low	57.2	Low	141 Å²	141	115.2 Å²	115.2	66%	0.659	62%	0.62	S	S	*	*	H	α-helix	trans	-65.4	-37.6	177.9	-72.8	-155	166	0	0	112.4	L27 D28 V34 T35	L27-E31 PolarHBondContact O-N 2.85Å; D28-E31 PolarHBondContact O-N 2.89Å; E31-V34 PolarHBondContact O-N 2.98Å; E31-T35 WeakPolarHBondContact O-CB 3.39Å; E31-T35 PolarHBondContact O-N 3.27Å; E31-T35 PolarHBondContact O-OG1 3.15Å
32	T	57.3	Low	55.6	Low	88 Å²	88	115.7 Å²	115.7	54%	0.54	63%	0.633	S	S	.	*	H	α-helix	trans	-69.8	-32.4	173.2	36.8	0	0	0	0	113	D28 I29 I30 T35 S36	D28-T32 PolarHBondContact O-N 3.47Å; D28-T32 PolarHBondContact O-OG1 2.88Å; I29-T32 WeakPolarHBondContact CA-OG1 3.4Å; I29-T32 PolarHBondContact O-OG1 2.62Å; I30-T32 VanDerWaalsContact C-N 3.35Å; I30-T32 PolarHBondContact O-N 3.09Å; T32-T35 WeakPolarHBondContact CA-OG1 3.44Å; T32-T35 PolarHBondContact O-OG1 3.17Å; T32-S36 WeakPolarHBondContact O-CB 2.78Å; T32-S36 PolarHBondContact O-N 2.86Å
33	W	54.2	Low	54	Low	176 Å²	176	116.4 Å²	116.4	67%	0.667	64%	0.642	S	S	*	*	H	α-helix	trans	-69.7	-41.9	171.9	-114	80.9	0	0	0	112.8	I29 I30 T35 S36 M37	I29-W33 WeakPolarHBondContact O-CB 3.41Å; I29-W33 PolarHBondContact O-N 2.86Å; I30-W33 PolarHBondContact O-N 3.17Å; W33-T35 VanDerWaalsContact C-N 3.32Å; W33-T35 PolarHBondContact O-N 3.1Å; W33-S36 PolarHBondContact O-N 3.32Å; W33-M37 HydrophobicContact CE3-CG 4.22Å; W33-M37 HydrophobicContact CE3-SD 3.82Å; W33-M37 HydrophobicContact CZ3-CG 4.29Å; W33-M37 HydrophobicContact CZ3-SD 3.66Å; W33-M37 PolarHBondContact O-N 3.25Å
34	V	56.4	Low	52.3	Low	104 Å²	104	120.2 Å²	120.2	63%	0.63	65%	0.651	S	S	*	*	H	α-helix	trans	-68.2	-31.2	178.9	170.6	0	0	0	0	111.7	I30 E31	I30-V34 HydrophobicContact CG2-CG2 4.18Å; I30-V34 WeakPolarHBondContact O-CB 3.35Å; I30-V34 VanDerWaalsContact O-CG2 3.25Å; I30-V34 WeakPolarHBondContact O-CG2 3.04Å; I30-V34 PolarHBondContact O-N 3.47Å; E31-V34 PolarHBondContact O-N 2.98Å
35	T	55.8	Low	50.7	Low	110 Å²	110	120.7 Å²	120.7	68%	0.675	66%	0.661	S	S	*	*	H	α-helix	trans	-83.8	-24.6	174.5	46.4	0	0	0	0	113.8	E31 T32 W33	E31-T35 WeakPolarHBondContact O-CB 3.39Å; E31-T35 PolarHBondContact O-N 3.27Å; E31-T35 PolarHBondContact O-OG1 3.15Å; T32-T35 WeakPolarHBondContact CA-OG1 3.44Å; T32-T35 PolarHBondContact O-OG1 3.17Å; W33-T35 VanDerWaalsContact C-N 3.32Å; W33-T35 PolarHBondContact O-N 3.1Å
36	S	49.7	Very low	49	Very low	102 Å²	102	123.6 Å²	123.6	71%	0.713	67%	0.672	S	S	*	*	H	α-helix	trans	-78.3	-32	175.3	-179.1	0	0	0	0	113	T32 W33 G38	T32-S36 WeakPolarHBondContact O-CB 2.78Å; T32-S36 PolarHBondContact O-N 2.86Å; W33-S36 PolarHBondContact O-N 3.32Å; S36-G38 VanDerWaalsContact C-N 3.29Å; S36-G38 PolarHBondContact O-N 2.86Å
37	M	45	Very low	47.7	Very low	109 Å²	109	123 Å²	123	54%	0.537	68%	0.679	S	S	.	*	S	Bend	trans	-76.2	82.6	166.3	-74.5	-173.2	55.9	0	0	109.9	W33 M39	W33-M37 HydrophobicContact CE3-CG 4.22Å; W33-M37 HydrophobicContact CE3-SD 3.82Å; W33-M37 HydrophobicContact CZ3-CG 4.29Å; W33-M37 HydrophobicContact CZ3-SD 3.66Å; W33-M37 PolarHBondContact O-N 3.25Å; M37-M39 VanDerWaalsContact C-N 3.31Å; M37-M39 PolarHBondContact O-N 3.47Å
38	G	50.6	Low	46.2	Very low	73 Å²	73	121.5 Å²	121.5	75%	0.753	68%	0.682	S	S	*	*			trans	-53.5	85.5	176.2	0	0	0	0	0	114.1	S36	S36-G38 VanDerWaalsContact C-N 3.29Å; S36-G38 PolarHBondContact O-N 2.86Å
39	M	43.7	Very low	45.2	Very low	171 Å²	171	124.2 Å²	124.2	84%	0.842	69%	0.694	S	S	*	*			trans	-105	55.2	164.9	-71.4	-170	65.7	0	0	110	M37	M37-M39 VanDerWaalsContact C-N 3.31Å; M37-M39 PolarHBondContact O-N 3.47Å
40	S	41.2	Very low	44.1	Very low	118 Å²	118	123.9 Å²	123.9	83%	0.825	70%	0.697	S	S	*	*			trans	-115.3	73.4	166.4	-66.6	0	0	0	0	108.9
41	R	33.4	Very low	43	Very low	238 Å²	238	124.2 Å²	124.2	90%	0.898	71%	0.706	S	S	*	*			trans	-103.8	101.3	148.5	-93.4	-176.3	172.2	172.4	-1.9	106.6	V43	R41-V43 PolarHBondContact O-N 2.88Å
42	A	36.1	Very low	42.6	Very low	96 Å²	96	120.1 Å²	120.1	79%	0.793	69%	0.692	S	S	*	*			trans	-51	112.6	157.2	0	0	0	0	0	107.3	E44	A42-E44 VanDerWaalsContact C-N 3.31Å; A42-E44 PolarHBondContact O-N 3.34Å; A42-E44 VanDerWaalsContact O-N 3.1Å
43	V	33.8	Very low	42.1	Very low	137 Å²	137	122.9 Å²	122.9	83%	0.83	70%	0.699	S	S	*	*			trans	-75.9	94.3	167.8	177.9	0	0	0	0	105.2	R41	R41-V43 PolarHBondContact O-N 2.88Å
44	E	31.4	Very low	42.1	Very low	133 Å²	133	118.5 Å²	118.5	62%	0.621	70%	0.695	S	S	*	*			trans	-52.6	137.4	157.5	-74.4	-174.3	158.5	0	0	107.6	A42 H46	A42-E44 VanDerWaalsContact C-N 3.31Å; A42-E44 PolarHBondContact O-N 3.34Å; A42-E44 VanDerWaalsContact O-N 3.1Å; E44-H46 PolarHBondContact O-N 3Å; E44-H46 IonicContact OE2-CE1 3.74Å
45	P	34.1	Very low	41.7	Very low	119 Å²	119	119.7 Å²	119.7	77%	0.773	70%	0.697	S	S	*	*			trans	-70.1	86.8	170	30.1	-30.1	0	0	0	106.5	V47	P45-V47 PolarHBondContact O-N 3.26Å
46	H	32.6	Very low	41.6	Very low	156 Å²	156	116 Å²	116	72%	0.722	68%	0.675	S	S	*	*			trans	-59.1	98	157.4	-71.4	-51.3	0	0	0	105.5	E44 A48	E44-H46 PolarHBondContact O-N 3Å; E44-H46 IonicContact OE2-CE1 3.74Å; H46-A48 PolarHBondContact O-N 3.32Å
47	V	38.6	Very low	41.7	Very low	125 Å²	125	112.2 Å²	112.2	76%	0.758	65%	0.648	S	S	*	*			trans	-55.7	91.3	153.4	176.8	0	0	0	0	103.9	P45 I49	P45-V47 PolarHBondContact O-N 3.26Å; V47-I49 VanDerWaalsContact C-N 3.31Å; V47-I49 PolarHBondContact O-N 2.8Å
48	A	30.5	Very low	42	Very low	74 Å²	74	110.7 Å²	110.7	61%	0.612	65%	0.648	S	S	*	*			trans	-57.6	107.7	168.7	0	0	0	0	0	104.3	H46 V50	H46-A48 PolarHBondContact O-N 3.32Å; A48-V50 PolarHBondContact O-N 3.08Å
49	I	40.9	Very low	42.4	Very low	159 Å²	159	113.3 Å²	113.3	82%	0.815	64%	0.639	S	S	*	*			trans	-63.1	88.6	163.6	-61.1	171.7	0	0	0	103.4	V47 S51	V47-I49 VanDerWaalsContact C-N 3.31Å; V47-I49 PolarHBondContact O-N 2.8Å; I49-S51 PolarHBondContact O-N 3.34Å
50	V	38.8	Very low	42.8	Very low	93 Å²	93	108.1 Å²	108.1	56%	0.564	62%	0.618	S	S	*	*			trans	-62.1	106.1	174.4	176.5	0	0	0	0	104.6	A48 P52	A48-V50 PolarHBondContact O-N 3.08Å; V50-P52 WeakPolarHBondContact O-CD 3.42Å
51	S	40.9	Very low	43.7	Very low	87 Å²	87	109.7 Å²	109.7	61%	0.608	61%	0.612	S	S	*	*			trans	-54.2	123.1	174	-166	0	0	0	0	107.5	I49 Q53	I49-S51 PolarHBondContact O-N 3.34Å; S51-Q53 VanDerWaalsContact C-N 3.31Å; S51-Q53 PolarHBondContact O-N 3.07Å
52	P	48.9	Very low	45.8	Very low	55 Å²	55	100.1 Å²	100.1	36%	0.357	58%	0.578	S	S	.	*			trans	-67.2	96.4	177.9	4.7	3.1	0	0	0	107.8	V50 S54 L145	V50-P52 WeakPolarHBondContact O-CD 3.42Å; P52-S54 PolarHBondContact O-N 3.13Å; P52-L145 HydrophobicContact CG-CB 4.08Å
53	Q	48.3	Very low	48.5	Very low	145 Å²	145	96.5 Å²	96.5	68%	0.678	54%	0.544	S	S	*	.			trans	-63.3	126.3	172.8	-68.8	-178.6	-10.5	0	0	108.2	S51 L55	S51-Q53 VanDerWaalsContact C-N 3.31Å; S51-Q53 PolarHBondContact O-N 3.07Å; Q53-L55 PolarHBondContact O-N 3.27Å
54	S	52.5	Low	51.3	Low	85 Å²	85	93.7 Å²	93.7	59%	0.594	52%	0.524	S	S	*	.			trans	-74.9	27.1	-176.9	57.7	0	0	0	0	114.2	P52	P52-S54 PolarHBondContact O-N 3.13Å
55	L	49.3	Very low	54.3	Low	128 Å²	128	89.1 Å²	89.1	67%	0.67	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-88.8	138	-178.8	-75.4	166.6	0	0	0	110.6	Q53	Q53-L55 PolarHBondContact O-N 3.27Å
56	P	52.7	Low	57.2	Low	32 Å²	32	86 Å²	86	21%	0.208	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-63.3	137.6	175.5	16.8	-20.1	0	0	0	110.4	S58 L156	P56-S58 PolarHBondContact O-N 2.9Å; P56-L156 HydrophobicContact CB-CB 4.47Å; P56-L156 HydrophobicContact CB-CD1 4.26Å; P56-L156 HydrophobicContact CB-CD2 4.28Å
57	P	53.1	Low	60.2	Low	24 Å²	24	79.1 Å²	79.1	16%	0.156	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-74.1	125.7	-175	27.5	-34.1	0	0	0	113.2	E62 F63 A157	P57-E62 WeakPolarHBondContact CA-OE2 3.33Å; P57-E62 HydrophobicContact CB-CB 3.78Å; P57-E62 HydrophobicContact CB-CG 4.23Å; P57-E62 WeakPolarHBondContact CB-OE2 3.46Å; P57-F63 HydrophobicContact CB-CZ 4.47Å; P57-A157 HydrophobicContact CG-CB 3.45Å; P57-A157 VanDerWaalsContact CG-CB 3.45Å
58	S	51.6	Low	62.8	Low	77 Å²	77	75.7 Å²	75.7	54%	0.538	43%	0.43	S	S	.	.			trans	-119.5	-10.4	174.2	65.3	0	0	0	0	115.4	P56 E62 R164	P56-S58 PolarHBondContact O-N 2.9Å; S58-E62 PolarHBondContact N-OE1 3.36Å; S58-E62 PolarHBondContact N-OE2 3.16Å; S58-E62 PolarHBondContact OG-OE1 2.82Å; S58-R164 PolarHBondContact O-NH1 2.94Å
59	K	57.2	Low	65.8	Low	127 Å²	127	75.8 Å²	75.8	55%	0.552	43%	0.425	S	S	*	.	S	Bend	trans	-127.5	149.5	-173.6	-64.2	-173.4	-177.8	179.1	0	113.4	E61 E62	K59-E61 PolarHBondContact O-N 3.13Å; K59-E61 VanDerWaalsContact O-N 3.15Å; K59-E62 HydrophobicContact CB-CG 4.46Å; K59-E62 PolarHBondContact N-OE1 3.39Å; K59-E62 PolarHBondContact N-OE2 3.37Å; K59-E62 WeakPolarHBondContact O-CB 3.48Å; K59-E62 PolarHBondContact O-N 3.23Å; K59-E62 VanDerWaalsContact O-N 3.12Å
60	P	53.7	Low	68.3	Low	63 Å²	63	71.7 Å²	71.7	41%	0.409	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-60	-28.9	179.9	-18.5	32.6	0	0	0	113	E62 F63 R164	P60-E62 PolarHBondContact O-N 3.06Å; P60-F63 PolarHBondContact O-N 2.9Å; P60-R164 VanDerWaalsContact CD-CZ 3.45Å; P60-R164 VanDerWaalsContact CD-NH1 3.34Å; P60-R164 VanDerWaalsContact CD-NH2 3.31Å; P60-R164 VanDerWaalsContact CG-CZ 3.43Å
61	E	59.8	Low	71	Confident	150 Å²	150	68.7 Å²	68.7	70%	0.701	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-65.7	-1	178.2	-65	173.5	-170.7	0	0	113.4	K59 R143	K59-E61 PolarHBondContact O-N 3.13Å; K59-E61 VanDerWaalsContact O-N 3.15Å; E61-R143 PolarHBondContact O-NH1 2.53Å; E61-R143 PolarHBondContact O-NH2 3.37Å
62	E	76.1	Confident	73.5	Confident	38 Å²	38	64.6 Å²	64.6	18%	0.178	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-98.4	-10.6	-179.4	-62.8	152.1	168.2	0	0	114	P57 S58 K59 P60 R143	P57-E62 WeakPolarHBondContact CA-OE2 3.33Å; P57-E62 HydrophobicContact CB-CB 3.78Å; P57-E62 HydrophobicContact CB-CG 4.23Å; P57-E62 WeakPolarHBondContact CB-OE2 3.46Å; S58-E62 PolarHBondContact N-OE1 3.36Å; S58-E62 PolarHBondContact N-OE2 3.16Å; S58-E62 PolarHBondContact OG-OE1 2.82Å; K59-E62 HydrophobicContact CB-CG 4.46Å; K59-E62 PolarHBondContact N-OE1 3.39Å; K59-E62 PolarHBondContact N-OE2 3.37Å; K59-E62 WeakPolarHBondContact O-CB 3.48Å; K59-E62 PolarHBondContact O-N 3.23Å; K59-E62 VanDerWaalsContact O-N 3.12Å; P60-E62 PolarHBondContact O-N 3.06Å; E62-R143 WeakPolarHBondContact O-CB 3.41Å; E62-R143 PolarHBondContact O-N 2.87Å
63	F	92.7	Very high	75.7	Confident	20 Å²	20	67.8 Å²	67.8	9%	0.088	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.2	171	-58.8	-75.5	0	0	0	109.4	P57 P60 M66 M116 I140 Q141 A157 W161 F165	P57-F63 HydrophobicContact CB-CZ 4.47Å; P60-F63 PolarHBondContact O-N 2.9Å; F63-M66 HydrophobicContact CB-CB 4.35Å; F63-M66 HydrophobicContact CB-CG 4.28Å; F63-M66 HydrophobicContact CB-SD 4.02Å; F63-M66 HydrophobicContact CD2-SD 4.08Å; F63-M66 HydrophobicContact CG-SD 4.27Å; F63-M116 HydrophobicContact CE1-CE 4.44Å; F63-I140 HydrophobicContact CD1-CG2 3.55Å; F63-I140 HydrophobicContact CE1-CG2 3.8Å; F63-I140 HydrophobicContact CG-CG2 4.41Å; F63-Q141 CarbonylContact C-O 3.5Å; F63-Q141 VanDerWaalsContact CA-O 3.29Å; F63-Q141 WeakPolarHBondContact CA-O 3.19Å; F63-A157 HydrophobicContact CE1-CB 4.31Å; F63-W161 HydrophobicContact CE1-CB 3.99Å; F63-W161 AromaticContact CE1-CD1 3.9Å; F63-W161 HydrophobicContact CE1-CG 4.34Å; F63-W161 HydrophobicContact CE2-CB 4.34Å; F63-W161 AromaticContact CE2-CD1 3.85Å; F63-W161 HydrophobicContact CZ-CB 3.61Å; F63-W161 AromaticContact CZ-CD1 3.75Å; F63-W161 HydrophobicContact CZ-CG 4.11Å; F63-F165 HydrophobicContact CD2-CE2 4.34Å; F63-F165 HydrophobicContact CE2-CE2 4.06Å
64	L	93.8	Very high	77.8	Confident	77 Å²	77	69.2 Å²	69.2	40%	0.403	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-38.3	178.4	-63.8	177.6	0	0	0	111.5	V119 Q141 R143	L64-V119 HydrophobicContact CD1-CG2 3.56Å; L64-Q141 HydrophobicContact CB-CB 4.33Å; L64-Q141 HydrophobicContact CB-CG 4.16Å; L64-Q141 HydrophobicContact CD1-CG 4.32Å; L64-Q141 PolarHBondContact N-O 2.87Å; L64-R143 HydrophobicContact CD2-CG 4.44Å; L64-R143 HydrophobicContact CG-CB 4.36Å
65	L	94.8	Very high	79.8	Confident	38 Å²	38	66.6 Å²	66.6	20%	0.199	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	137.4	175.4	-56.8	171.3	0	0	0	106.9	I130 A133 I140 Q141	L65-I130 HydrophobicContact CD1-CG1 4.18Å; L65-I130 HydrophobicContact CD2-CG1 4.45Å; L65-A133 HydrophobicContact CB-CB 4.39Å; L65-A133 HydrophobicContact CD1-CB 3.84Å; L65-A133 HydrophobicContact CD2-CB 4.49Å; L65-A133 HydrophobicContact CG-CB 4.48Å; L65-I140 CarbonylContact O-C 3.34Å; L65-I140 WeakPolarHBondContact O-CA 3.26Å; L65-Q141 HydrophobicContact CB-CB 3.83Å; L65-Q141 HydrophobicContact CD1-CB 4.31Å; L65-Q141 VanDerWaalsContact CD1-OE1 3.22Å; L65-Q141 HydrophobicContact CG-CB 4.21Å; L65-Q141 PolarHBondContact O-N 3.21Å
66	M	95.1	Very high	82	Confident	53 Å²	53	67.7 Å²	67.7	26%	0.261	35%	0.349	S	S	.	.			trans	-157.6	157.5	168.9	58	176.3	-75.3	0	0	109.8	F63 P69 L139 W161 F165	F63-M66 HydrophobicContact CB-CB 4.35Å; F63-M66 HydrophobicContact CB-CG 4.28Å; F63-M66 HydrophobicContact CB-SD 4.02Å; F63-M66 HydrophobicContact CD2-SD 4.08Å; F63-M66 HydrophobicContact CG-SD 4.27Å; M66-P69 HydrophobicContact CE-CG 4.23Å; M66-L139 VanDerWaalsContact CA-O 3.26Å; M66-L139 WeakPolarHBondContact CA-O 3.29Å; M66-W161 HydrophobicContact CE-CZ2 4.49Å; M66-W161 VanDerWaalsContact CE-NE1 3.34Å; M66-F165 HydrophobicContact CE-CD1 4.01Å; M66-F165 HydrophobicContact CE-CD2 3.87Å; M66-F165 HydrophobicContact CE-CE1 3.76Å; M66-F165 HydrophobicContact CE-CE2 3.59Å; M66-F165 HydrophobicContact CE-CG 4.06Å; M66-F165 HydrophobicContact CE-CZ 3.53Å; M66-F165 HydrophobicContact SD-CE2 4.1Å; M66-F165 HydrophobicContact SD-CZ 4.01Å
67	P	95	Very high	84.1	Confident	12 Å²	12	66.2 Å²	66.2	8%	0.078	34%	0.34	C	S	.	.	S	Bend	trans	-59.9	171.6	167.5	-17.3	31.4	0	0	0	110.6	V71 L114 G137 L139	P67-V71 HydrophobicContact CB-CB 4.18Å; P67-V71 HydrophobicContact CB-CG1 4.15Å; P67-V71 HydrophobicContact CB-CG2 4.3Å; P67-L114 HydrophobicContact CG-CD2 3.88Å; P67-G137 WeakPolarHBondContact CB-O 3.47Å; P67-G137 WeakPolarHBondContact CG-O 3.31Å; P67-L139 WeakPolarHBondContact CD-O 3.27Å
68	S	94.1	Very high	86.1	Confident	53 Å²	53	66.8 Å²	66.8	37%	0.371	34%	0.339	S	S	.	.			trans	-48.5	135.3	173.1	179.5	0	0	0	0	111	L70 V71	S68-L70 PolarHBondContact O-N 3.03Å; S68-L70 PolarHBondContact OG-N 3.47Å; S68-V71 VanDerWaalsContact O-CB 3.24Å; S68-V71 WeakPolarHBondContact O-CB 3.27Å; S68-V71 VanDerWaalsContact O-CG1 3.3Å; S68-V71 WeakPolarHBondContact O-CG1 3.38Å; S68-V71 PolarHBondContact O-N 2.93Å
69	P	92	Very high	88.3	Confident	75 Å²	75	63.1 Å²	63.1	49%	0.487	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-19.1	173.6	-28.9	35.8	0	0	0	114.3	M66 F165	M66-P69 HydrophobicContact CE-CG 4.23Å; P69-F165 HydrophobicContact CB-CD1 3.99Å; P69-F165 HydrophobicContact CB-CE1 3.87Å; P69-F165 HydrophobicContact CG-CE1 4.47Å
70	L	93.8	Very high	90.3	Very high	73 Å²	73	57 Å²	57	38%	0.382	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	6.3	179.1	-50.8	-177	0	0	0	113.2	S68 C72 Q73 R74	S68-L70 PolarHBondContact O-N 3.03Å; S68-L70 PolarHBondContact OG-N 3.47Å; L70-C72 VanDerWaalsContact C-N 3.34Å; L70-C72 PolarHBondContact O-N 3.17Å; L70-Q73 PolarHBondContact O-N 2.72Å; L70-R74 WeakPolarHBondContact O-CG 3.32Å; L70-R74 PolarHBondContact O-N 2.83Å
71	V	94.6	Very high	92.4	Very high	31 Å²	31	54.1 Å²	54.1	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-53.3	-49.5	-174.8	65.6	0	0	0	0	111.5	P67 S68 R74 A75 M112 W161	P67-V71 HydrophobicContact CB-CB 4.18Å; P67-V71 HydrophobicContact CB-CG1 4.15Å; P67-V71 HydrophobicContact CB-CG2 4.3Å; S68-V71 VanDerWaalsContact O-CB 3.24Å; S68-V71 WeakPolarHBondContact O-CB 3.27Å; S68-V71 VanDerWaalsContact O-CG1 3.3Å; S68-V71 WeakPolarHBondContact O-CG1 3.38Å; S68-V71 PolarHBondContact O-N 2.93Å; V71-R74 PolarHBondContact O-N 3.38Å; V71-A75 VanDerWaalsContact O-CB 3.23Å; V71-A75 WeakPolarHBondContact O-CB 3.26Å; V71-A75 PolarHBondContact O-N 3.27Å; V71-M112 HydrophobicContact CG2-SD 3.88Å; V71-W161 HydrophobicContact CG1-CH2 3.9Å; V71-W161 HydrophobicContact CG1-CZ2 4.09Å
72	C	95	Very high	94.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-72.4	-33	178.5	-88.2	0	0	0	0	112.6	L70 R74 K76 M112 F165 C166 Q168	L70-C72 VanDerWaalsContact C-N 3.34Å; L70-C72 PolarHBondContact O-N 3.17Å; C72-R74 VanDerWaalsContact C-N 3.27Å; C72-R74 PolarHBondContact O-N 3.1Å; C72-K76 WeakPolarHBondContact O-CA 3.4Å; C72-K76 PolarHBondContact O-N 3.32Å; C72-M112 WeakPolarHBondContact SG-CE 3.49Å; C72-F165 VanDerWaalsContact CB-O 3.24Å; C72-F165 WeakPolarHBondContact CB-O 3.18Å; C72-C166 HydrophobicContact CB-CB 3.73Å; C72-C166 WeakPolarHBondContact CB-SG 3.39Å; C72-C166 WeakPolarHBondContact SG-CB 3.21Å; C72-C166 CovalentContact SG-SG 2.02Å; C72-C166 PolarHBondContact SG-SG 3.41Å; C72-Q168 PolarHBondContact O-NE2 3.35Å
73	Q	94.1	Very high	95.3	Very high	123 Å²	123	45.1 Å²	45.1	58%	0.575	23%	0.226	S	C	*	.	H	α-helix	trans	-63.2	-38.9	177.7	-168.8	-173.9	23.3	0	0	111	L70 K76 Q168	L70-Q73 PolarHBondContact O-N 2.72Å; Q73-K76 WeakPolarHBondContact O-CG 3.39Å; Q73-Q168 VanDerWaalsContact CA-NE2 3.31Å; Q73-Q168 VanDerWaalsContact N-NE2 3.13Å
74	R	93.8	Very high	95.6	Very high	175 Å²	175	44.5 Å²	44.5	66%	0.66	22%	0.224	S	C	*	.	H	α-helix	trans	-75.9	-50	177.3	-66.2	174.3	-178	175.6	-0.2	111.6	L70 V71 C72	L70-R74 WeakPolarHBondContact O-CG 3.32Å; L70-R74 PolarHBondContact O-N 2.83Å; V71-R74 PolarHBondContact O-N 3.38Å; C72-R74 VanDerWaalsContact C-N 3.27Å; C72-R74 PolarHBondContact O-N 3.1Å
75	A	93.8	Very high	95.8	Very high	29 Å²	29	40.9 Å²	40.9	24%	0.24	21%	0.205	C	C	.	.	H	α-helix	trans	-69.2	-37.9	-176.5	0	0	0	0	0	112	V71 R110 M112	V71-A75 VanDerWaalsContact O-CB 3.23Å; V71-A75 WeakPolarHBondContact O-CB 3.26Å; V71-A75 PolarHBondContact O-N 3.27Å; A75-R110 WeakPolarHBondContact O-CD 3.35Å; A75-R110 PolarHBondContact O-NH1 2.77Å; A75-M112 HydrophobicContact CB-SD 4.29Å
76	K	95.3	Very high	96	Very high	151 Å²	151	40.5 Å²	40.5	66%	0.657	21%	0.207	S	C	*	.			trans	49.5	56.3	-170.8	-57.2	-179.6	-179	177.9	0	112	C72 Q73	C72-K76 WeakPolarHBondContact O-CA 3.4Å; C72-K76 PolarHBondContact O-N 3.32Å; Q73-K76 WeakPolarHBondContact O-CG 3.39Å
77	P	96.5	Very high	96.1	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.013	20%	0.198	C	C	.	.			trans	-67.7	140.8	-179	30.7	-34.6	0	0	0	110.5	I80 M112 A169	P77-I80 HydrophobicContact CB-CG2 3.86Å; P77-I80 HydrophobicContact CG-CG2 3.43Å; P77-I80 VanDerWaalsContact CG-CG2 3.43Å; P77-M112 HydrophobicContact CB-CB 3.88Å; P77-M112 HydrophobicContact CG-CB 4.39Å; P77-M112 HydrophobicContact CG-CE 4.19Å; P77-A169 WeakPolarHBondContact O-CA 3.29Å
78	Y	96	Very high	96.2	Very high	35 Å²	35	40.9 Å²	40.9	14%	0.137	22%	0.219	C	C	.	.	S	Bend	trans	-77.6	-44.2	169.7	-176	-92.8	0	0	0	110.2	L109 R110 H170 F171 L187 E198	Y78-L109 HydrophobicContact CD1-CB 4.21Å; Y78-L109 HydrophobicContact CD1-CD1 3.82Å; Y78-L109 HydrophobicContact CD1-CD2 4.26Å; Y78-L109 HydrophobicContact CD1-CG 4.33Å; Y78-L109 HydrophobicContact CD2-CD2 3.94Å; Y78-L109 HydrophobicContact CE1-CD1 3.75Å; Y78-L109 HydrophobicContact CE2-CD2 4.24Å; Y78-L109 HydrophobicContact CG-CB 4.25Å; Y78-L109 HydrophobicContact CG-CD1 4.34Å; Y78-L109 HydrophobicContact CG-CD2 3.93Å; Y78-L109 HydrophobicContact CG-CG 4.41Å; Y78-R110 PolarHBondContact N-O 3.2Å; Y78-H170 HydrophobicContact CD1-CB 4.39Å; Y78-H170 HydrophobicContact CD2-CB 3.87Å; Y78-H170 AromaticContact CD2-CD2 3.65Å; Y78-H170 AromaticContact CD2-CG 3.62Å; Y78-H170 HydrophobicContact CE1-CB 4.29Å; Y78-H170 HydrophobicContact CE2-CB 3.75Å; Y78-H170 AromaticContact CE2-CD2 3.88Å; Y78-H170 AromaticContact CE2-CG 3.46Å; Y78-H170 VanDerWaalsContact CE2-CG 3.46Å; Y78-H170 AromaticContact CE2-ND1 3.62Å; Y78-H170 HydrophobicContact CG-CB 4.21Å; Y78-H170 WeakPolarHBondContact O-CA 3.39Å; Y78-H170 WeakPolarHBondContact O-CB 3.28Å; Y78-H170 PolarHBondContact O-N 2.93Å; Y78-F171 HydrophobicContact CD1-CD2 4.24Å; Y78-F171 AromaticContact CE1-CD2 3.65Å; Y78-F171 HydrophobicContact CE1-CD2 3.65Å; Y78-F171 AromaticContact CE1-CE2 3.67Å; Y78-F171 HydrophobicContact CE1-CE2 3.67Å; Y78-F171 AromaticContact CZ-CE2 3.78Å; Y78-F171 PolarHBondContact O-N 3.15Å; Y78-F171 VanDerWaalsContact O-N 3.11Å; Y78-F171 WeakPolarHBondContact OH-CE2 3.45Å; Y78-L187 HydrophobicContact CD1-CD2 3.87Å; Y78-L187 HydrophobicContact CE1-CD2 3.83Å; Y78-E198 PolarHBondContact OH-OE1 2.61Å
79	L	97.4	Very high	96.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.8	173.8	172.2	65.2	0	0	0	109.8	R110 V111 M112 F171 A173 P183 L186 L187	L79-R110 PolarHBondContact N-O 2.79Å; L79-V111 HydrophobicContact CB-CG1 4.49Å; L79-V111 HydrophobicContact CB-CG2 4.32Å; L79-V111 HydrophobicContact CD2-CG1 4.14Å; L79-V111 HydrophobicContact CD2-CG2 4.38Å; L79-V111 HydrophobicContact CG-CG1 4.33Å; L79-V111 WeakPolarHBondContact O-CA 3.38Å; L79-M112 PolarHBondContact O-N 2.87Å; L79-F171 HydrophobicContact CD1-CB 3.75Å; L79-A173 HydrophobicContact CD1-CB 4Å; L79-P183 HydrophobicContact CD2-CB 4.35Å; L79-L186 HydrophobicContact CD1-CD2 4.43Å; L79-L186 HydrophobicContact CD2-CD2 4.07Å; L79-L187 HydrophobicContact CB-CD2 4.47Å; L79-L187 HydrophobicContact CD2-CD2 4.48Å
80	I	98.3	Very high	96.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.8	163.1	57.2	174.4	0	0	0	109	P77 I82 M112 A162 C166 A169 F171 L172 A173	P77-I80 HydrophobicContact CB-CG2 3.86Å; P77-I80 HydrophobicContact CG-CG2 3.43Å; P77-I80 VanDerWaalsContact CG-CG2 3.43Å; I80-I82 HydrophobicContact CD1-CD1 4.47Å; I80-M112 CarbonylContact C-O 3.59Å; I80-M112 WeakPolarHBondContact CA-O 3.33Å; I80-M112 HydrophobicContact CG2-CB 4.46Å; I80-M112 HydrophobicContact CG2-CE 3.73Å; I80-A162 HydrophobicContact CD1-CB 3.93Å; I80-C166 HydrophobicContact CD1-CB 3.76Å; I80-A169 HydrophobicContact CD1-CB 4.18Å; I80-A169 HydrophobicContact CG1-CB 4.05Å; I80-A169 HydrophobicContact CG2-CB 4.03Å; I80-F171 WeakPolarHBondContact CG1-O 3.3Å; I80-F171 PolarHBondContact N-O 2.9Å; I80-L172 HydrophobicContact CD1-CB 4.28Å; I80-L172 HydrophobicContact CD1-CD1 3.74Å; I80-L172 HydrophobicContact CG1-CB 4.03Å; I80-L172 HydrophobicContact CG1-CD1 3.66Å; I80-L172 HydrophobicContact CG1-CG 4.46Å; I80-L172 CarbonylContact O-C 3.47Å; I80-L172 WeakPolarHBondContact O-CA 3.22Å; I80-A173 PolarHBondContact O-N 2.96Å
81	A	98.7	Very high	96.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.5	170.5	0	0	0	0	0	107.8	W100 M112 T113 L114 A173	A81-W100 HydrophobicContact CB-CZ3 4.47Å; A81-M112 PolarHBondContact N-O 3.23Å; A81-T113 CarbonylContact O-C 3.5Å; A81-T113 VanDerWaalsContact O-CA 3.3Å; A81-T113 WeakPolarHBondContact O-CA 3.41Å; A81-L114 PolarHBondContact O-N 2.92Å; A81-A173 CarbonylContact C-O 3.56Å; A81-A173 WeakPolarHBondContact CA-O 3.42Å; A81-A173 HydrophobicContact CB-CB 4.41Å
82	I	98.8	Very high	97.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	116	173.8	-53.3	179.1	0	0	0	108.3	I80 L114 M116 M158 W161 A162 L172 A173 V175	I80-I82 HydrophobicContact CD1-CD1 4.47Å; I82-L114 CarbonylContact C-O 3.6Å; I82-L114 WeakPolarHBondContact CA-O 3.41Å; I82-L114 HydrophobicContact CG1-CB 4.42Å; I82-M116 HydrophobicContact CG2-CB 3.73Å; I82-M158 HydrophobicContact CB-CG 3.86Å; I82-M158 HydrophobicContact CB-SD 3.91Å; I82-M158 HydrophobicContact CD1-CG 3.78Å; I82-M158 HydrophobicContact CG1-CG 4.4Å; I82-M158 HydrophobicContact CG2-CG 3.69Å; I82-M158 HydrophobicContact CG2-SD 4.04Å; I82-W161 HydrophobicContact CD1-CE3 4.01Å; I82-W161 HydrophobicContact CD1-CZ3 4.34Å; I82-A162 HydrophobicContact CD1-CB 4Å; I82-L172 HydrophobicContact CB-CD1 4.21Å; I82-L172 HydrophobicContact CD1-CD1 3.67Å; I82-L172 HydrophobicContact CG1-CD1 3.68Å; I82-A173 PolarHBondContact N-O 3.33Å; I82-V175 PolarHBondContact O-N 3.08Å
83	V	98.9	Very high	97.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	118	-177.1	-173.5	0	0	0	0	109.4	S85 I96 W100 T113 L114 F115 M116 V175 D177	V83-S85 PolarHBondContact O-N 3.5Å; V83-I96 HydrophobicContact CG1-CD1 3.74Å; V83-I96 HydrophobicContact CG2-CG2 4.49Å; V83-W100 HydrophobicContact CG2-CH2 3.53Å; V83-W100 HydrophobicContact CG2-CZ2 4.46Å; V83-W100 HydrophobicContact CG2-CZ3 4.17Å; V83-T113 HydrophobicContact CG2-CG2 3.89Å; V83-L114 PolarHBondContact N-O 2.84Å; V83-F115 HydrophobicContact CB-CD1 3.6Å; V83-F115 HydrophobicContact CB-CE1 3.84Å; V83-F115 HydrophobicContact CG1-CD1 3.97Å; V83-F115 HydrophobicContact CG1-CE1 4.03Å; V83-F115 HydrophobicContact CG2-CD1 4.18Å; V83-F115 HydrophobicContact CG2-CE1 3.99Å; V83-F115 CarbonylContact O-C 3.6Å; V83-F115 WeakPolarHBondContact O-CA 3.43Å; V83-M116 PolarHBondContact O-N 2.99Å; V83-V175 CarbonylContact C-O 3.56Å; V83-V175 WeakPolarHBondContact CA-O 3.49Å; V83-D177 HydrophobicContact CG1-CB 3.84Å
84	T	98.6	Very high	97.5	Very high	6 Å²	6	36.2 Å²	36.2	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.1	171.8	43.4	0	0	0	0	109.5	M116 K154 K174 V175 D176 D177	T84-M116 HydrophobicContact CG2-CB 4.39Å; T84-K154 HydrophobicContact CG2-CD 3.88Å; T84-K154 HydrophobicContact CG2-CG 4.08Å; T84-K174 WeakPolarHBondContact OG1-CE 3.18Å; T84-K174 PolarHBondContact OG1-NZ 3.35Å; T84-V175 PolarHBondContact N-O 3.04Å; T84-V175 PolarHBondContact OG1-O 3.17Å; T84-D176 PolarHBondContact OG1-OD1 2.99Å; T84-D177 PolarHBondContact O-N 3.44Å
85	S	98.4	Very high	97.8	Very high	2 Å²	2	28 Å²	28	1%	0.014	17%	0.166	C	C	.	.			trans	-132.2	162.6	-176.4	-174	0	0	0	0	110.7	V83 R93 M116 K154 D177	V83-S85 PolarHBondContact O-N 3.5Å; S85-R93 WeakPolarHBondContact OG-CG 3.48Å; S85-R93 PolarHBondContact OG-NH1 3.24Å; S85-R93 VanDerWaalsContact OG-NH1 3.11Å; S85-M116 PolarHBondContact N-O 3.41Å; S85-K154 PolarHBondContact O-NZ 2.98Å; S85-D177 VanDerWaalsContact CA-OD2 3.25Å; S85-D177 WeakPolarHBondContact CA-OD2 3.35Å; S85-D177 VanDerWaalsContact CB-OD2 3.23Å; S85-D177 WeakPolarHBondContact CB-OD2 3.47Å; S85-D177 PolarHBondContact OG-OD2 2.86Å
86	A	97.9	Very high	98	Very high	29 Å²	29	26.6 Å²	26.6	24%	0.24	16%	0.155	C	C	.	.			trans	-95.9	149.8	171.1	0	0	0	0	0	110.8	A88 N89 R93	A86-A88 PolarHBondContact O-N 3.02Å; A86-A88 VanDerWaalsContact O-N 3.09Å; A86-N89 HydrophobicContact CB-CB 4.45Å; A86-N89 WeakPolarHBondContact O-CB 3.42Å; A86-N89 PolarHBondContact O-N 3.49Å; A86-R93 PolarHBondContact O-NH1 2.81Å
87	P	97.9	Very high	98.2	Very high	11 Å²	11	21 Å²	21	7%	0.071	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-44.4	176.4	-34.6	37.4	0	0	0	114.5	N89 R93 A120 L125 L129 D146	P87-N89 VanDerWaalsContact C-N 3.28Å; P87-N89 PolarHBondContact O-N 2.99Å; P87-R93 PolarHBondContact O-NH2 2.84Å; P87-A120 HydrophobicContact CB-CB 3.69Å; P87-A120 HydrophobicContact CG-CB 3.85Å; P87-L125 HydrophobicContact CB-CB 4.49Å; P87-L129 HydrophobicContact CB-CD1 3.57Å; P87-L129 HydrophobicContact CB-CG 4.23Å; P87-L129 HydrophobicContact CG-CD1 3.87Å; P87-D146 VanDerWaalsContact CD-CG 3.46Å; P87-D146 VanDerWaalsContact CD-OD2 3.28Å; P87-D146 WeakPolarHBondContact CD-OD2 3.46Å; P87-D146 HydrophobicContact CG-CB 3.98Å
88	A	97.5	Very high	98.3	Very high	62 Å²	62	25.5 Å²	25.5	51%	0.512	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.4	179.8	0	0	0	0	0	114.3	A86 Q90 L125	A86-A88 PolarHBondContact O-N 3.02Å; A86-A88 VanDerWaalsContact O-N 3.09Å; A88-Q90 PolarHBondContact O-N 2.85Å; A88-L125 HydrophobicContact CB-CD1 3.95Å; A88-L125 HydrophobicContact CB-CD2 4.41Å
89	N	98.2	Very high	98.4	Very high	62 Å²	62	24.1 Å²	24.1	33%	0.332	15%	0.149	S	C	.	.			trans	-83.4	39.3	-173.1	-68.9	-0	0	0	0	113.2	A86 P87 G91 A92 R93 D177	A86-N89 HydrophobicContact CB-CB 4.45Å; A86-N89 WeakPolarHBondContact O-CB 3.42Å; A86-N89 PolarHBondContact O-N 3.49Å; P87-N89 VanDerWaalsContact C-N 3.28Å; P87-N89 PolarHBondContact O-N 2.99Å; N89-G91 PolarHBondContact O-N 3.42Å; N89-A92 HydrophobicContact CB-CB 4.12Å; N89-A92 PolarHBondContact O-N 3.29Å; N89-A92 VanDerWaalsContact O-N 3.12Å; N89-R93 PolarHBondContact O-N 2.81Å; N89-R93 VanDerWaalsContact O-N 3.1Å; N89-R93 PolarHBondContact O-NH1 3.14Å; N89-D177 WeakPolarHBondContact CB-OD2 3.44Å; N89-D177 PolarHBondContact ND2-OD2 3.36Å
90	Q	97.9	Very high	98.5	Very high	85 Å²	85	24.3 Å²	24.3	40%	0.397	15%	0.149	S	C	.	.	H	α-helix	trans	-57.4	-38	177.9	-173.1	-179.5	-2.4	0	0	112	A88 A92 R93 Q94	A88-Q90 PolarHBondContact O-N 2.85Å; Q90-A92 PolarHBondContact O-N 3.28Å; Q90-R93 PolarHBondContact O-N 2.95Å; Q90-Q94 WeakPolarHBondContact O-CB 3.42Å; Q90-Q94 PolarHBondContact O-N 2.79Å
91	G	98.5	Very high	98.4	Very high	46 Å²	46	24.8 Å²	24.8	47%	0.474	16%	0.155	S	C	.	.	H	α-helix	trans	-62.6	-39.4	176.2	0	0	0	0	0	113.5	N89 Q94 A95	N89-G91 PolarHBondContact O-N 3.42Å; G91-Q94 PolarHBondContact O-N 3.44Å; G91-A95 WeakPolarHBondContact O-CB 3.43Å; G91-A95 PolarHBondContact O-N 3.38Å
92	A	98.8	Very high	98.3	Very high	10 Å²	10	26.9 Å²	26.9	8%	0.083	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-46.4	176.2	0	0	0	0	0	111.3	N89 Q90 Q94 A95 I96 D177 P313	N89-A92 HydrophobicContact CB-CB 4.12Å; N89-A92 PolarHBondContact O-N 3.29Å; N89-A92 VanDerWaalsContact O-N 3.12Å; Q90-A92 PolarHBondContact O-N 3.28Å; A92-Q94 VanDerWaalsContact C-N 3.28Å; A92-Q94 PolarHBondContact O-N 3.31Å; A92-A95 PolarHBondContact O-N 3.12Å; A92-I96 WeakPolarHBondContact O-CG1 3.3Å; A92-I96 PolarHBondContact O-N 2.61Å; A92-D177 HydrophobicContact CB-CB 4.16Å; A92-P313 HydrophobicContact CB-CG 4.03Å
93	R	98.8	Very high	98	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-42.5	174.8	-63.4	-168	-70.4	-79	5.7	112	S85 A86 P87 N89 Q90 I96 R97 F115 E132	S85-R93 WeakPolarHBondContact OG-CG 3.48Å; S85-R93 PolarHBondContact OG-NH1 3.24Å; S85-R93 VanDerWaalsContact OG-NH1 3.11Å; A86-R93 PolarHBondContact O-NH1 2.81Å; P87-R93 PolarHBondContact O-NH2 2.84Å; N89-R93 PolarHBondContact O-N 2.81Å; N89-R93 VanDerWaalsContact O-N 3.1Å; N89-R93 PolarHBondContact O-NH1 3.14Å; Q90-R93 PolarHBondContact O-N 2.95Å; R93-I96 PolarHBondContact O-N 3.14Å; R93-R97 WeakPolarHBondContact O-CG 3.46Å; R93-R97 PolarHBondContact O-N 3.35Å; R93-F115 HydrophobicContact CB-CD1 3.99Å; R93-F115 HydrophobicContact CB-CE1 3.78Å; R93-F115 HydrophobicContact CB-CE2 4.43Å; R93-F115 HydrophobicContact CB-CG 4.41Å; R93-F115 HydrophobicContact CB-CZ 4.01Å; R93-F115 HydrophobicContact CG-CD1 3.49Å; R93-F115 VanDerWaalsContact CG-CD1 3.49Å; R93-F115 HydrophobicContact CG-CE1 3.75Å; R93-F115 HydrophobicContact CG-CG 4.01Å; R93-F115 HydrophobicContact CG-CZ 4.43Å; R93-F115 WeakPolarHBondContact O-CZ 3.15Å; R93-E132 IonicContact CZ-OE1 3.3Å; R93-E132 IonicContact CZ-OE2 3.28Å; R93-E132 VanDerWaalsContact CZ-OE2 3.3Å; R93-E132 IonicContact NE-OE1 3.24Å; R93-E132 PolarHBondContact NE-OE1 3.44Å; R93-E132 IonicContact NE-OE2 3.57Å; R93-E132 PolarHBondContact NE-OE2 3.42Å; R93-E132 VanDerWaalsContact NE-OE2 3.13Å; R93-E132 IonicContact NH2-OE1 2.68Å; R93-E132 IonicContact NH2-OE2 3.42Å; R93-E132 PolarHBondContact NH2-OE2 2.96Å
94	Q	98.8	Very high	97.7	Very high	53 Å²	53	34.7 Å²	34.7	25%	0.248	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-44.3	177.8	-171.3	55.2	53.2	0	0	111.9	Q90 G91 A92 I96 R97 D98	Q90-Q94 WeakPolarHBondContact O-CB 3.42Å; Q90-Q94 PolarHBondContact O-N 2.79Å; G91-Q94 PolarHBondContact O-N 3.44Å; A92-Q94 VanDerWaalsContact C-N 3.28Å; A92-Q94 PolarHBondContact O-N 3.31Å; Q94-I96 VanDerWaalsContact C-N 3.29Å; Q94-I96 PolarHBondContact O-N 3.4Å; Q94-R97 WeakPolarHBondContact O-CB 3.29Å; Q94-R97 PolarHBondContact O-N 3.48Å; Q94-R97 VanDerWaalsContact O-N 3.15Å; Q94-D98 PolarHBondContact NE2-OD1 2.84Å; Q94-D98 PolarHBondContact NE2-OD2 3Å; Q94-D98 VanDerWaalsContact O-CG 3.27Å; Q94-D98 PolarHBondContact O-N 3.29Å
95	A	98.9	Very high	97.6	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-59.6	-39.3	174.9	0	0	0	0	0	112.4	G91 A92 D98 T99 P313 M316 L317	G91-A95 WeakPolarHBondContact O-CB 3.43Å; G91-A95 PolarHBondContact O-N 3.38Å; A92-A95 PolarHBondContact O-N 3.12Å; A95-D98 PolarHBondContact O-N 2.84Å; A95-T99 WeakPolarHBondContact O-CB 3.45Å; A95-T99 VanDerWaalsContact O-CG2 3.29Å; A95-T99 WeakPolarHBondContact O-CG2 3.4Å; A95-T99 PolarHBondContact O-N 3.41Å; A95-T99 VanDerWaalsContact O-N 3.13Å; A95-T99 PolarHBondContact O-OG1 3.37Å; A95-P313 HydrophobicContact CB-CB 3.8Å; A95-M316 HydrophobicContact CB-CB 4.49Å; A95-M316 HydrophobicContact CB-SD 4.22Å; A95-L317 HydrophobicContact CB-CD1 4.45Å; A95-L317 HydrophobicContact CB-CG 4.2Å
96	I	98.9	Very high	97.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-46.8	174.3	-70.7	171	0	0	0	110.9	V83 A92 R93 Q94 D98 T99 W100 G101 G102 T113 F115 D177 M316	V83-I96 HydrophobicContact CG1-CD1 3.74Å; V83-I96 HydrophobicContact CG2-CG2 4.49Å; A92-I96 WeakPolarHBondContact O-CG1 3.3Å; A92-I96 PolarHBondContact O-N 2.61Å; R93-I96 PolarHBondContact O-N 3.14Å; Q94-I96 VanDerWaalsContact C-N 3.29Å; Q94-I96 PolarHBondContact O-N 3.4Å; I96-D98 VanDerWaalsContact C-N 3.27Å; I96-D98 PolarHBondContact O-N 3.08Å; I96-T99 CarbonylContact O-C 3.56Å; I96-T99 PolarHBondContact O-N 2.98Å; I96-T99 VanDerWaalsContact O-N 3.14Å; I96-T99 PolarHBondContact O-OG1 2.83Å; I96-W100 HydrophobicContact CB-CZ2 4.15Å; I96-W100 HydrophobicContact CD1-CH2 4.26Å; I96-W100 HydrophobicContact CD1-CZ2 3.63Å; I96-W100 HydrophobicContact CG1-CH2 4.43Å; I96-W100 HydrophobicContact CG1-CZ2 3.59Å; I96-W100 HydrophobicContact CG2-CD2 4.06Å; I96-W100 HydrophobicContact CG2-CE3 4.13Å; I96-W100 HydrophobicContact CG2-CH2 3.63Å; I96-W100 HydrophobicContact CG2-CZ2 3.52Å; I96-W100 HydrophobicContact CG2-CZ3 3.92Å; I96-G101 WeakPolarHBondContact O-CA 3.3Å; I96-G101 PolarHBondContact O-N 3.18Å; I96-G102 PolarHBondContact O-N 3.08Å; I96-T113 HydrophobicContact CG2-CG2 4.25Å; I96-F115 HydrophobicContact CB-CE1 4.11Å; I96-F115 HydrophobicContact CB-CZ 4.02Å; I96-F115 HydrophobicContact CD1-CE1 4.09Å; I96-F115 HydrophobicContact CG2-CE1 3.94Å; I96-F115 HydrophobicContact CG2-CZ 3.73Å; I96-D177 HydrophobicContact CD1-CB 4.14Å; I96-M316 HydrophobicContact CB-SD 4.25Å; I96-M316 HydrophobicContact CD1-CE 4.32Å; I96-M316 HydrophobicContact CG1-CE 3.73Å; I96-M316 HydrophobicContact CG1-SD 3.39Å; I96-M316 WeakPolarHBondContact CG1-SD 3.37Å
97	R	98.8	Very high	97.1	Very high	33 Å²	33	44.4 Å²	44.4	13%	0.125	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-38.6	176.1	-70.4	175.2	-171.5	114.5	0.5	112.4	R93 Q94 T99 G102 F115 E132 D138	R93-R97 WeakPolarHBondContact O-CG 3.46Å; R93-R97 PolarHBondContact O-N 3.35Å; Q94-R97 WeakPolarHBondContact O-CB 3.29Å; Q94-R97 PolarHBondContact O-N 3.48Å; Q94-R97 VanDerWaalsContact O-N 3.15Å; R97-T99 PolarHBondContact O-N 2.95Å; R97-G102 WeakPolarHBondContact O-CA 3.29Å; R97-G102 PolarHBondContact O-N 2.8Å; R97-F115 HydrophobicContact CG-CE2 3.86Å; R97-F115 HydrophobicContact CG-CZ 4.03Å; R97-E132 IonicContact CZ-OE1 2.73Å; R97-E132 VanDerWaalsContact CZ-OE1 3.25Å; R97-E132 IonicContact NH1-OE1 2.81Å; R97-E132 PolarHBondContact NH1-OE1 2.85Å; R97-E132 IonicContact NH2-OE1 3.51Å; R97-E132 PolarHBondContact NH2-OE1 3.22Å; R97-D138 IonicContact CZ-OD1 3.85Å; R97-D138 IonicContact CZ-OD2 3.25Å; R97-D138 IonicContact NE-OD1 3.27Å; R97-D138 IonicContact NE-OD2 3.13Å; R97-D138 PolarHBondContact NE-OD2 2.95Å; R97-D138 IonicContact NH2-OD1 3.79Å; R97-D138 PolarHBondContact NH2-OD1 3.44Å; R97-D138 IonicContact NH2-OD2 2.89Å; R97-D138 PolarHBondContact NH2-OD2 3.11Å
98	D	98.6	Very high	97	Very high	96 Å²	96	46.6 Å²	46.6	51%	0.513	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-4.7	-178.7	-63.7	-25.5	0	0	0	113	Q94 A95 I96 L317	Q94-D98 PolarHBondContact NE2-OD1 2.84Å; Q94-D98 PolarHBondContact NE2-OD2 3Å; Q94-D98 VanDerWaalsContact O-CG 3.27Å; Q94-D98 PolarHBondContact O-N 3.29Å; A95-D98 PolarHBondContact O-N 2.84Å; I96-D98 VanDerWaalsContact C-N 3.27Å; I96-D98 PolarHBondContact O-N 3.08Å; D98-L317 HydrophobicContact CB-CD2 3.91Å
99	T	98.6	Very high	96.9	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.043	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.5	-119.5	-178.3	60.4	0	0	0	0	111.6	A95 I96 R97 G101 G102 M316 L317 W320	A95-T99 WeakPolarHBondContact O-CB 3.45Å; A95-T99 VanDerWaalsContact O-CG2 3.29Å; A95-T99 WeakPolarHBondContact O-CG2 3.4Å; A95-T99 PolarHBondContact O-N 3.41Å; A95-T99 VanDerWaalsContact O-N 3.13Å; A95-T99 PolarHBondContact O-OG1 3.37Å; I96-T99 CarbonylContact O-C 3.56Å; I96-T99 PolarHBondContact O-N 2.98Å; I96-T99 VanDerWaalsContact O-N 3.14Å; I96-T99 PolarHBondContact O-OG1 2.83Å; R97-T99 PolarHBondContact O-N 2.95Å; T99-G101 VanDerWaalsContact C-N 3.32Å; T99-G101 PolarHBondContact O-N 3.27Å; T99-G102 PolarHBondContact O-N 2.96Å; T99-M316 HydrophobicContact CG2-CG 4.29Å; T99-L317 HydrophobicContact CG2-CD2 3.81Å; T99-L317 HydrophobicContact CG2-CG 4.45Å; T99-W320 HydrophobicContact CG2-CB 3.58Å; T99-W320 HydrophobicContact CG2-CG 3.69Å
100	W	98.1	Very high	96.8	Very high	3 Å²	3	48.5 Å²	48.5	1%	0.011	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-67.4	-32.1	-173	57.6	-98.2	0	0	0	113	A81 V83 I96 G102 Q103 T113 V175 V179 F181 M316 W320	A81-W100 HydrophobicContact CB-CZ3 4.47Å; V83-W100 HydrophobicContact CG2-CH2 3.53Å; V83-W100 HydrophobicContact CG2-CZ2 4.46Å; V83-W100 HydrophobicContact CG2-CZ3 4.17Å; I96-W100 HydrophobicContact CB-CZ2 4.15Å; I96-W100 HydrophobicContact CD1-CH2 4.26Å; I96-W100 HydrophobicContact CD1-CZ2 3.63Å; I96-W100 HydrophobicContact CG1-CH2 4.43Å; I96-W100 HydrophobicContact CG1-CZ2 3.59Å; I96-W100 HydrophobicContact CG2-CD2 4.06Å; I96-W100 HydrophobicContact CG2-CE3 4.13Å; I96-W100 HydrophobicContact CG2-CH2 3.63Å; I96-W100 HydrophobicContact CG2-CZ2 3.52Å; I96-W100 HydrophobicContact CG2-CZ3 3.92Å; W100-G102 VanDerWaalsContact C-N 3.28Å; W100-G102 PolarHBondContact O-N 2.74Å; W100-Q103 PolarHBondContact O-N 3.19Å; W100-T113 HydrophobicContact CZ3-CG2 4.21Å; W100-V175 HydrophobicContact CH2-CB 4.29Å; W100-V175 HydrophobicContact CH2-CG1 3.93Å; W100-V175 HydrophobicContact CZ2-CG1 4.14Å; W100-V179 PolarHBondContact NE1-O 3.33Å; W100-F181 WeakPolarHBondContact CB-O 3.36Å; W100-F181 HydrophobicContact CD2-CB 3.85Å; W100-F181 HydrophobicContact CD2-CD1 4.48Å; W100-F181 HydrophobicContact CE3-CB 4Å; W100-F181 AromaticContact CE3-CD1 3.85Å; W100-F181 HydrophobicContact CE3-CD1 3.85Å; W100-F181 HydrophobicContact CE3-CG 4.42Å; W100-F181 HydrophobicContact CG-CB 4.38Å; W100-F181 VanDerWaalsContact CG-O 3.25Å; W100-F181 HydrophobicContact CH2-CB 4.15Å; W100-F181 HydrophobicContact CZ2-CB 4.03Å; W100-F181 HydrophobicContact CZ3-CB 4.17Å; W100-F181 AromaticContact CZ3-CD1 3.96Å; W100-F181 HydrophobicContact CZ3-CD1 3.96Å; W100-F181 HydrophobicContact CZ3-CG 4.45Å; W100-M316 PolarHBondContact NE1-SD 3.1Å; W100-M316 VanDerWaalsContact NE1-SD 3.42Å; W100-W320 HydrophobicContact CB-CE3 3.95Å; W100-W320 HydrophobicContact CB-CH2 3.54Å; W100-W320 HydrophobicContact CB-CZ2 4.12Å; W100-W320 HydrophobicContact CB-CZ3 3.45Å; W100-W320 VanDerWaalsContact CB-CZ3 3.45Å
101	G	97.9	Very high	96.8	Very high	11 Å²	11	44.8 Å²	44.8	11%	0.113	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-74.7	-18.4	-178.8	0	0	0	0	0	113.6	I96 T99 Q103 T113	I96-G101 WeakPolarHBondContact O-CA 3.3Å; I96-G101 PolarHBondContact O-N 3.18Å; T99-G101 VanDerWaalsContact C-N 3.32Å; T99-G101 PolarHBondContact O-N 3.27Å; G101-Q103 VanDerWaalsContact C-N 3.33Å; G101-T113 WeakPolarHBondContact CA-OG1 3.37Å; G101-T113 VanDerWaalsContact O-CB 3.29Å; G101-T113 WeakPolarHBondContact O-CB 3.43Å; G101-T113 PolarHBondContact O-OG1 2.79Å
102	G	96.7	Very high	96.8	Very high	44 Å²	44	43.8 Å²	43.8	45%	0.454	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-79.9	-9.3	175.4	0	0	0	0	0	114.6	I96 R97 T99 W100 V104	I96-G102 PolarHBondContact O-N 3.08Å; R97-G102 WeakPolarHBondContact O-CA 3.29Å; R97-G102 PolarHBondContact O-N 2.8Å; T99-G102 PolarHBondContact O-N 2.96Å; W100-G102 VanDerWaalsContact C-N 3.28Å; W100-G102 PolarHBondContact O-N 2.74Å; G102-V104 PolarHBondContact O-N 2.8Å
103	Q	91.6	Very high	96.8	Very high	56 Å²	56	44.2 Å²	44.2	26%	0.262	24%	0.24	S	C	.	.			trans	-74.9	113.2	178.9	-61.9	-172	-40.5	0	0	111	W100 G101 V106 P183 W320	W100-Q103 PolarHBondContact O-N 3.19Å; G101-Q103 VanDerWaalsContact C-N 3.33Å; Q103-V106 HydrophobicContact CB-CG2 3.67Å; Q103-V106 HydrophobicContact CG-CG2 4.48Å; Q103-P183 VanDerWaalsContact OE1-CG 3.28Å; Q103-W320 HydrophobicContact CG-CZ2 4.31Å
104	V	93.4	Very high	96.8	Very high	109 Å²	109	44.4 Å²	44.4	66%	0.661	24%	0.241	S	C	*	.	S	Bend	trans	-89.5	-21.3	179.4	-61.9	0	0	0	0	113.6	G102 R110 V111	G102-V104 PolarHBondContact O-N 2.8Å; V104-R110 WeakPolarHBondContact O-CA 3.5Å; V104-V111 PolarHBondContact O-N 2.81Å
105	E	95.6	Very high	96.8	Very high	123 Å²	123	41.9 Å²	41.9	58%	0.575	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140	128.2	176	-170	175.9	120.3	0	0	109.6	L109	E105-L109 WeakPolarHBondContact CA-O 3.06Å
106	V	93.5	Very high	96.7	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.042	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	119.5	-176.5	-179.7	0	0	0	0	108	Q103 G108 L109 V111 P183 L187	Q103-V106 HydrophobicContact CB-CG2 3.67Å; Q103-V106 HydrophobicContact CG-CG2 4.48Å; V106-G108 PolarHBondContact O-N 3.11Å; V106-L109 PolarHBondContact N-O 3.1Å; V106-L109 WeakPolarHBondContact O-CB 3.32Å; V106-L109 PolarHBondContact O-N 2.88Å; V106-V111 HydrophobicContact CB-CG2 3.91Å; V106-V111 HydrophobicContact CG2-CB 4.47Å; V106-V111 HydrophobicContact CG2-CG2 3.83Å; V106-P183 HydrophobicContact CG1-CB 4.4Å; V106-P183 HydrophobicContact CG1-CG 4.5Å; V106-P183 HydrophobicContact CG2-CB 4.32Å; V106-P183 HydrophobicContact CG2-CG 4.07Å; V106-L187 HydrophobicContact CB-CD1 3.89Å; V106-L187 HydrophobicContact CG1-CD1 3.93Å
107	R	93	Very high	96.7	Very high	111 Å²	111	41.8 Å²	41.8	42%	0.419	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	38.6	-176.1	-53.7	-175.8	73.9	-120.2	-1.1	113.1	L109 S184 L187 H188 N191	R107-L109 PolarHBondContact O-N 2.78Å; R107-S184 WeakPolarHBondContact CD-O 3.29Å; R107-L187 PolarHBondContact NH1-O 2.98Å; R107-H188 VanDerWaalsContact NH1-CA 3.31Å; R107-H188 PolarHBondContact NH2-ND1 3.16Å; R107-N191 PolarHBondContact NH1-ND2 3.31Å
108	G	94.1	Very high	96.6	Very high	57 Å²	57	40.2 Å²	40.2	59%	0.588	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.7	6.8	-178.6	0	0	0	0	0	114.9	V106	V106-G108 PolarHBondContact O-N 3.11Å
109	L	95.5	Very high	96.5	Very high	41 Å²	41	37.7 Å²	37.7	22%	0.215	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.9	178.8	-62.5	170.1	0	0	0	109.6	Y78 E105 V106 R107 V111 L187	Y78-L109 HydrophobicContact CD1-CB 4.21Å; Y78-L109 HydrophobicContact CD1-CD1 3.82Å; Y78-L109 HydrophobicContact CD1-CD2 4.26Å; Y78-L109 HydrophobicContact CD1-CG 4.33Å; Y78-L109 HydrophobicContact CD2-CD2 3.94Å; Y78-L109 HydrophobicContact CE1-CD1 3.75Å; Y78-L109 HydrophobicContact CE2-CD2 4.24Å; Y78-L109 HydrophobicContact CG-CB 4.25Å; Y78-L109 HydrophobicContact CG-CD1 4.34Å; Y78-L109 HydrophobicContact CG-CD2 3.93Å; Y78-L109 HydrophobicContact CG-CG 4.41Å; E105-L109 WeakPolarHBondContact CA-O 3.06Å; V106-L109 PolarHBondContact N-O 3.1Å; V106-L109 WeakPolarHBondContact O-CB 3.32Å; V106-L109 PolarHBondContact O-N 2.88Å; R107-L109 PolarHBondContact O-N 2.78Å; L109-V111 PolarHBondContact O-N 3.06Å; L109-L187 HydrophobicContact CB-CD1 4.2Å; L109-L187 HydrophobicContact CD1-CB 4.49Å; L109-L187 HydrophobicContact CD1-CD1 4.27Å; L109-L187 HydrophobicContact CD1-CD2 3.98Å; L109-L187 HydrophobicContact CD1-CG 4.48Å
110	R	96.9	Very high	96.3	Very high	122 Å²	122	38.1 Å²	38.1	46%	0.46	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	128.9	-179.5	-170.5	164.1	-72	152.1	6.1	111.2	A75 Y78 L79 V104	A75-R110 WeakPolarHBondContact O-CD 3.35Å; A75-R110 PolarHBondContact O-NH1 2.77Å; Y78-R110 PolarHBondContact N-O 3.2Å; L79-R110 PolarHBondContact N-O 2.79Å; V104-R110 WeakPolarHBondContact O-CA 3.5Å
111	V	97.6	Very high	96	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.9	177.4	-176.6	0	0	0	0	108.4	L79 V104 V106 L109 L187	L79-V111 HydrophobicContact CB-CG1 4.49Å; L79-V111 HydrophobicContact CB-CG2 4.32Å; L79-V111 HydrophobicContact CD2-CG1 4.14Å; L79-V111 HydrophobicContact CD2-CG2 4.38Å; L79-V111 HydrophobicContact CG-CG1 4.33Å; L79-V111 WeakPolarHBondContact O-CA 3.38Å; V104-V111 PolarHBondContact O-N 2.81Å; V106-V111 HydrophobicContact CB-CG2 3.91Å; V106-V111 HydrophobicContact CG2-CB 4.47Å; V106-V111 HydrophobicContact CG2-CG2 3.83Å; L109-V111 PolarHBondContact O-N 3.06Å; V111-L187 HydrophobicContact CG2-CD1 4.01Å
112	M	98	Very high	95.7	Very high	26 Å²	26	46.1 Å²	46.1	13%	0.128	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.6	175.6	-173.9	-179.7	71.4	0	0	109.7	V71 C72 A75 P77 L79 I80 A81 L114	V71-M112 HydrophobicContact CG2-SD 3.88Å; C72-M112 WeakPolarHBondContact SG-CE 3.49Å; A75-M112 HydrophobicContact CB-SD 4.29Å; P77-M112 HydrophobicContact CB-CB 3.88Å; P77-M112 HydrophobicContact CG-CB 4.39Å; P77-M112 HydrophobicContact CG-CE 4.19Å; L79-M112 PolarHBondContact O-N 2.87Å; I80-M112 CarbonylContact C-O 3.59Å; I80-M112 WeakPolarHBondContact CA-O 3.33Å; I80-M112 HydrophobicContact CG2-CB 4.46Å; I80-M112 HydrophobicContact CG2-CE 3.73Å; A81-M112 PolarHBondContact N-O 3.23Å; M112-L114 HydrophobicContact CE-CD1 3.62Å; M112-L114 HydrophobicContact CE-CG 4.07Å
113	T	98.6	Very high	95.5	Very high	19 Å²	19	48.8 Å²	48.8	12%	0.117	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	133.4	178.1	-50.4	0	0	0	0	109.7	A81 V83 I96 W100 G101 F115	A81-T113 CarbonylContact O-C 3.5Å; A81-T113 VanDerWaalsContact O-CA 3.3Å; A81-T113 WeakPolarHBondContact O-CA 3.41Å; V83-T113 HydrophobicContact CG2-CG2 3.89Å; I96-T113 HydrophobicContact CG2-CG2 4.25Å; W100-T113 HydrophobicContact CZ3-CG2 4.21Å; G101-T113 WeakPolarHBondContact CA-OG1 3.37Å; G101-T113 VanDerWaalsContact O-CB 3.29Å; G101-T113 WeakPolarHBondContact O-CB 3.43Å; G101-T113 PolarHBondContact O-OG1 2.79Å; T113-F115 HydrophobicContact CG2-CZ 4.34Å
114	L	98.7	Very high	95.7	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	158	175.7	-62.9	174	0	0	0	109.4	P67 A81 I82 V83 M112 D138 I140 W161	P67-L114 HydrophobicContact CG-CD2 3.88Å; A81-L114 PolarHBondContact O-N 2.92Å; I82-L114 CarbonylContact C-O 3.6Å; I82-L114 WeakPolarHBondContact CA-O 3.41Å; I82-L114 HydrophobicContact CG1-CB 4.42Å; V83-L114 PolarHBondContact N-O 2.84Å; M112-L114 HydrophobicContact CE-CD1 3.62Å; M112-L114 HydrophobicContact CE-CG 4.07Å; L114-D138 CarbonylContact C-O 3.58Å; L114-D138 WeakPolarHBondContact CA-O 3.04Å; L114-D138 HydrophobicContact CD2-CB 4.11Å; L114-I140 HydrophobicContact CB-CD1 4.17Å; L114-I140 HydrophobicContact CD1-CD1 3.97Å; L114-W161 HydrophobicContact CD1-CE3 4.39Å; L114-W161 HydrophobicContact CD1-CH2 3.24Å; L114-W161 HydrophobicContact CD1-CZ2 4.1Å; L114-W161 HydrophobicContact CD1-CZ3 3.4Å; L114-W161 VanDerWaalsContact CD1-CZ3 3.4Å
115	F	98.8	Very high	95.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.8	-178.7	-64.4	-82.6	0	0	0	111	V83 R93 I96 R97 T113 D138 L139 I140	V83-F115 HydrophobicContact CB-CD1 3.6Å; V83-F115 HydrophobicContact CB-CE1 3.84Å; V83-F115 HydrophobicContact CG1-CD1 3.97Å; V83-F115 HydrophobicContact CG1-CE1 4.03Å; V83-F115 HydrophobicContact CG2-CD1 4.18Å; V83-F115 HydrophobicContact CG2-CE1 3.99Å; V83-F115 CarbonylContact O-C 3.6Å; V83-F115 WeakPolarHBondContact O-CA 3.43Å; R93-F115 HydrophobicContact CB-CD1 3.99Å; R93-F115 HydrophobicContact CB-CE1 3.78Å; R93-F115 HydrophobicContact CB-CE2 4.43Å; R93-F115 HydrophobicContact CB-CG 4.41Å; R93-F115 HydrophobicContact CB-CZ 4.01Å; R93-F115 HydrophobicContact CG-CD1 3.49Å; R93-F115 VanDerWaalsContact CG-CD1 3.49Å; R93-F115 HydrophobicContact CG-CE1 3.75Å; R93-F115 HydrophobicContact CG-CG 4.01Å; R93-F115 HydrophobicContact CG-CZ 4.43Å; R93-F115 WeakPolarHBondContact O-CZ 3.15Å; I96-F115 HydrophobicContact CB-CE1 4.11Å; I96-F115 HydrophobicContact CB-CZ 4.02Å; I96-F115 HydrophobicContact CD1-CE1 4.09Å; I96-F115 HydrophobicContact CG2-CE1 3.94Å; I96-F115 HydrophobicContact CG2-CZ 3.73Å; R97-F115 HydrophobicContact CG-CE2 3.86Å; R97-F115 HydrophobicContact CG-CZ 4.03Å; T113-F115 HydrophobicContact CG2-CZ 4.34Å; F115-D138 HydrophobicContact CD2-CB 4.41Å; F115-D138 WeakPolarHBondContact CE2-OD2 3.41Å; F115-D138 PolarHBondContact N-O 3.01Å; F115-L139 HydrophobicContact CB-CD2 3.64Å; F115-I140 PolarHBondContact O-N 3.42Å
116	M	98.5	Very high	95.7	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120.1	176.6	-173.5	69.7	-169.1	0	0	110.7	F63 I82 V83 T84 S85 I140 F144 K154 A157 M158	F63-M116 HydrophobicContact CE1-CE 4.44Å; I82-M116 HydrophobicContact CG2-CB 3.73Å; V83-M116 PolarHBondContact O-N 2.99Å; T84-M116 HydrophobicContact CG2-CB 4.39Å; S85-M116 PolarHBondContact N-O 3.41Å; M116-I140 WeakPolarHBondContact CA-O 3.37Å; M116-I140 HydrophobicContact CE-CG2 4.39Å; M116-I140 HydrophobicContact SD-CB 3.81Å; M116-I140 HydrophobicContact SD-CG2 3.52Å; M116-I140 VanDerWaalsContact SD-CG2 3.52Å; M116-F144 HydrophobicContact CE-CE1 3.83Å; M116-F144 HydrophobicContact CE-CZ 3.94Å; M116-K154 HydrophobicContact CG-CD 4.48Å; M116-K154 HydrophobicContact CG-CG 3.71Å; M116-A157 HydrophobicContact CE-CB 3.24Å; M116-M158 HydrophobicContact CG-CB 4.17Å; M116-M158 HydrophobicContact SD-CB 4.49Å
117	V	98.3	Very high	95.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163.3	177.7	-59.5	0	0	0	0	111	L129 L139 I140 Q141 G142	V117-L129 HydrophobicContact CG2-CD1 4.32Å; V117-L129 HydrophobicContact CG2-CD2 4.42Å; V117-L139 HydrophobicContact CG1-CD2 4.13Å; V117-L139 HydrophobicContact CG2-CD2 4.21Å; V117-I140 PolarHBondContact N-O 3.49Å; V117-Q141 HydrophobicContact CG2-CB 3.92Å; V117-Q141 HydrophobicContact CG2-CG 4.05Å; V117-Q141 VanDerWaalsContact O-CA 3.31Å; V117-Q141 WeakPolarHBondContact O-CA 3.26Å; V117-G142 PolarHBondContact O-N 3.34Å
118	G	96.9	Very high	96	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-167.1	168.7	0	0	0	0	0	112.9	Q141 F144 D146	G118-Q141 PolarHBondContact O-NE2 3.32Å; G118-F144 VanDerWaalsContact CA-CE2 3.41Å; G118-D146 WeakPolarHBondContact CA-OD2 3.47Å; G118-D146 PolarHBondContact N-OD2 2.81Å
119	V	96.1	Very high	96.1	Very high	44 Å²	44	43.8 Å²	43.8	27%	0.267	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	126.8	172.3	-179.5	0	0	0	0	109	L64 F144 D146	L64-V119 HydrophobicContact CD1-CG2 3.56Å; V119-F144 WeakPolarHBondContact CB-O 3.39Å; V119-F144 PolarHBondContact N-O 3.32Å; V119-D146 WeakPolarHBondContact O-CB 3.46Å; V119-D146 PolarHBondContact O-N 2.85Å
120	A	94.6	Very high	96.2	Very high	15 Å²	15	45 Å²	45	12%	0.124	25%	0.253	C	S	.	.			trans	-69.3	141.7	173	0	0	0	0	0	110.8	P87 D122 L125	P87-A120 HydrophobicContact CB-CB 3.69Å; P87-A120 HydrophobicContact CG-CB 3.85Å; A120-D122 VanDerWaalsContact C-N 3.32Å; A120-L125 HydrophobicContact CB-CB 3.8Å
121	S	91.1	Very high	96.3	Very high	104 Å²	104	43.4 Å²	43.4	73%	0.727	25%	0.251	S	S	*	.	S	Bend	trans	-67.9	-34.1	170.1	49.6	0	0	0	0	112.1
122	D	92.8	Very high	96.3	Very high	78 Å²	78	43.2 Å²	43.2	42%	0.417	25%	0.249	S	C	.	.	S	Bend	trans	-88.9	120.5	175.9	174.8	18.2	0	0	0	111.4	A120 G124 L125 G126	A120-D122 VanDerWaalsContact C-N 3.32Å; D122-G124 PolarHBondContact O-N 2.83Å; D122-G124 PolarHBondContact OD1-N 3.27Å; D122-L125 HydrophobicContact CB-CB 4.32Å; D122-L125 HydrophobicContact CB-CD1 4.12Å; D122-L125 HydrophobicContact CB-CG 4.11Å; D122-L125 PolarHBondContact O-N 3.25Å; D122-L125 PolarHBondContact OD2-N 3.42Å; D122-G126 PolarHBondContact O-N 3.36Å; D122-G126 VanDerWaalsContact O-N 3.15Å
123	P	92	Very high	96.3	Very high	101 Å²	101	42.9 Å²	42.9	66%	0.656	25%	0.251	S	S	*	.	H	α-helix	trans	-57.3	-29.1	173.7	-24.5	34.5	0	0	0	114.3	G126 K127	P123-G126 PolarHBondContact O-N 3.48Å; P123-K127 PolarHBondContact O-N 3.16Å; P123-K127 VanDerWaalsContact O-N 3.16Å
124	G	95.3	Very high	96.2	Very high	34 Å²	34	51 Å²	51	35%	0.351	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-50.5	175.6	0	0	0	0	0	111.8	D122 G126 K127 L128	D122-G124 PolarHBondContact O-N 2.83Å; D122-G124 PolarHBondContact OD1-N 3.27Å; G124-G126 VanDerWaalsContact C-N 3.26Å; G124-G126 PolarHBondContact O-N 3.12Å; G124-K127 PolarHBondContact O-N 2.83Å; G124-L128 PolarHBondContact O-N 2.69Å
125	L	94.7	Very high	96.1	Very high	48 Å²	48	56.3 Å²	56.3	25%	0.251	30%	0.304	S	S	.	.	H	α-helix	trans	-58.8	-37.2	172.3	-68.7	179.3	0	0	0	112.4	P87 A88 A120 D122 K127 L128 L129	P87-L125 HydrophobicContact CB-CB 4.49Å; A88-L125 HydrophobicContact CB-CD1 3.95Å; A88-L125 HydrophobicContact CB-CD2 4.41Å; A120-L125 HydrophobicContact CB-CB 3.8Å; D122-L125 HydrophobicContact CB-CB 4.32Å; D122-L125 HydrophobicContact CB-CD1 4.12Å; D122-L125 HydrophobicContact CB-CG 4.11Å; D122-L125 PolarHBondContact O-N 3.25Å; D122-L125 PolarHBondContact OD2-N 3.42Å; L125-K127 VanDerWaalsContact C-N 3.33Å; L125-K127 PolarHBondContact O-N 2.83Å; L125-L128 HydrophobicContact CD2-CD1 4.42Å; L125-L128 PolarHBondContact O-N 3.41Å; L125-L129 PolarHBondContact O-N 3.24Å
126	G	95	Very high	96.1	Very high	20 Å²	20	60.6 Å²	60.6	21%	0.206	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-42.4	175.3	0	0	0	0	0	113.2	D122 P123 G124 L129 I130	D122-G126 PolarHBondContact O-N 3.36Å; D122-G126 VanDerWaalsContact O-N 3.15Å; P123-G126 PolarHBondContact O-N 3.48Å; G124-G126 VanDerWaalsContact C-N 3.26Å; G124-G126 PolarHBondContact O-N 3.12Å; G126-L129 PolarHBondContact O-N 3.37Å; G126-I130 WeakPolarHBondContact O-CG1 3.34Å; G126-I130 PolarHBondContact O-N 3.4Å; G126-I130 VanDerWaalsContact O-N 3.15Å
127	K	95.9	Very high	96	Very high	160 Å²	160	62.6 Å²	62.6	70%	0.696	34%	0.344	S	S	*	.	H	α-helix	trans	-66.4	-41.5	176.3	-68.4	178.2	-177.7	177.1	0	112.2	P123 G124 L125 L129 I130 Q131	P123-K127 PolarHBondContact O-N 3.16Å; P123-K127 VanDerWaalsContact O-N 3.16Å; G124-K127 PolarHBondContact O-N 2.83Å; L125-K127 VanDerWaalsContact C-N 3.33Å; L125-K127 PolarHBondContact O-N 2.83Å; K127-L129 VanDerWaalsContact C-N 3.34Å; K127-I130 PolarHBondContact O-N 2.84Å; K127-Q131 PolarHBondContact O-N 3.37Å; K127-Q131 VanDerWaalsContact O-N 3.1Å
128	L	96.9	Very high	95.9	Very high	94 Å²	94	63.6 Å²	63.6	49%	0.492	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-40.9	176.9	-66.5	175.7	0	0	0	111.6	G124 L125 I130 Q131 E132	G124-L128 PolarHBondContact O-N 2.69Å; L125-L128 HydrophobicContact CD2-CD1 4.42Å; L125-L128 PolarHBondContact O-N 3.41Å; L128-I130 PolarHBondContact O-N 2.93Å; L128-Q131 PolarHBondContact O-N 3.14Å; L128-E132 WeakPolarHBondContact O-CB 3.49Å; L128-E132 PolarHBondContact O-N 2.7Å
129	L	96.8	Very high	96	Very high	2 Å²	2	63.8 Å²	63.8	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-61.7	-41.9	174.6	-83.1	-179.3	0	0	0	113	P87 V117 L125 G126 K127 Q131 E132 A133 L139	P87-L129 HydrophobicContact CB-CD1 3.57Å; P87-L129 HydrophobicContact CB-CG 4.23Å; P87-L129 HydrophobicContact CG-CD1 3.87Å; V117-L129 HydrophobicContact CG2-CD1 4.32Å; V117-L129 HydrophobicContact CG2-CD2 4.42Å; L125-L129 PolarHBondContact O-N 3.24Å; G126-L129 PolarHBondContact O-N 3.37Å; K127-L129 VanDerWaalsContact C-N 3.34Å; L129-Q131 VanDerWaalsContact C-N 3.28Å; L129-Q131 PolarHBondContact O-N 3.13Å; L129-E132 PolarHBondContact O-N 3.32Å; L129-A133 VanDerWaalsContact O-CB 3.31Å; L129-A133 WeakPolarHBondContact O-CB 3.27Å; L129-A133 PolarHBondContact O-N 3.29Å; L129-L139 HydrophobicContact CD2-CD1 4.12Å
130	I	97	Very high	96.1	Very high	67 Å²	67	61.7 Å²	61.7	34%	0.344	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-41.2	176.7	-68.9	165.8	0	0	0	110.4	L65 G126 K127 L128 A133 R134	L65-I130 HydrophobicContact CD1-CG1 4.18Å; L65-I130 HydrophobicContact CD2-CG1 4.45Å; G126-I130 WeakPolarHBondContact O-CG1 3.34Å; G126-I130 PolarHBondContact O-N 3.4Å; G126-I130 VanDerWaalsContact O-N 3.15Å; K127-I130 PolarHBondContact O-N 2.84Å; L128-I130 PolarHBondContact O-N 2.93Å; I130-A133 PolarHBondContact O-N 3.21Å; I130-R134 WeakPolarHBondContact O-CG 3.13Å; I130-R134 PolarHBondContact O-N 3.38Å; I130-R134 VanDerWaalsContact O-N 3.14Å
131	Q	97.7	Very high	96.2	Very high	87 Å²	87	61.6 Å²	61.6	41%	0.407	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-48.1	177.2	-174.4	60.9	22	0	0	111.4	K127 L128 L129 A133 R134 E135	K127-Q131 PolarHBondContact O-N 3.37Å; K127-Q131 VanDerWaalsContact O-N 3.1Å; L128-Q131 PolarHBondContact O-N 3.14Å; L129-Q131 VanDerWaalsContact C-N 3.28Å; L129-Q131 PolarHBondContact O-N 3.13Å; Q131-A133 VanDerWaalsContact C-N 3.29Å; Q131-A133 PolarHBondContact O-N 3.3Å; Q131-R134 WeakPolarHBondContact O-CB 3.42Å; Q131-R134 PolarHBondContact O-N 2.86Å; Q131-R134 VanDerWaalsContact O-N 3.16Å; Q131-E135 WeakPolarHBondContact CG-OE1 3.41Å; Q131-E135 PolarHBondContact NE2-OE1 3.11Å; Q131-E135 WeakPolarHBondContact O-CG 3.49Å; Q131-E135 PolarHBondContact O-N 3.19Å
132	E	98.2	Very high	96.5	Very high	3 Å²	3	56.7 Å²	56.7	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-42.8	175.7	-175.5	-176.4	-178.6	0	0	111.5	R93 R97 L128 L129 R134 E135 K136 L139	R93-E132 IonicContact CZ-OE1 3.3Å; R93-E132 IonicContact CZ-OE2 3.28Å; R93-E132 VanDerWaalsContact CZ-OE2 3.3Å; R93-E132 IonicContact NE-OE1 3.24Å; R93-E132 PolarHBondContact NE-OE1 3.44Å; R93-E132 IonicContact NE-OE2 3.57Å; R93-E132 PolarHBondContact NE-OE2 3.42Å; R93-E132 VanDerWaalsContact NE-OE2 3.13Å; R93-E132 IonicContact NH2-OE1 2.68Å; R93-E132 IonicContact NH2-OE2 3.42Å; R93-E132 PolarHBondContact NH2-OE2 2.96Å; R97-E132 IonicContact CZ-OE1 2.73Å; R97-E132 VanDerWaalsContact CZ-OE1 3.25Å; R97-E132 IonicContact NH1-OE1 2.81Å; R97-E132 PolarHBondContact NH1-OE1 2.85Å; R97-E132 IonicContact NH2-OE1 3.51Å; R97-E132 PolarHBondContact NH2-OE1 3.22Å; L128-E132 WeakPolarHBondContact O-CB 3.49Å; L128-E132 PolarHBondContact O-N 2.7Å; L129-E132 PolarHBondContact O-N 3.32Å; E132-R134 VanDerWaalsContact C-N 3.31Å; E132-R134 PolarHBondContact O-N 3.17Å; E132-E135 PolarHBondContact O-N 3.07Å; E132-K136 HydrophobicContact CG-CG 3.96Å; E132-K136 WeakPolarHBondContact O-CB 3.47Å; E132-K136 WeakPolarHBondContact O-CG 3.07Å; E132-K136 PolarHBondContact O-N 3.3Å; E132-L139 HydrophobicContact CB-CD1 3.93Å; E132-L139 HydrophobicContact CG-CD1 3.76Å
133	A	97.5	Very high	96.5	Very high	19 Å²	19	57.2 Å²	57.2	16%	0.157	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-36.9	179.8	0	0	0	0	0	112.3	L65 L129 I130 Q131 G137 L139	L65-A133 HydrophobicContact CB-CB 4.39Å; L65-A133 HydrophobicContact CD1-CB 3.84Å; L65-A133 HydrophobicContact CD2-CB 4.49Å; L65-A133 HydrophobicContact CG-CB 4.48Å; L129-A133 VanDerWaalsContact O-CB 3.31Å; L129-A133 WeakPolarHBondContact O-CB 3.27Å; L129-A133 PolarHBondContact O-N 3.29Å; I130-A133 PolarHBondContact O-N 3.21Å; Q131-A133 VanDerWaalsContact C-N 3.29Å; Q131-A133 PolarHBondContact O-N 3.3Å; A133-G137 WeakPolarHBondContact O-CA 3.45Å; A133-G137 PolarHBondContact O-N 2.94Å; A133-L139 HydrophobicContact CB-CB 4.08Å; A133-L139 HydrophobicContact CB-CD1 3.87Å
134	R	97.1	Very high	96.5	Very high	189 Å²	189	52.9 Å²	52.9	71%	0.713	27%	0.267	S	S	*	.	H	α-helix	trans	-68	-39.7	174.6	-71.9	171.7	-176.4	172.9	0.4	112.1	I130 Q131 E132	I130-R134 WeakPolarHBondContact O-CG 3.13Å; I130-R134 PolarHBondContact O-N 3.38Å; I130-R134 VanDerWaalsContact O-N 3.14Å; Q131-R134 WeakPolarHBondContact O-CB 3.42Å; Q131-R134 PolarHBondContact O-N 2.86Å; Q131-R134 VanDerWaalsContact O-N 3.16Å; E132-R134 VanDerWaalsContact C-N 3.31Å; E132-R134 PolarHBondContact O-N 3.17Å
135	E	97.4	Very high	96.5	Very high	117 Å²	117	54.4 Å²	54.4	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-77.5	-41.6	-176.6	-71.7	175.4	-174.1	0	0	113.1	Q131 E132	Q131-E135 WeakPolarHBondContact CG-OE1 3.41Å; Q131-E135 PolarHBondContact NE2-OE1 3.11Å; Q131-E135 WeakPolarHBondContact O-CG 3.49Å; Q131-E135 PolarHBondContact O-N 3.19Å; E132-E135 PolarHBondContact O-N 3.07Å
136	K	97.4	Very high	96.6	Very high	89 Å²	89	53.5 Å²	53.5	39%	0.387	26%	0.262	S	S	.	.	H	α-helix	trans	-100.2	-29.8	-170.5	-54.4	-59.4	-172.9	176.2	0	113.1	E132 D138	E132-K136 HydrophobicContact CG-CG 3.96Å; E132-K136 WeakPolarHBondContact O-CB 3.47Å; E132-K136 WeakPolarHBondContact O-CG 3.07Å; E132-K136 PolarHBondContact O-N 3.3Å; K136-D138 VanDerWaalsContact CB-OD1 3.31Å; K136-D138 WeakPolarHBondContact CB-OD1 3.34Å; K136-D138 PolarHBondContact O-N 3.15Å
137	G	96.4	Very high	96.6	Very high	43 Å²	43	54.1 Å²	54.1	44%	0.443	26%	0.263	S	S	.	.			trans	65.1	17.3	176.4	0	0	0	0	0	115.2	P67 A133	P67-G137 WeakPolarHBondContact CB-O 3.47Å; P67-G137 WeakPolarHBondContact CG-O 3.31Å; A133-G137 WeakPolarHBondContact O-CA 3.45Å; A133-G137 PolarHBondContact O-N 2.94Å
138	D	97.9	Very high	96.3	Very high	22 Å²	22	52.1 Å²	52.1	12%	0.118	25%	0.252	C	S	.	.			trans	-119.5	3.6	-173	61.9	4.4	0	0	0	114	R97 L114 F115 K136	R97-D138 IonicContact CZ-OD1 3.85Å; R97-D138 IonicContact CZ-OD2 3.25Å; R97-D138 IonicContact NE-OD1 3.27Å; R97-D138 IonicContact NE-OD2 3.13Å; R97-D138 PolarHBondContact NE-OD2 2.95Å; R97-D138 IonicContact NH2-OD1 3.79Å; R97-D138 PolarHBondContact NH2-OD1 3.44Å; R97-D138 IonicContact NH2-OD2 2.89Å; R97-D138 PolarHBondContact NH2-OD2 3.11Å; L114-D138 CarbonylContact C-O 3.58Å; L114-D138 WeakPolarHBondContact CA-O 3.04Å; L114-D138 HydrophobicContact CD2-CB 4.11Å; F115-D138 HydrophobicContact CD2-CB 4.41Å; F115-D138 WeakPolarHBondContact CE2-OD2 3.41Å; F115-D138 PolarHBondContact N-O 3.01Å; K136-D138 VanDerWaalsContact CB-OD1 3.31Å; K136-D138 WeakPolarHBondContact CB-OD1 3.34Å; K136-D138 PolarHBondContact O-N 3.15Å
139	L	98.3	Very high	96.1	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.016	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133.1	179.4	-79.5	170.4	0	0	0	112.4	M66 P67 F115 V117 L129 E132 A133	M66-L139 VanDerWaalsContact CA-O 3.26Å; M66-L139 WeakPolarHBondContact CA-O 3.29Å; P67-L139 WeakPolarHBondContact CD-O 3.27Å; F115-L139 HydrophobicContact CB-CD2 3.64Å; V117-L139 HydrophobicContact CG1-CD2 4.13Å; V117-L139 HydrophobicContact CG2-CD2 4.21Å; L129-L139 HydrophobicContact CD2-CD1 4.12Å; E132-L139 HydrophobicContact CB-CD1 3.93Å; E132-L139 HydrophobicContact CG-CD1 3.76Å; A133-L139 HydrophobicContact CB-CB 4.08Å; A133-L139 HydrophobicContact CB-CD1 3.87Å
140	I	98.2	Very high	96	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	118.2	165.6	-55.2	159.9	0	0	0	107.2	F63 L65 L114 F115 M116 V117 W161	F63-I140 HydrophobicContact CD1-CG2 3.55Å; F63-I140 HydrophobicContact CE1-CG2 3.8Å; F63-I140 HydrophobicContact CG-CG2 4.41Å; L65-I140 CarbonylContact O-C 3.34Å; L65-I140 WeakPolarHBondContact O-CA 3.26Å; L114-I140 HydrophobicContact CB-CD1 4.17Å; L114-I140 HydrophobicContact CD1-CD1 3.97Å; F115-I140 PolarHBondContact O-N 3.42Å; M116-I140 WeakPolarHBondContact CA-O 3.37Å; M116-I140 HydrophobicContact CE-CG2 4.39Å; M116-I140 HydrophobicContact SD-CB 3.81Å; M116-I140 HydrophobicContact SD-CG2 3.52Å; M116-I140 VanDerWaalsContact SD-CG2 3.52Å; V117-I140 PolarHBondContact N-O 3.49Å; I140-W161 HydrophobicContact CD1-CD2 3.39Å; I140-W161 HydrophobicContact CD1-CE3 3.59Å; I140-W161 HydrophobicContact CD1-CG 3.85Å; I140-W161 HydrophobicContact CD1-CH2 4.16Å; I140-W161 HydrophobicContact CD1-CZ2 3.96Å; I140-W161 HydrophobicContact CD1-CZ3 3.97Å; I140-W161 HydrophobicContact CG1-CD2 4.15Å; I140-W161 HydrophobicContact CG1-CG 4.42Å; I140-W161 HydrophobicContact CG1-CZ2 4.26Å; I140-W161 HydrophobicContact CG2-CG 4.06Å
141	Q	97.6	Very high	95.9	Very high	13 Å²	13	52 Å²	52	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.5	177.6	-175.3	176.1	39.9	0	0	110.4	F63 L64 L65 V117 G118	F63-Q141 CarbonylContact C-O 3.5Å; F63-Q141 VanDerWaalsContact CA-O 3.29Å; F63-Q141 WeakPolarHBondContact CA-O 3.19Å; L64-Q141 HydrophobicContact CB-CB 4.33Å; L64-Q141 HydrophobicContact CB-CG 4.16Å; L64-Q141 HydrophobicContact CD1-CG 4.32Å; L64-Q141 PolarHBondContact N-O 2.87Å; L65-Q141 HydrophobicContact CB-CB 3.83Å; L65-Q141 HydrophobicContact CD1-CB 4.31Å; L65-Q141 VanDerWaalsContact CD1-OE1 3.22Å; L65-Q141 HydrophobicContact CG-CB 4.21Å; L65-Q141 PolarHBondContact O-N 3.21Å; V117-Q141 HydrophobicContact CG2-CB 3.92Å; V117-Q141 HydrophobicContact CG2-CG 4.05Å; V117-Q141 VanDerWaalsContact O-CA 3.31Å; V117-Q141 WeakPolarHBondContact O-CA 3.26Å; G118-Q141 PolarHBondContact O-NE2 3.32Å
142	G	95.5	Very high	95.8	Very high	1 Å²	1	48 Å²	48	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	155.2	172.2	0	0	0	0	0	112.7	V117 F144	V117-G142 PolarHBondContact O-N 3.34Å; G142-F144 VanDerWaalsContact C-N 3.27Å; G142-F144 PolarHBondContact O-N 3.45Å; G142-F144 VanDerWaalsContact O-N 3.08Å
143	R	93.6	Very high	95.7	Very high	89 Å²	89	48.3 Å²	48.3	34%	0.336	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	59.7	178	-167.2	-177	-70.7	135.6	6	112.9	E61 E62 L64	E61-R143 PolarHBondContact O-NH1 2.53Å; E61-R143 PolarHBondContact O-NH2 3.37Å; E62-R143 WeakPolarHBondContact O-CB 3.41Å; E62-R143 PolarHBondContact O-N 2.87Å; L64-R143 HydrophobicContact CD2-CG 4.44Å; L64-R143 HydrophobicContact CG-CB 4.36Å
144	F	92.8	Very high	95.6	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.048	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.4	171.5	53.5	-94.6	0	0	0	109	M116 G118 V119 G142 D146 L153 K154 A157	M116-F144 HydrophobicContact CE-CE1 3.83Å; M116-F144 HydrophobicContact CE-CZ 3.94Å; G118-F144 VanDerWaalsContact CA-CE2 3.41Å; V119-F144 WeakPolarHBondContact CB-O 3.39Å; V119-F144 PolarHBondContact N-O 3.32Å; G142-F144 VanDerWaalsContact C-N 3.27Å; G142-F144 PolarHBondContact O-N 3.45Å; G142-F144 VanDerWaalsContact O-N 3.08Å; F144-D146 PolarHBondContact O-N 2.83Å; F144-L153 HydrophobicContact CB-CB 4.18Å; F144-L153 HydrophobicContact CB-CD1 3.99Å; F144-L153 HydrophobicContact CD1-CB 4.19Å; F144-L153 HydrophobicContact CD2-CB 4.41Å; F144-L153 HydrophobicContact CG-CB 3.98Å; F144-K154 HydrophobicContact CE1-CB 4.41Å; F144-K154 HydrophobicContact CE2-CB 3.67Å; F144-K154 HydrophobicContact CE2-CG 4.12Å; F144-K154 HydrophobicContact CZ-CB 3.54Å; F144-K154 HydrophobicContact CZ-CG 3.77Å; F144-A157 HydrophobicContact CD1-CB 4.48Å; F144-A157 HydrophobicContact CE1-CB 3.78Å
145	L	95.4	Very high	95.6	Very high	66 Å²	66	38.8 Å²	38.8	35%	0.346	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	127.7	173.6	-179.9	67.6	0	0	0	109.5	P52 S147 N150	P52-L145 HydrophobicContact CG-CB 4.08Å; L145-S147 PolarHBondContact O-N 3.47Å; L145-N150 WeakPolarHBondContact O-CB 3.36Å; L145-N150 PolarHBondContact O-ND2 3.15Å
146	D	95.8	Very high	95.6	Very high	28 Å²	28	33.5 Å²	33.5	15%	0.15	18%	0.178	C	C	.	.			trans	-76.4	104.6	178.7	-152.6	-45.8	0	0	0	110.5	P87 G118 V119 F144 K154	P87-D146 VanDerWaalsContact CD-CG 3.46Å; P87-D146 VanDerWaalsContact CD-OD2 3.28Å; P87-D146 WeakPolarHBondContact CD-OD2 3.46Å; P87-D146 HydrophobicContact CG-CB 3.98Å; G118-D146 WeakPolarHBondContact CA-OD2 3.47Å; G118-D146 PolarHBondContact N-OD2 2.81Å; V119-D146 WeakPolarHBondContact O-CB 3.46Å; V119-D146 PolarHBondContact O-N 2.85Å; F144-D146 PolarHBondContact O-N 2.83Å; D146-K154 WeakPolarHBondContact OD1-CE 3.25Å; D146-K154 IonicContact OD1-NZ 3.9Å; D146-K154 PolarHBondContact OD1-NZ 3.34Å; D146-K154 WeakPolarHBondContact OD2-CE 3.44Å; D146-K154 IonicContact OD2-NZ 2.73Å; D146-K154 PolarHBondContact OD2-NZ 3.45Å
147	S	94.6	Very high	95.5	Very high	33 Å²	33	29.3 Å²	29.3	23%	0.231	16%	0.16	C	C	.	.			trans	-146	159.8	176.7	67.4	0	0	0	0	109.7	L145 S149 N150 L151	L145-S147 PolarHBondContact O-N 3.47Å; S147-S149 VanDerWaalsContact C-N 3.26Å; S147-S149 PolarHBondContact O-N 3.03Å; S147-S149 PolarHBondContact OG-OG 2.92Å; S147-N150 PolarHBondContact O-N 2.89Å; S147-N150 WeakPolarHBondContact OG-CB 3.39Å; S147-N150 PolarHBondContact OG-N 3.46Å; S147-N150 PolarHBondContact OG-ND2 3.49Å; S147-L151 PolarHBondContact O-N 3.45Å
148	Y	91.3	Very high	95.6	Very high	118 Å²	118	27.2 Å²	27.2	46%	0.463	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-57.8	-40.7	175.2	-173.5	-94.6	0	0	0	112.1	N150 L151 K220 H221	Y148-N150 PolarHBondContact O-N 3.03Å; Y148-L151 HydrophobicContact CD2-CD1 3.6Å; Y148-L151 HydrophobicContact CE2-CD1 3.65Å; Y148-L151 HydrophobicContact CG-CD1 4.24Å; Y148-L151 VanDerWaalsContact O-CG 3.27Å; Y148-L151 WeakPolarHBondContact O-CG 3.34Å; Y148-L151 PolarHBondContact O-N 2.92Å; Y148-K220 HydrophobicContact CE1-CB 4Å; Y148-K220 HydrophobicContact CE1-CD 4.27Å; Y148-K220 HydrophobicContact CE1-CG 4.33Å; Y148-K220 WeakPolarHBondContact CE1-O 3.42Å; Y148-H221 PolarHBondContact OH-CD2 2.96Å; Y148-H221 VanDerWaalsContact OH-CD2 3.26Å; Y148-H221 PolarHBondContact OH-NE2 3.41Å; Y148-H221 VanDerWaalsContact OH-NE2 3.1Å
149	S	90.9	Very high	95.5	Very high	81 Å²	81	26.3 Å²	26.3	57%	0.566	13%	0.133	S	C	*	.	G	3₁₀ helix	trans	-63	-20.6	176.3	52.9	0	0	0	0	114.1	S147	S147-S149 VanDerWaalsContact C-N 3.26Å; S147-S149 PolarHBondContact O-N 3.03Å; S147-S149 PolarHBondContact OG-OG 2.92Å
150	N	94.9	Very high	95.4	Very high	35 Å²	35	26.8 Å²	26.8	19%	0.187	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-104.5	11.9	-178.4	-71	-17.7	0	0	0	113.2	L145 S147 Y148 T152 L153 K154	L145-N150 WeakPolarHBondContact O-CB 3.36Å; L145-N150 PolarHBondContact O-ND2 3.15Å; S147-N150 PolarHBondContact O-N 2.89Å; S147-N150 WeakPolarHBondContact OG-CB 3.39Å; S147-N150 PolarHBondContact OG-N 3.46Å; S147-N150 PolarHBondContact OG-ND2 3.49Å; Y148-N150 PolarHBondContact O-N 3.03Å; N150-T152 PolarHBondContact O-N 2.02Å; N150-L153 HydrophobicContact CB-CD1 4.24Å; N150-L153 WeakPolarHBondContact O-CB 3.42Å; N150-L153 PolarHBondContact O-N 2.76Å; N150-K154 PolarHBondContact O-N 3.43Å; N150-K154 VanDerWaalsContact O-N 3.1Å
151	L	95.3	Very high	95.3	Very high	45 Å²	45	26.8 Å²	26.8	24%	0.236	14%	0.139	C	C	.	.	H	α-helix	trans	-55.4	-34.7	176.5	-72.5	174.3	0	0	0	112.3	S147 Y148 L153 K154 T155 E268	S147-L151 PolarHBondContact O-N 3.45Å; Y148-L151 HydrophobicContact CD2-CD1 3.6Å; Y148-L151 HydrophobicContact CE2-CD1 3.65Å; Y148-L151 HydrophobicContact CG-CD1 4.24Å; Y148-L151 VanDerWaalsContact O-CG 3.27Å; Y148-L151 WeakPolarHBondContact O-CG 3.34Å; Y148-L151 PolarHBondContact O-N 2.92Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L151-L153 PolarHBondContact O-N 3.06Å; L151-K154 HydrophobicContact CD2-CD 4.4Å; L151-K154 WeakPolarHBondContact O-CA 3.44Å; L151-K154 WeakPolarHBondContact O-CB 3.46Å; L151-K154 PolarHBondContact O-N 3.31Å; L151-K154 VanDerWaalsContact O-N 3.09Å; L151-T155 PolarHBondContact O-N 3.16Å; L151-E268 HydrophobicContact CB-CB 3.89Å; L151-E268 HydrophobicContact CB-CG 4.46Å
152	T	95.7	Very high	95.3	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-39.7	175	-61.9	0	0	0	0	112.5	N150 K154 T155 L156 L265 P266 E268 F271	N150-T152 PolarHBondContact O-N 2.02Å; T152-K154 VanDerWaalsContact C-N 3.35Å; T152-T155 PolarHBondContact O-N 3.13Å; T152-L156 HydrophobicContact CG2-CD1 4.14Å; T152-L156 WeakPolarHBondContact O-CB 3.37Å; T152-L156 WeakPolarHBondContact O-CD1 2.91Å; T152-L156 VanDerWaalsContact O-CG 3.31Å; T152-L156 WeakPolarHBondContact O-CG 3.4Å; T152-L156 PolarHBondContact O-N 2.88Å; T152-L265 HydrophobicContact CG2-CD2 4.36Å; T152-P266 PolarHBondContact OG1-O 2.87Å; T152-E268 WeakPolarHBondContact OG1-CA 3.23Å; T152-F271 HydrophobicContact CG2-CB 3.87Å; T152-F271 HydrophobicContact CG2-CD1 3.56Å; T152-F271 HydrophobicContact CG2-CD2 3.83Å; T152-F271 HydrophobicContact CG2-CE1 4.01Å; T152-F271 HydrophobicContact CG2-CE2 4.26Å; T152-F271 HydrophobicContact CG2-CG 3.45Å; T152-F271 VanDerWaalsContact CG2-CG 3.45Å; T152-F271 HydrophobicContact CG2-CZ 4.34Å
153	L	95.9	Very high	95.3	Very high	11 Å²	11	30 Å²	30	6%	0.058	15%	0.15	C	C	.	.	H	α-helix	trans	-66.4	-38.5	173.5	-60.3	179.4	0	0	0	111.4	F144 N150 L151 L156 A157 L261 L265	F144-L153 HydrophobicContact CB-CB 4.18Å; F144-L153 HydrophobicContact CB-CD1 3.99Å; F144-L153 HydrophobicContact CD1-CB 4.19Å; F144-L153 HydrophobicContact CD2-CB 4.41Å; F144-L153 HydrophobicContact CG-CB 3.98Å; N150-L153 HydrophobicContact CB-CD1 4.24Å; N150-L153 WeakPolarHBondContact O-CB 3.42Å; N150-L153 PolarHBondContact O-N 2.76Å; L151-L153 VanDerWaalsContact C-N 3.34Å; L151-L153 PolarHBondContact O-N 3.06Å; L153-L156 HydrophobicContact CD2-CD1 4.32Å; L153-L156 PolarHBondContact O-N 2.97Å; L153-A157 VanDerWaalsContact O-CB 3.3Å; L153-A157 WeakPolarHBondContact O-CB 3.43Å; L153-A157 PolarHBondContact O-N 2.62Å; L153-L261 HydrophobicContact CD2-CD1 3.88Å; L153-L265 HydrophobicContact CD1-CD1 4.31Å; L153-L265 HydrophobicContact CD2-CD1 4.2Å; L153-L265 HydrophobicContact CG-CD1 3.8Å
154	K	96.9	Very high	95.3	Very high	5 Å²	5	31 Å²	31	2%	0.022	15%	0.154	C	C	.	.	H	α-helix	trans	-60.6	-45.4	175.4	-173.6	178	-63.8	-177.2	0	111.7	T84 S85 M116 F144 D146 N150 L151 T152 A157 M158	T84-K154 HydrophobicContact CG2-CD 3.88Å; T84-K154 HydrophobicContact CG2-CG 4.08Å; S85-K154 PolarHBondContact O-NZ 2.98Å; M116-K154 HydrophobicContact CG-CD 4.48Å; M116-K154 HydrophobicContact CG-CG 3.71Å; F144-K154 HydrophobicContact CE1-CB 4.41Å; F144-K154 HydrophobicContact CE2-CB 3.67Å; F144-K154 HydrophobicContact CE2-CG 4.12Å; F144-K154 HydrophobicContact CZ-CB 3.54Å; F144-K154 HydrophobicContact CZ-CG 3.77Å; D146-K154 WeakPolarHBondContact OD1-CE 3.25Å; D146-K154 IonicContact OD1-NZ 3.9Å; D146-K154 PolarHBondContact OD1-NZ 3.34Å; D146-K154 WeakPolarHBondContact OD2-CE 3.44Å; D146-K154 IonicContact OD2-NZ 2.73Å; D146-K154 PolarHBondContact OD2-NZ 3.45Å; N150-K154 PolarHBondContact O-N 3.43Å; N150-K154 VanDerWaalsContact O-N 3.1Å; L151-K154 HydrophobicContact CD2-CD 4.4Å; L151-K154 WeakPolarHBondContact O-CA 3.44Å; L151-K154 WeakPolarHBondContact O-CB 3.46Å; L151-K154 PolarHBondContact O-N 3.31Å; L151-K154 VanDerWaalsContact O-N 3.09Å; T152-K154 VanDerWaalsContact C-N 3.35Å; K154-A157 PolarHBondContact O-N 3.37Å; K154-M158 PolarHBondContact O-N 2.67Å
155	T	96.4	Very high	95.5	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-68.7	-42.3	176.6	-76.9	0	0	0	0	112.7	L151 T152 A157 M158 L159 E268 V272	L151-T155 PolarHBondContact O-N 3.16Å; T152-T155 PolarHBondContact O-N 3.13Å; T155-A157 PolarHBondContact O-N 2.65Å; T155-M158 HydrophobicContact CG2-CE 4.09Å; T155-M158 WeakPolarHBondContact O-CB 3.39Å; T155-M158 PolarHBondContact O-N 2.84Å; T155-M158 VanDerWaalsContact O-N 3.16Å; T155-L159 HydrophobicContact CG2-CD1 3.83Å; T155-L159 HydrophobicContact CG2-CG 4.06Å; T155-L159 WeakPolarHBondContact O-CB 3.23Å; T155-L159 WeakPolarHBondContact O-CG 3.33Å; T155-L159 PolarHBondContact O-N 3.28Å; T155-E268 VanDerWaalsContact CB-CG 3.49Å; T155-E268 VanDerWaalsContact CB-OE1 3.29Å; T155-E268 WeakPolarHBondContact CB-OE1 3.31Å; T155-E268 HydrophobicContact CG2-CG 4.09Å; T155-E268 WeakPolarHBondContact CG2-OE1 3.35Å; T155-E268 WeakPolarHBondContact OG1-CG 3.25Å; T155-E268 PolarHBondContact OG1-OE1 3.49Å; T155-V272 HydrophobicContact CG2-CG2 3.59Å
156	L	96.1	Very high	95.5	Very high	7 Å²	7	28.5 Å²	28.5	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-54.1	-43.4	173.6	-80.9	162.5	0	0	0	111.2	P56 T152 L153 G160 A256 L261 F271	P56-L156 HydrophobicContact CB-CB 4.47Å; P56-L156 HydrophobicContact CB-CD1 4.26Å; P56-L156 HydrophobicContact CB-CD2 4.28Å; T152-L156 HydrophobicContact CG2-CD1 4.14Å; T152-L156 WeakPolarHBondContact O-CB 3.37Å; T152-L156 WeakPolarHBondContact O-CD1 2.91Å; T152-L156 VanDerWaalsContact O-CG 3.31Å; T152-L156 WeakPolarHBondContact O-CG 3.4Å; T152-L156 PolarHBondContact O-N 2.88Å; L153-L156 HydrophobicContact CD2-CD1 4.32Å; L153-L156 PolarHBondContact O-N 2.97Å; L156-G160 PolarHBondContact O-N 2.88Å; L156-A256 HydrophobicContact CD2-CB 3.59Å; L156-L261 HydrophobicContact CD1-CD1 4.32Å; L156-L261 HydrophobicContact CD1-CD2 3.85Å; L156-F271 HydrophobicContact CD1-CE1 4.06Å; L156-F271 HydrophobicContact CD1-CZ 4.07Å; L156-F271 HydrophobicContact CD2-CE1 3.65Å; L156-F271 HydrophobicContact CD2-CZ 3.88Å; L156-F271 HydrophobicContact CG-CE1 3.78Å; L156-F271 HydrophobicContact CG-CZ 4.2Å
157	A	96.4	Very high	95.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.8	-40.3	178	0	0	0	0	0	113.6	P57 F63 M116 F144 L153 K154 T155 W161	P57-A157 HydrophobicContact CG-CB 3.45Å; P57-A157 VanDerWaalsContact CG-CB 3.45Å; F63-A157 HydrophobicContact CE1-CB 4.31Å; M116-A157 HydrophobicContact CE-CB 3.24Å; F144-A157 HydrophobicContact CD1-CB 4.48Å; F144-A157 HydrophobicContact CE1-CB 3.78Å; L153-A157 VanDerWaalsContact O-CB 3.3Å; L153-A157 WeakPolarHBondContact O-CB 3.43Å; L153-A157 PolarHBondContact O-N 2.62Å; K154-A157 PolarHBondContact O-N 3.37Å; T155-A157 PolarHBondContact O-N 2.65Å; A157-W161 VanDerWaalsContact O-CB 3.29Å; A157-W161 WeakPolarHBondContact O-CB 3.34Å; A157-W161 PolarHBondContact O-N 3.38Å
158	M	97.7	Very high	95.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-50.7	171.2	176.3	-166.7	68.8	0	0	112.1	I82 M116 K154 T155 W161 A162 K174	I82-M158 HydrophobicContact CB-CG 3.86Å; I82-M158 HydrophobicContact CB-SD 3.91Å; I82-M158 HydrophobicContact CD1-CG 3.78Å; I82-M158 HydrophobicContact CG1-CG 4.4Å; I82-M158 HydrophobicContact CG2-CG 3.69Å; I82-M158 HydrophobicContact CG2-SD 4.04Å; M116-M158 HydrophobicContact CG-CB 4.17Å; M116-M158 HydrophobicContact SD-CB 4.49Å; K154-M158 PolarHBondContact O-N 2.67Å; T155-M158 HydrophobicContact CG2-CE 4.09Å; T155-M158 WeakPolarHBondContact O-CB 3.39Å; T155-M158 PolarHBondContact O-N 2.84Å; T155-M158 VanDerWaalsContact O-N 3.16Å; M158-W161 PolarHBondContact O-N 2.71Å; M158-A162 WeakPolarHBondContact O-CB 3.34Å; M158-A162 PolarHBondContact O-N 2.79Å; M158-K174 HydrophobicContact CE-CB 3.85Å; M158-K174 HydrophobicContact CE-CG 3.68Å; M158-K174 HydrophobicContact SD-CB 3.93Å; M158-K174 HydrophobicContact SD-CG 3.62Å
159	L	97.5	Very high	95.5	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-43.6	-179.4	-68.1	176.3	0	0	0	111.2	T155 A162 R163 L172 F244 L249 V252 A253 A256	T155-L159 HydrophobicContact CG2-CD1 3.83Å; T155-L159 HydrophobicContact CG2-CG 4.06Å; T155-L159 WeakPolarHBondContact O-CB 3.23Å; T155-L159 WeakPolarHBondContact O-CG 3.33Å; T155-L159 PolarHBondContact O-N 3.28Å; L159-A162 PolarHBondContact O-N 2.89Å; L159-R163 VanDerWaalsContact O-CB 3.27Å; L159-R163 WeakPolarHBondContact O-CB 3.38Å; L159-R163 PolarHBondContact O-N 3.24Å; L159-L172 HydrophobicContact CD2-CD2 4.03Å; L159-F244 HydrophobicContact CD2-CD2 4.25Å; L159-F244 HydrophobicContact CD2-CE2 4.01Å; L159-L249 HydrophobicContact CD2-CD1 3.61Å; L159-V252 HydrophobicContact CD1-CG1 4.37Å; L159-A253 HydrophobicContact CB-CB 4.06Å; L159-A256 HydrophobicContact CD1-CB 4.43Å
160	G	95.4	Very high	95.7	Very high	13 Å²	13	26.4 Å²	26.4	13%	0.134	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-45.1	175.2	0	0	0	0	0	112.3	L156 R164	L156-G160 PolarHBondContact O-N 2.88Å; G160-R164 VanDerWaalsContact O-CB 3.22Å; G160-R164 WeakPolarHBondContact O-CB 3.45Å; G160-R164 PolarHBondContact O-N 3.26Å; G160-R164 VanDerWaalsContact O-N 3.12Å
161	W	96.8	Very high	95.8	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-62.6	-51.3	176.8	-169.8	97.2	0	0	0	111.5	F63 M66 V71 I82 L114 I140 A157 M158 R163 R164 F165 C166	F63-W161 HydrophobicContact CE1-CB 3.99Å; F63-W161 AromaticContact CE1-CD1 3.9Å; F63-W161 HydrophobicContact CE1-CG 4.34Å; F63-W161 HydrophobicContact CE2-CB 4.34Å; F63-W161 AromaticContact CE2-CD1 3.85Å; F63-W161 HydrophobicContact CZ-CB 3.61Å; F63-W161 AromaticContact CZ-CD1 3.75Å; F63-W161 HydrophobicContact CZ-CG 4.11Å; M66-W161 HydrophobicContact CE-CZ2 4.49Å; M66-W161 VanDerWaalsContact CE-NE1 3.34Å; V71-W161 HydrophobicContact CG1-CH2 3.9Å; V71-W161 HydrophobicContact CG1-CZ2 4.09Å; I82-W161 HydrophobicContact CD1-CE3 4.01Å; I82-W161 HydrophobicContact CD1-CZ3 4.34Å; L114-W161 HydrophobicContact CD1-CE3 4.39Å; L114-W161 HydrophobicContact CD1-CH2 3.24Å; L114-W161 HydrophobicContact CD1-CZ2 4.1Å; L114-W161 HydrophobicContact CD1-CZ3 3.4Å; L114-W161 VanDerWaalsContact CD1-CZ3 3.4Å; I140-W161 HydrophobicContact CD1-CD2 3.39Å; I140-W161 HydrophobicContact CD1-CE3 3.59Å; I140-W161 HydrophobicContact CD1-CG 3.85Å; I140-W161 HydrophobicContact CD1-CH2 4.16Å; I140-W161 HydrophobicContact CD1-CZ2 3.96Å; I140-W161 HydrophobicContact CD1-CZ3 3.97Å; I140-W161 HydrophobicContact CG1-CD2 4.15Å; I140-W161 HydrophobicContact CG1-CG 4.42Å; I140-W161 HydrophobicContact CG1-CZ2 4.26Å; I140-W161 HydrophobicContact CG2-CG 4.06Å; A157-W161 VanDerWaalsContact O-CB 3.29Å; A157-W161 WeakPolarHBondContact O-CB 3.34Å; A157-W161 PolarHBondContact O-N 3.38Å; M158-W161 PolarHBondContact O-N 2.71Å; W161-R163 PolarHBondContact O-N 3.29Å; W161-R164 PolarHBondContact O-N 2.73Å; W161-R164 VanDerWaalsContact O-N 3.15Å; W161-F165 HydrophobicContact CB-CD2 4.45Å; W161-F165 AromaticContact CD1-CD2 3.45Å; W161-F165 VanDerWaalsContact CD1-CD2 3.45Å; W161-F165 AromaticContact CD1-CE2 3.67Å; W161-F165 HydrophobicContact CD2-CB 4.33Å; W161-F165 AromaticContact CD2-CD2 3.9Å; W161-F165 HydrophobicContact CD2-CD2 3.9Å; W161-F165 AromaticContact CE2-CD2 3.73Å; W161-F165 AromaticContact CG-CD2 3.71Å; W161-F165 HydrophobicContact CG-CD2 3.71Å; W161-F165 HydrophobicContact CG-CE2 4.26Å; W161-F165 HydrophobicContact CH2-CB 4.27Å; W161-F165 HydrophobicContact CZ2-CB 4.04Å; W161-F165 HydrophobicContact CZ2-CD2 4.47Å; W161-F165 HydrophobicContact CZ2-CG 4.49Å; W161-F165 AromaticContact NE1-CD2 3.46Å; W161-F165 AromaticContact NE1-CE2 3.86Å; W161-F165 WeakPolarHBondContact O-CD2 3.5Å; W161-F165 PolarHBondContact O-N 3.18Å; W161-C166 VanDerWaalsContact CH2-SG 3.55Å; W161-C166 WeakPolarHBondContact CZ3-SG 3.49Å
162	A	97.1	Very high	96	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-47.1	-178	0	0	0	0	0	111.8	I80 I82 M158 L159 R164 C166 L172 L249	I80-A162 HydrophobicContact CD1-CB 3.93Å; I82-A162 HydrophobicContact CD1-CB 4Å; M158-A162 WeakPolarHBondContact O-CB 3.34Å; M158-A162 PolarHBondContact O-N 2.79Å; L159-A162 PolarHBondContact O-N 2.89Å; A162-R164 VanDerWaalsContact C-N 3.26Å; A162-R164 PolarHBondContact O-N 3.28Å; A162-C166 CarbonylContact O-C 3.55Å; A162-C166 VanDerWaalsContact O-C 3.31Å; A162-C166 WeakPolarHBondContact O-CA 3.43Å; A162-C166 WeakPolarHBondContact O-CB 3.11Å; A162-C166 PolarHBondContact O-N 3.27Å; A162-L172 HydrophobicContact CB-CD1 4.25Å; A162-L172 HydrophobicContact CB-CD2 3.9Å; A162-L249 HydrophobicContact CB-CD2 4.06Å
163	R	95.5	Very high	96.1	Very high	82 Å²	82	22.8 Å²	22.8	31%	0.309	11%	0.109	S	C	.	.	H	α-helix	trans	-59.1	-38.2	176.6	-178.2	-178.3	63.1	86.2	-2.9	111.9	L159 W161 L250 A253	L159-R163 VanDerWaalsContact O-CB 3.27Å; L159-R163 WeakPolarHBondContact O-CB 3.38Å; L159-R163 PolarHBondContact O-N 3.24Å; W161-R163 PolarHBondContact O-N 3.29Å; R163-L250 HydrophobicContact CG-CD1 4.08Å; R163-A253 HydrophobicContact CB-CB 4.28Å
164	R	93.9	Very high	96.2	Very high	110 Å²	110	22.5 Å²	22.5	42%	0.415	11%	0.108	S	C	.	.	H	α-helix	trans	-81.3	-49.1	-174.3	-178.3	174.9	-172.9	134.5	13.2	113.2	S58 P60 G160 W161 A162	S58-R164 PolarHBondContact O-NH1 2.94Å; P60-R164 VanDerWaalsContact CD-CZ 3.45Å; P60-R164 VanDerWaalsContact CD-NH1 3.34Å; P60-R164 VanDerWaalsContact CD-NH2 3.31Å; P60-R164 VanDerWaalsContact CG-CZ 3.43Å; G160-R164 VanDerWaalsContact O-CB 3.22Å; G160-R164 WeakPolarHBondContact O-CB 3.45Å; G160-R164 PolarHBondContact O-N 3.26Å; G160-R164 VanDerWaalsContact O-N 3.12Å; W161-R164 PolarHBondContact O-N 2.73Å; W161-R164 VanDerWaalsContact O-N 3.15Å; A162-R164 VanDerWaalsContact C-N 3.26Å; A162-R164 PolarHBondContact O-N 3.28Å
165	F	95.6	Very high	96.3	Very high	23 Å²	23	22.3 Å²	22.3	10%	0.101	11%	0.107	C	C	.	.	H	α-helix	trans	-100	-17.5	-168.6	-61.5	-71	0	0	0	113.1	F63 M66 P69 C72 W161	F63-F165 HydrophobicContact CD2-CE2 4.34Å; F63-F165 HydrophobicContact CE2-CE2 4.06Å; M66-F165 HydrophobicContact CE-CD1 4.01Å; M66-F165 HydrophobicContact CE-CD2 3.87Å; M66-F165 HydrophobicContact CE-CE1 3.76Å; M66-F165 HydrophobicContact CE-CE2 3.59Å; M66-F165 HydrophobicContact CE-CG 4.06Å; M66-F165 HydrophobicContact CE-CZ 3.53Å; M66-F165 HydrophobicContact SD-CE2 4.1Å; M66-F165 HydrophobicContact SD-CZ 4.01Å; P69-F165 HydrophobicContact CB-CD1 3.99Å; P69-F165 HydrophobicContact CB-CE1 3.87Å; P69-F165 HydrophobicContact CG-CE1 4.47Å; C72-F165 VanDerWaalsContact CB-O 3.24Å; C72-F165 WeakPolarHBondContact CB-O 3.18Å; W161-F165 HydrophobicContact CB-CD2 4.45Å; W161-F165 AromaticContact CD1-CD2 3.45Å; W161-F165 VanDerWaalsContact CD1-CD2 3.45Å; W161-F165 AromaticContact CD1-CE2 3.67Å; W161-F165 HydrophobicContact CD2-CB 4.33Å; W161-F165 AromaticContact CD2-CD2 3.9Å; W161-F165 HydrophobicContact CD2-CD2 3.9Å; W161-F165 AromaticContact CE2-CD2 3.73Å; W161-F165 AromaticContact CG-CD2 3.71Å; W161-F165 HydrophobicContact CG-CD2 3.71Å; W161-F165 HydrophobicContact CG-CE2 4.26Å; W161-F165 HydrophobicContact CH2-CB 4.27Å; W161-F165 HydrophobicContact CZ2-CB 4.04Å; W161-F165 HydrophobicContact CZ2-CD2 4.47Å; W161-F165 HydrophobicContact CZ2-CG 4.49Å; W161-F165 AromaticContact NE1-CD2 3.46Å; W161-F165 AromaticContact NE1-CE2 3.86Å; W161-F165 WeakPolarHBondContact O-CD2 3.5Å; W161-F165 PolarHBondContact O-N 3.18Å
166	C	96.3	Very high	96.4	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.007	11%	0.114	C	C	.	.			trans	-128.6	43.5	179.6	-57.8	0	0	0	0	114.2	C72 I80 W161 A162 Q168 A169	C72-C166 HydrophobicContact CB-CB 3.73Å; C72-C166 WeakPolarHBondContact CB-SG 3.39Å; C72-C166 WeakPolarHBondContact SG-CB 3.21Å; C72-C166 CovalentContact SG-SG 2.02Å; C72-C166 PolarHBondContact SG-SG 3.41Å; I80-C166 HydrophobicContact CD1-CB 3.76Å; W161-C166 VanDerWaalsContact CH2-SG 3.55Å; W161-C166 WeakPolarHBondContact CZ3-SG 3.49Å; A162-C166 CarbonylContact O-C 3.55Å; A162-C166 VanDerWaalsContact O-C 3.31Å; A162-C166 WeakPolarHBondContact O-CA 3.43Å; A162-C166 WeakPolarHBondContact O-CB 3.11Å; A162-C166 PolarHBondContact O-N 3.27Å; C166-Q168 PolarHBondContact O-N 2.95Å; C166-A169 PolarHBondContact O-N 3.23Å; C166-A169 VanDerWaalsContact O-N 3.1Å
167	P	94.6	Very high	96.5	Very high	75 Å²	75	24.4 Å²	24.4	49%	0.487	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17	-177.3	28.6	-37.6	0	0	0	114.3	R246	P167-R246 WeakPolarHBondContact O-CD 3.41Å; P167-R246 PolarHBondContact O-NE 3.17Å
168	Q	92.3	Very high	96.6	Very high	59 Å²	59	26.7 Å²	26.7	28%	0.276	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.4	179.4	74.8	-82.3	34.6	0	0	114.4	C72 Q73 C166 R246	C72-Q168 PolarHBondContact O-NE2 3.35Å; Q73-Q168 VanDerWaalsContact CA-NE2 3.31Å; Q73-Q168 VanDerWaalsContact N-NE2 3.13Å; C166-Q168 PolarHBondContact O-N 2.95Å; Q168-R246 PolarHBondContact O-NH2 2.92Å
169	A	95.4	Very high	96.7	Very high	5 Å²	5	26.7 Å²	26.7	4%	0.041	13%	0.13	C	C	.	.			trans	-64.5	142.1	173.6	0	0	0	0	0	109.5	P77 I80 C166 R246	P77-A169 WeakPolarHBondContact O-CA 3.29Å; I80-A169 HydrophobicContact CD1-CB 4.18Å; I80-A169 HydrophobicContact CG1-CB 4.05Å; I80-A169 HydrophobicContact CG2-CB 4.03Å; C166-A169 PolarHBondContact O-N 3.23Å; C166-A169 VanDerWaalsContact O-N 3.1Å; A169-R246 PolarHBondContact O-NE 2.94Å; A169-R246 PolarHBondContact O-NH2 3.33Å
170	H	94.5	Very high	96.7	Very high	78 Å²	78	26.7 Å²	26.7	36%	0.361	13%	0.13	S	C	.	.	S	Bend	trans	-76.8	-36.6	176.8	-79.1	-112.2	0	0	0	111.1	Y78 R246	Y78-H170 HydrophobicContact CD1-CB 4.39Å; Y78-H170 HydrophobicContact CD2-CB 3.87Å; Y78-H170 AromaticContact CD2-CD2 3.65Å; Y78-H170 AromaticContact CD2-CG 3.62Å; Y78-H170 HydrophobicContact CE1-CB 4.29Å; Y78-H170 HydrophobicContact CE2-CB 3.75Å; Y78-H170 AromaticContact CE2-CD2 3.88Å; Y78-H170 AromaticContact CE2-CG 3.46Å; Y78-H170 VanDerWaalsContact CE2-CG 3.46Å; Y78-H170 AromaticContact CE2-ND1 3.62Å; Y78-H170 HydrophobicContact CG-CB 4.21Å; Y78-H170 WeakPolarHBondContact O-CA 3.39Å; Y78-H170 WeakPolarHBondContact O-CB 3.28Å; Y78-H170 PolarHBondContact O-N 2.93Å; H170-R246 PolarHBondContact CD2-NH2 3.43Å; H170-R246 PolarHBondContact NE2-NH2 3.02Å; H170-R246 PolarHBondContact O-N 2.97Å
171	F	96.9	Very high	96.8	Very high	5 Å²	5	26.1 Å²	26.1	2%	0.022	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144.8	-179.3	-61.2	-78.3	0	0	0	112	Y78 L79 I80 L190 E198 L202 V243 F244	Y78-F171 HydrophobicContact CD1-CD2 4.24Å; Y78-F171 AromaticContact CE1-CD2 3.65Å; Y78-F171 HydrophobicContact CE1-CD2 3.65Å; Y78-F171 AromaticContact CE1-CE2 3.67Å; Y78-F171 HydrophobicContact CE1-CE2 3.67Å; Y78-F171 AromaticContact CZ-CE2 3.78Å; Y78-F171 PolarHBondContact O-N 3.15Å; Y78-F171 VanDerWaalsContact O-N 3.11Å; Y78-F171 WeakPolarHBondContact OH-CE2 3.45Å; L79-F171 HydrophobicContact CD1-CB 3.75Å; I80-F171 WeakPolarHBondContact CG1-O 3.3Å; I80-F171 PolarHBondContact N-O 2.9Å; F171-L190 HydrophobicContact CD1-CD1 4.12Å; F171-L190 HydrophobicContact CD2-CD1 3.92Å; F171-L190 HydrophobicContact CE1-CD1 4.15Å; F171-L190 HydrophobicContact CE1-CD2 4.14Å; F171-L190 HydrophobicContact CE2-CD1 3.94Å; F171-L190 HydrophobicContact CG-CD1 4.01Å; F171-L190 HydrophobicContact CZ-CD1 4.06Å; F171-L190 HydrophobicContact CZ-CD2 4.27Å; F171-E198 HydrophobicContact CZ-CG 4.27Å; F171-L202 HydrophobicContact CD1-CD2 4.43Å; F171-L202 HydrophobicContact CE1-CD2 3.92Å; F171-V243 HydrophobicContact CB-CG1 4.05Å; F171-V243 HydrophobicContact CD1-CG1 4.05Å; F171-V243 HydrophobicContact CG-CG1 4.39Å; F171-F244 VanDerWaalsContact CA-O 3.26Å; F171-F244 WeakPolarHBondContact CA-O 3.39Å
172	L	98.3	Very high	96.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	123.2	163.8	167.6	68.8	0	0	0	108.3	I80 I82 L159 A162 V243 F244 L249	I80-L172 HydrophobicContact CD1-CB 4.28Å; I80-L172 HydrophobicContact CD1-CD1 3.74Å; I80-L172 HydrophobicContact CG1-CB 4.03Å; I80-L172 HydrophobicContact CG1-CD1 3.66Å; I80-L172 HydrophobicContact CG1-CG 4.46Å; I80-L172 CarbonylContact O-C 3.47Å; I80-L172 WeakPolarHBondContact O-CA 3.22Å; I82-L172 HydrophobicContact CB-CD1 4.21Å; I82-L172 HydrophobicContact CD1-CD1 3.67Å; I82-L172 HydrophobicContact CG1-CD1 3.68Å; L159-L172 HydrophobicContact CD2-CD2 4.03Å; A162-L172 HydrophobicContact CB-CD1 4.25Å; A162-L172 HydrophobicContact CB-CD2 3.9Å; L172-V243 CarbonylContact O-C 3.51Å; L172-V243 VanDerWaalsContact O-CA 3.26Å; L172-V243 WeakPolarHBondContact O-CA 3.41Å; L172-F244 HydrophobicContact CD2-CD2 4.46Å; L172-F244 PolarHBondContact N-O 3.1Å; L172-F244 PolarHBondContact O-N 3.09Å; L172-L249 HydrophobicContact CB-CD2 4.05Å; L172-L249 HydrophobicContact CD2-CD1 3.58Å; L172-L249 HydrophobicContact CD2-CD2 4.06Å; L172-L249 HydrophobicContact CD2-CG 4.41Å
173	A	98.6	Very high	96.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.8	163.9	0	0	0	0	0	109.3	L79 I80 A81 I82 V175 F181 Y242 V243	L79-A173 HydrophobicContact CD1-CB 4Å; I80-A173 PolarHBondContact O-N 2.96Å; A81-A173 CarbonylContact C-O 3.56Å; A81-A173 WeakPolarHBondContact CA-O 3.42Å; A81-A173 HydrophobicContact CB-CB 4.41Å; I82-A173 PolarHBondContact N-O 3.33Å; A173-V175 HydrophobicContact CB-CG2 4.18Å; A173-F181 HydrophobicContact CB-CE2 4.47Å; A173-F181 HydrophobicContact CB-CZ 3.9Å; A173-Y242 CarbonylContact C-O 3.53Å; A173-Y242 WeakPolarHBondContact CA-O 3.46Å; A173-V243 HydrophobicContact CB-CG2 4.05Å
174	K	98.7	Very high	96.9	Very high	6 Å²	6	25 Å²	25	3%	0.026	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	134.5	160.6	-176	-93.4	174.9	176.5	0	107.8	T84 M158 D176 G239 A241 Y242 E268	T84-K174 WeakPolarHBondContact OG1-CE 3.18Å; T84-K174 PolarHBondContact OG1-NZ 3.35Å; M158-K174 HydrophobicContact CE-CB 3.85Å; M158-K174 HydrophobicContact CE-CG 3.68Å; M158-K174 HydrophobicContact SD-CB 3.93Å; M158-K174 HydrophobicContact SD-CG 3.62Å; K174-D176 VanDerWaalsContact NZ-CG 3.27Å; K174-D176 IonicContact NZ-OD1 2.77Å; K174-D176 PolarHBondContact NZ-OD1 3.27Å; K174-D176 IonicContact NZ-OD2 3.69Å; K174-D176 PolarHBondContact NZ-OD2 2.82Å; K174-G239 WeakPolarHBondContact CD-O 3.35Å; K174-G239 PolarHBondContact NZ-O 2.99Å; K174-A241 VanDerWaalsContact O-CA 3.23Å; K174-A241 WeakPolarHBondContact O-CA 3.43Å; K174-Y242 HydrophobicContact CB-CD1 4.48Å; K174-Y242 HydrophobicContact CB-CD2 3.8Å; K174-Y242 HydrophobicContact CB-CE1 4.11Å; K174-Y242 HydrophobicContact CB-CE2 3.3Å; K174-Y242 HydrophobicContact CB-CG 4.35Å; K174-Y242 VanDerWaalsContact CB-CZ 3.49Å; K174-Y242 HydrophobicContact CD-CD1 4.27Å; K174-Y242 HydrophobicContact CD-CE1 3.68Å; K174-Y242 HydrophobicContact CD-CE2 4.46Å; K174-Y242 HydrophobicContact CG-CE1 4.12Å; K174-Y242 HydrophobicContact CG-CE2 4.03Å; K174-Y242 PolarHBondContact N-O 2.92Å; K174-Y242 PolarHBondContact O-N 2.74Å; K174-E268 IonicContact NZ-OE2 2.8Å
175	V	98.8	Very high	97	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	137.9	-178.3	-170.2	0	0	0	0	109	I82 V83 T84 W100 A173 V179 F181	I82-V175 PolarHBondContact O-N 3.08Å; V83-V175 CarbonylContact C-O 3.56Å; V83-V175 WeakPolarHBondContact CA-O 3.49Å; T84-V175 PolarHBondContact N-O 3.04Å; T84-V175 PolarHBondContact OG1-O 3.17Å; W100-V175 HydrophobicContact CH2-CB 4.29Å; W100-V175 HydrophobicContact CH2-CG1 3.93Å; W100-V175 HydrophobicContact CZ2-CG1 4.14Å; A173-V175 HydrophobicContact CB-CG2 4.18Å; V175-V179 HydrophobicContact CG1-CB 3.69Å; V175-V179 HydrophobicContact CG1-CG1 3.74Å; V175-V179 HydrophobicContact CG1-CG2 4.48Å; V175-F181 HydrophobicContact CG1-CB 4.07Å; V175-F181 HydrophobicContact CG1-CG 4.4Å; V175-F181 HydrophobicContact CG2-CD1 4.46Å; V175-F181 HydrophobicContact CG2-CD2 4.02Å; V175-F181 HydrophobicContact CG2-CE2 4.18Å; V175-F181 HydrophobicContact CG2-CG 4.15Å; V175-F181 HydrophobicContact CG2-CZ 4.45Å
176	D	98.6	Very high	97	Very high	33 Å²	33	19.8 Å²	19.8	18%	0.176	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	157.3	169.4	-75.8	-32.4	0	0	0	111.9	T84 K174 D178 V179 T240	T84-D176 PolarHBondContact OG1-OD1 2.99Å; K174-D176 VanDerWaalsContact NZ-CG 3.27Å; K174-D176 IonicContact NZ-OD1 2.77Å; K174-D176 PolarHBondContact NZ-OD1 3.27Å; K174-D176 IonicContact NZ-OD2 3.69Å; K174-D176 PolarHBondContact NZ-OD2 2.82Å; D176-D178 WeakPolarHBondContact CB-OD1 3.35Å; D176-D178 PolarHBondContact O-N 3Å; D176-V179 HydrophobicContact CB-CG2 3.92Å; D176-V179 WeakPolarHBondContact O-CB 3.37Å; D176-V179 PolarHBondContact O-N 3.12Å; D176-T240 PolarHBondContact N-O 2.91Å; D176-T240 WeakPolarHBondContact OD2-CA 3.46Å
177	D	98.6	Very high	96.9	Very high	20 Å²	20	19.8 Å²	19.8	11%	0.107	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-5.4	-175.3	66.5	-5.1	0	0	0	114.9	V83 T84 S85 N89 A92 I96	V83-D177 HydrophobicContact CG1-CB 3.84Å; T84-D177 PolarHBondContact O-N 3.44Å; S85-D177 VanDerWaalsContact CA-OD2 3.25Å; S85-D177 WeakPolarHBondContact CA-OD2 3.35Å; S85-D177 VanDerWaalsContact CB-OD2 3.23Å; S85-D177 WeakPolarHBondContact CB-OD2 3.47Å; S85-D177 PolarHBondContact OG-OD2 2.86Å; N89-D177 WeakPolarHBondContact CB-OD2 3.44Å; N89-D177 PolarHBondContact ND2-OD2 3.36Å; A92-D177 HydrophobicContact CB-CB 4.16Å; I96-D177 HydrophobicContact CD1-CB 4.14Å
178	D	98	Very high	96.8	Very high	48 Å²	48	20 Å²	20	26%	0.257	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	24.2	172.4	69.3	-15.6	0	0	0	112.4	D176 H309 Q310 I311	D176-D178 WeakPolarHBondContact CB-OD1 3.35Å; D176-D178 PolarHBondContact O-N 3Å; D178-H309 IonicContact OD1-CD2 2.67Å; D178-H309 PolarHBondContact OD1-CD2 2.97Å; D178-H309 VanDerWaalsContact OD1-CD2 3.24Å; D178-H309 IonicContact OD1-NE2 3.14Å; D178-H309 IonicContact OD2-CD2 3.37Å; D178-H309 IonicContact OD2-NE2 2.61Å; D178-H309 PolarHBondContact OD2-NE2 3.48Å; D178-Q310 PolarHBondContact O-N 3Å; D178-Q310 VanDerWaalsContact O-N 3.12Å; D178-I311 WeakPolarHBondContact CA-O 3.42Å; D178-I311 PolarHBondContact O-N 2.86Å
179	V	98.4	Very high	96.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.			trans	-110.3	126.3	178.9	174.9	0	0	0	0	111.2	W100 V175 D176 F181 V308 H309 M316	W100-V179 PolarHBondContact NE1-O 3.33Å; V175-V179 HydrophobicContact CG1-CB 3.69Å; V175-V179 HydrophobicContact CG1-CG1 3.74Å; V175-V179 HydrophobicContact CG1-CG2 4.48Å; D176-V179 HydrophobicContact CB-CG2 3.92Å; D176-V179 WeakPolarHBondContact O-CB 3.37Å; D176-V179 PolarHBondContact O-N 3.12Å; V179-F181 HydrophobicContact CG1-CB 4.45Å; V179-F181 PolarHBondContact O-N 3.15Å; V179-V308 CarbonylContact C-O 3.5Å; V179-V308 WeakPolarHBondContact CA-O 3.46Å; V179-H309 HydrophobicContact CG2-CB 4.25Å; V179-M316 WeakPolarHBondContact O-CE 3.22Å
180	F	98.1	Very high	96.4	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.009	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	108.9	163.6	-173.9	-80.7	0	0	0	108.8	Y302 S307 V308 I311 W320 V323	F180-Y302 HydrophobicContact CD1-CD1 4.1Å; F180-Y302 HydrophobicContact CD2-CD1 4.39Å; F180-Y302 HydrophobicContact CE1-CD1 4.35Å; F180-Y302 HydrophobicContact CG-CD1 4.13Å; F180-Y302 HydrophobicContact CG-CE1 4.5Å; F180-S307 WeakPolarHBondContact O-CA 2.8Å; F180-V308 HydrophobicContact CB-CB 4.34Å; F180-V308 PolarHBondContact N-O 2.72Å; F180-V308 PolarHBondContact O-N 3.1Å; F180-I311 HydrophobicContact CB-CB 4.48Å; F180-I311 HydrophobicContact CB-CG1 3.91Å; F180-I311 HydrophobicContact CB-CG2 4.45Å; F180-W320 HydrophobicContact CE1-CE3 4.17Å; F180-W320 HydrophobicContact CE1-CZ3 4.31Å; F180-W320 HydrophobicContact CE2-CB 3.99Å; F180-W320 AromaticContact CE2-CE3 3.69Å; F180-W320 HydrophobicContact CE2-CE3 3.69Å; F180-W320 HydrophobicContact CZ-CD2 4.45Å; F180-W320 AromaticContact CZ-CE3 3.4Å; F180-W320 HydrophobicContact CZ-CE3 3.4Å; F180-W320 AromaticContact CZ-CZ3 3.96Å; F180-W320 HydrophobicContact CZ-CZ3 3.96Å; F180-V323 HydrophobicContact CZ-CG2 3.83Å
181	F	98.3	Very high	95.8	Very high	1 Å²	1	21.3 Å²	21.3	0%	0.004	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.3	-175.7	-178.8	-107.6	0	0	0	111.5	W100 A173 V175 V179 P183 L186 V306	W100-F181 WeakPolarHBondContact CB-O 3.36Å; W100-F181 HydrophobicContact CD2-CB 3.85Å; W100-F181 HydrophobicContact CD2-CD1 4.48Å; W100-F181 HydrophobicContact CE3-CB 4Å; W100-F181 AromaticContact CE3-CD1 3.85Å; W100-F181 HydrophobicContact CE3-CD1 3.85Å; W100-F181 HydrophobicContact CE3-CG 4.42Å; W100-F181 HydrophobicContact CG-CB 4.38Å; W100-F181 VanDerWaalsContact CG-O 3.25Å; W100-F181 HydrophobicContact CH2-CB 4.15Å; W100-F181 HydrophobicContact CZ2-CB 4.03Å; W100-F181 HydrophobicContact CZ3-CB 4.17Å; W100-F181 AromaticContact CZ3-CD1 3.96Å; W100-F181 HydrophobicContact CZ3-CD1 3.96Å; W100-F181 HydrophobicContact CZ3-CG 4.45Å; A173-F181 HydrophobicContact CB-CE2 4.47Å; A173-F181 HydrophobicContact CB-CZ 3.9Å; V175-F181 HydrophobicContact CG1-CB 4.07Å; V175-F181 HydrophobicContact CG1-CG 4.4Å; V175-F181 HydrophobicContact CG2-CD1 4.46Å; V175-F181 HydrophobicContact CG2-CD2 4.02Å; V175-F181 HydrophobicContact CG2-CE2 4.18Å; V175-F181 HydrophobicContact CG2-CG 4.15Å; V175-F181 HydrophobicContact CG2-CZ 4.45Å; V179-F181 HydrophobicContact CG1-CB 4.45Å; V179-F181 PolarHBondContact O-N 3.15Å; F181-P183 HydrophobicContact CD1-CB 4.47Å; F181-P183 HydrophobicContact CE1-CB 4.04Å; F181-P183 VanDerWaalsContact O-CD 3.3Å; F181-P183 WeakPolarHBondContact O-CD 3.07Å; F181-L186 HydrophobicContact CE1-CD2 4.5Å; F181-L186 HydrophobicContact CE2-CD2 4.13Å; F181-L186 HydrophobicContact CZ-CD2 3.51Å; F181-V306 CarbonylContact C-O 3.48Å; F181-V306 WeakPolarHBondContact CA-O 3.42Å; F181-V306 HydrophobicContact CD2-CG1 4.23Å; F181-V306 WeakPolarHBondContact CD2-O 3.42Å; F181-V306 HydrophobicContact CE2-CG1 3.84Å
182	N	97.7	Very high	94.1	Very high	10 Å²	10	27.6 Å²	27.6	5%	0.053	14%	0.139	C	C	.	.			trans	-111.9	93	-179.6	-166.9	-30.7	0	0	0	110.9	S184 V185 L186 M305 V306	N182-S184 PolarHBondContact O-N 2.94Å; N182-S184 WeakPolarHBondContact OD1-CB 3.31Å; N182-S184 PolarHBondContact OD1-N 2.88Å; N182-S184 VanDerWaalsContact OD1-N 3.13Å; N182-V185 HydrophobicContact CB-CB 4.11Å; N182-V185 HydrophobicContact CB-CG2 4.11Å; N182-V185 VanDerWaalsContact CG-CG2 3.4Å; N182-V185 VanDerWaalsContact ND2-CG2 3.27Å; N182-V185 WeakPolarHBondContact ND2-CG2 3.35Å; N182-V185 PolarHBondContact O-N 3.27Å; N182-V185 PolarHBondContact OD1-N 3.46Å; N182-V185 VanDerWaalsContact OD1-N 3.07Å; N182-L186 PolarHBondContact O-N 3.22Å; N182-L186 VanDerWaalsContact O-N 3.08Å; N182-M305 VanDerWaalsContact CB-O 3.32Å; N182-M305 WeakPolarHBondContact CB-O 3.44Å; N182-V306 PolarHBondContact N-O 2.74Å
183	P	97.1	Very high	91.8	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-27.4	180	26	-34.3	0	0	0	112.2	L79 Q103 V106 F181 L187	L79-P183 HydrophobicContact CD2-CB 4.35Å; Q103-P183 VanDerWaalsContact OE1-CG 3.28Å; V106-P183 HydrophobicContact CG1-CB 4.4Å; V106-P183 HydrophobicContact CG1-CG 4.5Å; V106-P183 HydrophobicContact CG2-CB 4.32Å; V106-P183 HydrophobicContact CG2-CG 4.07Å; F181-P183 HydrophobicContact CD1-CB 4.47Å; F181-P183 HydrophobicContact CE1-CB 4.04Å; F181-P183 VanDerWaalsContact O-CD 3.3Å; F181-P183 WeakPolarHBondContact O-CD 3.07Å; P183-L187 VanDerWaalsContact O-CB 3.29Å; P183-L187 WeakPolarHBondContact O-CB 3.46Å; P183-L187 WeakPolarHBondContact O-CG 3.42Å; P183-L187 PolarHBondContact O-N 2.92Å
184	S	95.7	Very high	89.5	Confident	47 Å²	47	44.4 Å²	44.4	33%	0.329	22%	0.219	S	C	.	.	H	α-helix	trans	-67.8	-45.8	178.8	-171.8	0	0	0	0	111.6	R107 N182 L187 H188	R107-S184 WeakPolarHBondContact CD-O 3.29Å; N182-S184 PolarHBondContact O-N 2.94Å; N182-S184 WeakPolarHBondContact OD1-CB 3.31Å; N182-S184 PolarHBondContact OD1-N 2.88Å; N182-S184 VanDerWaalsContact OD1-N 3.13Å; S184-L187 PolarHBondContact O-N 2.84Å; S184-H188 VanDerWaalsContact O-CB 3.31Å; S184-H188 WeakPolarHBondContact O-CB 3.32Å; S184-H188 PolarHBondContact O-N 3.27Å
185	V	95.8	Very high	87.4	Confident	25 Å²	25	45.8 Å²	45.8	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-43.8	175.6	175.2	0	0	0	0	110.6	N182 H188 F189 L288 Q303 A304 V306	N182-V185 HydrophobicContact CB-CB 4.11Å; N182-V185 HydrophobicContact CB-CG2 4.11Å; N182-V185 VanDerWaalsContact CG-CG2 3.4Å; N182-V185 VanDerWaalsContact ND2-CG2 3.27Å; N182-V185 WeakPolarHBondContact ND2-CG2 3.35Å; N182-V185 PolarHBondContact O-N 3.27Å; N182-V185 PolarHBondContact OD1-N 3.46Å; N182-V185 VanDerWaalsContact OD1-N 3.07Å; V185-H188 PolarHBondContact O-N 2.91Å; V185-F189 WeakPolarHBondContact O-CB 3.05Å; V185-F189 PolarHBondContact O-N 3.46Å; V185-L288 HydrophobicContact CG1-CD1 4.05Å; V185-Q303 VanDerWaalsContact CG2-O 3.27Å; V185-Q303 WeakPolarHBondContact CG2-O 3.47Å; V185-A304 VanDerWaalsContact CG1-O 3.31Å; V185-A304 WeakPolarHBondContact CG1-O 3.31Å; V185-V306 HydrophobicContact CB-CG2 4.27Å; V185-V306 HydrophobicContact CG1-CG2 3.62Å
186	L	95.9	Very high	85.3	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.2	-52.5	176	174.7	62.1	0	0	0	111.1	L79 F181 N182 H188 F189 L190 L204 V243 F289 V306	L79-L186 HydrophobicContact CD1-CD2 4.43Å; L79-L186 HydrophobicContact CD2-CD2 4.07Å; F181-L186 HydrophobicContact CE1-CD2 4.5Å; F181-L186 HydrophobicContact CE2-CD2 4.13Å; F181-L186 HydrophobicContact CZ-CD2 3.51Å; N182-L186 PolarHBondContact O-N 3.22Å; N182-L186 VanDerWaalsContact O-N 3.08Å; L186-H188 PolarHBondContact O-N 2.87Å; L186-F189 WeakPolarHBondContact O-CB 3.03Å; L186-F189 PolarHBondContact O-N 2.96Å; L186-F189 VanDerWaalsContact O-N 3.1Å; L186-L190 HydrophobicContact CD1-CD1 3.84Å; L186-L190 HydrophobicContact CD1-CG 3.97Å; L186-L190 HydrophobicContact CD2-CD1 4.41Å; L186-L190 HydrophobicContact CG-CD1 3.83Å; L186-L190 HydrophobicContact CG-CG 4.33Å; L186-L190 WeakPolarHBondContact O-CG 3.49Å; L186-L190 PolarHBondContact O-N 2.99Å; L186-L204 HydrophobicContact CD1-CD2 4.07Å; L186-V243 HydrophobicContact CD1-CG2 4.03Å; L186-V243 HydrophobicContact CD2-CG2 3.77Å; L186-F289 HydrophobicContact CD1-CZ 4.33Å; L186-V306 HydrophobicContact CB-CG1 3.98Å; L186-V306 HydrophobicContact CB-CG2 4.32Å; L186-V306 HydrophobicContact CD1-CG1 4.33Å
187	L	94.5	Very high	83.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.5	-28.5	-179	-69.1	172.9	0	0	0	111.7	Y78 L79 V106 R107 L109 V111 P183 S184 N191	Y78-L187 HydrophobicContact CD1-CD2 3.87Å; Y78-L187 HydrophobicContact CE1-CD2 3.83Å; L79-L187 HydrophobicContact CB-CD2 4.47Å; L79-L187 HydrophobicContact CD2-CD2 4.48Å; V106-L187 HydrophobicContact CB-CD1 3.89Å; V106-L187 HydrophobicContact CG1-CD1 3.93Å; R107-L187 PolarHBondContact NH1-O 2.98Å; L109-L187 HydrophobicContact CB-CD1 4.2Å; L109-L187 HydrophobicContact CD1-CB 4.49Å; L109-L187 HydrophobicContact CD1-CD1 4.27Å; L109-L187 HydrophobicContact CD1-CD2 3.98Å; L109-L187 HydrophobicContact CD1-CG 4.48Å; V111-L187 HydrophobicContact CG2-CD1 4.01Å; P183-L187 VanDerWaalsContact O-CB 3.29Å; P183-L187 WeakPolarHBondContact O-CB 3.46Å; P183-L187 WeakPolarHBondContact O-CG 3.42Å; P183-L187 PolarHBondContact O-N 2.92Å; S184-L187 PolarHBondContact O-N 2.84Å; L187-N191 WeakPolarHBondContact O-CB 3.37Å; L187-N191 PolarHBondContact O-N 2.89Å
188	H	92.6	Very high	81	Confident	80 Å²	80	56.7 Å²	56.7	37%	0.37	28%	0.281	S	S	.	.	H	α-helix	trans	-66.5	-46	169.3	-176.6	71.2	0	0	0	112.2	R107 S184 V185 L186 L190 N191 K192	R107-H188 VanDerWaalsContact NH1-CA 3.31Å; R107-H188 PolarHBondContact NH2-ND1 3.16Å; S184-H188 VanDerWaalsContact O-CB 3.31Å; S184-H188 WeakPolarHBondContact O-CB 3.32Å; S184-H188 PolarHBondContact O-N 3.27Å; V185-H188 PolarHBondContact O-N 2.91Å; L186-H188 PolarHBondContact O-N 2.87Å; H188-L190 VanDerWaalsContact C-N 3.34Å; H188-L190 PolarHBondContact O-N 3.49Å; H188-N191 PolarHBondContact O-N 2.85Å; H188-K192 WeakPolarHBondContact NE2-CE 3.29Å; H188-K192 PolarHBondContact O-N 2.94Å
189	F	90.9	Very high	79.1	Confident	67 Å²	67	63.3 Å²	63.3	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-59.7	-43.4	175.5	177.8	-91.9	0	0	0	111.8	V185 L186 L204 C286 L288	V185-F189 WeakPolarHBondContact O-CB 3.05Å; V185-F189 PolarHBondContact O-N 3.46Å; L186-F189 WeakPolarHBondContact O-CB 3.03Å; L186-F189 PolarHBondContact O-N 2.96Å; L186-F189 VanDerWaalsContact O-N 3.1Å; F189-L204 HydrophobicContact CD1-CD2 3.84Å; F189-L204 HydrophobicContact CE1-CD1 3.76Å; F189-L204 HydrophobicContact CE1-CD2 3.59Å; F189-L204 HydrophobicContact CE1-CG 4.34Å; F189-L204 HydrophobicContact CZ-CD1 4.19Å; F189-C286 HydrophobicContact CZ-CB 4.49Å; F189-L288 HydrophobicContact CD2-CD1 4.22Å
190	L	89	Confident	78.3	Confident	9 Å²	9	64.5 Å²	64.5	5%	0.047	32%	0.323	C	S	.	.	H	α-helix	trans	-70.1	-32.4	178.1	-64.5	174.3	0	0	0	112.7	F171 L186 H188 L202 L204	F171-L190 HydrophobicContact CD1-CD1 4.12Å; F171-L190 HydrophobicContact CD2-CD1 3.92Å; F171-L190 HydrophobicContact CE1-CD1 4.15Å; F171-L190 HydrophobicContact CE1-CD2 4.14Å; F171-L190 HydrophobicContact CE2-CD1 3.94Å; F171-L190 HydrophobicContact CG-CD1 4.01Å; F171-L190 HydrophobicContact CZ-CD1 4.06Å; F171-L190 HydrophobicContact CZ-CD2 4.27Å; L186-L190 HydrophobicContact CD1-CD1 3.84Å; L186-L190 HydrophobicContact CD1-CG 3.97Å; L186-L190 HydrophobicContact CD2-CD1 4.41Å; L186-L190 HydrophobicContact CG-CD1 3.83Å; L186-L190 HydrophobicContact CG-CG 4.33Å; L186-L190 WeakPolarHBondContact O-CG 3.49Å; L186-L190 PolarHBondContact O-N 2.99Å; H188-L190 VanDerWaalsContact C-N 3.34Å; H188-L190 PolarHBondContact O-N 3.49Å; L190-L202 HydrophobicContact CD2-CD2 3.75Å; L190-L204 HydrophobicContact CD2-CD2 4.3Å
191	N	81.6	Confident	78	Confident	93 Å²	93	66.6 Å²	66.6	50%	0.497	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	6.9	-175.1	-169.4	16.8	0	0	0	114.7	R107 L187 H188 S193	R107-N191 PolarHBondContact NH1-ND2 3.31Å; L187-N191 WeakPolarHBondContact O-CB 3.37Å; L187-N191 PolarHBondContact O-N 2.89Å; H188-N191 PolarHBondContact O-N 2.85Å; N191-S193 PolarHBondContact O-N 3.36Å
192	K	61.7	Low	77.8	Confident	136 Å²	136	66.5 Å²	66.5	59%	0.591	33%	0.334	S	S	*	.	S	Bend	trans	-72.3	75.2	170.9	-77	-171.3	-177.9	-177.6	0	110.7	H188	H188-K192 WeakPolarHBondContact NE2-CE 3.29Å; H188-K192 PolarHBondContact O-N 2.94Å
193	S	48.3	Very low	77.8	Confident	108 Å²	108	66 Å²	66	76%	0.755	33%	0.331	S	S	*	.	S	Bend	trans	62.4	58.3	147.1	55.5	0	0	0	0	119.8	N191	N191-S193 PolarHBondContact O-N 3.36Å
194	R	51.8	Low	77.8	Confident	246 Å²	246	66.1 Å²	66.1	93%	0.928	33%	0.332	S	S	*	.			trans	84.2	61.5	-174.4	-58.1	179.6	167.2	-173.1	-3	113.3	P196	R194-P196 WeakPolarHBondContact O-CD 3.24Å
195	N	54.1	Low	77.9	Confident	35 Å²	35	63.9 Å²	63.9	19%	0.187	32%	0.316	C	S	.	.			trans	-68.6	120.9	163.1	-143.7	-18.8	0	0	0	108	Y197 E198	N195-Y197 HydrophobicContact CB-CD2 4.31Å; N195-Y197 WeakPolarHBondContact ND2-CD2 3.42Å; N195-Y197 PolarHBondContact O-N 3.31Å; N195-Y197 WeakPolarHBondContact OD1-CD2 3.48Å; N195-Y197 WeakPolarHBondContact OD1-CE2 3.39Å; N195-E198 PolarHBondContact O-N 3.48Å
196	P	55.2	Low	78	Confident	92 Å²	92	67 Å²	67	60%	0.597	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-55.8	-15.1	177.7	20.7	-32.1	0	0	0	112.7	R194 E198 Q199 G200	R194-P196 WeakPolarHBondContact O-CD 3.24Å; P196-E198 PolarHBondContact O-N 3.42Å; P196-Q199 CarbonylContact O-C 3.56Å; P196-Q199 PolarHBondContact O-N 3.35Å; P196-Q199 VanDerWaalsContact O-N 3.15Å; P196-G200 PolarHBondContact O-N 3.21Å
197	Y	54.2	Low	78.1	Confident	79 Å²	79	67.7 Å²	67.7	31%	0.31	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-69	-18	177.5	-59.6	-41.8	0	0	0	116.7	N195 Q199 G200 L202	N195-Y197 HydrophobicContact CB-CD2 4.31Å; N195-Y197 WeakPolarHBondContact ND2-CD2 3.42Å; N195-Y197 PolarHBondContact O-N 3.31Å; N195-Y197 WeakPolarHBondContact OD1-CD2 3.48Å; N195-Y197 WeakPolarHBondContact OD1-CE2 3.39Å; Y197-Q199 PolarHBondContact O-N 2.88Å; Y197-G200 VanDerWaalsContact O-O 3.08Å; Y197-L202 HydrophobicContact CD1-CB 4.21Å; Y197-L202 HydrophobicContact CD1-CD1 3.68Å; Y197-L202 HydrophobicContact CD1-CG 4.49Å; Y197-L202 HydrophobicContact CD2-CD1 3.57Å; Y197-L202 HydrophobicContact CD2-CD2 4.49Å; Y197-L202 HydrophobicContact CE1-CD1 4.05Å; Y197-L202 HydrophobicContact CE2-CD1 4.02Å; Y197-L202 HydrophobicContact CG-CB 4.1Å; Y197-L202 HydrophobicContact CG-CD1 3.47Å; Y197-L202 VanDerWaalsContact CG-CD1 3.47Å; Y197-L202 HydrophobicContact CG-CD2 4.34Å; Y197-L202 HydrophobicContact CG-CG 4.15Å
198	E	51.4	Low	78.3	Confident	110 Å²	110	70.3 Å²	70.3	51%	0.514	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-70	-23.4	168.3	-81.5	-156.9	149.6	0	0	111.7	Y78 F171 N195 P196	Y78-E198 PolarHBondContact OH-OE1 2.61Å; F171-E198 HydrophobicContact CZ-CG 4.27Å; N195-E198 PolarHBondContact O-N 3.48Å; P196-E198 PolarHBondContact O-N 3.42Å
199	Q	59.4	Low	78.5	Confident	188 Å²	188	71.8 Å²	71.8	88%	0.879	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-14.1	179.8	-64.9	169.5	20	0	0	112.5	P196 Y197	P196-Q199 CarbonylContact O-C 3.56Å; P196-Q199 PolarHBondContact O-N 3.35Å; P196-Q199 VanDerWaalsContact O-N 3.15Å; Y197-Q199 PolarHBondContact O-N 2.88Å
200	G	80.5	Confident	78.7	Confident	25 Å²	25	75.2 Å²	75.2	26%	0.258	37%	0.368	S	S	.	.	S	Bend	trans	-114.8	178.7	-178.1	0	0	0	0	0	113.9	P196 Y197 S245 S247	P196-G200 PolarHBondContact O-N 3.21Å; Y197-G200 VanDerWaalsContact O-O 3.08Å; G200-S245 PolarHBondContact O-OG 2.86Å; G200-S247 PolarHBondContact O-OG 3.1Å
201	D	92.2	Very high	79.1	Confident	45 Å²	45	76.9 Å²	76.9	24%	0.241	38%	0.379	C	S	.	.			trans	-78.7	122.3	173.5	-52.2	-52.1	0	0	0	109.6	S247 A248 K251 V281	D201-S247 WeakPolarHBondContact OD1-CB 3.23Å; D201-S247 PolarHBondContact OD1-OG 3.26Å; D201-A248 HydrophobicContact CB-CB 4.03Å; D201-K251 VanDerWaalsContact CG-NZ 3.25Å; D201-K251 WeakPolarHBondContact OD1-CD 3.37Å; D201-K251 WeakPolarHBondContact OD1-CE 3.02Å; D201-K251 IonicContact OD1-NZ 3.72Å; D201-K251 PolarHBondContact OD1-NZ 2.95Å; D201-K251 VanDerWaalsContact OD1-NZ 3.14Å; D201-K251 IonicContact OD2-NZ 3.17Å; D201-K251 PolarHBondContact OD2-NZ 3.04Å; D201-V281 HydrophobicContact CB-CB 4.49Å; D201-V281 HydrophobicContact CB-CG1 4.04Å; D201-V281 HydrophobicContact CB-CG2 3.93Å
202	L	95	Very high	79.8	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	38%	0.38	C	S	.	.			trans	-115.9	127.6	173.2	-178.9	67.1	0	0	0	110	F171 L190 Y197 L204 F244 S245 A248	F171-L202 HydrophobicContact CD1-CD2 4.43Å; F171-L202 HydrophobicContact CE1-CD2 3.92Å; L190-L202 HydrophobicContact CD2-CD2 3.75Å; Y197-L202 HydrophobicContact CD1-CB 4.21Å; Y197-L202 HydrophobicContact CD1-CD1 3.68Å; Y197-L202 HydrophobicContact CD1-CG 4.49Å; Y197-L202 HydrophobicContact CD2-CD1 3.57Å; Y197-L202 HydrophobicContact CD2-CD2 4.49Å; Y197-L202 HydrophobicContact CE1-CD1 4.05Å; Y197-L202 HydrophobicContact CE2-CD1 4.02Å; Y197-L202 HydrophobicContact CG-CB 4.1Å; Y197-L202 HydrophobicContact CG-CD1 3.47Å; Y197-L202 VanDerWaalsContact CG-CD1 3.47Å; Y197-L202 HydrophobicContact CG-CD2 4.34Å; Y197-L202 HydrophobicContact CG-CG 4.15Å; L202-L204 HydrophobicContact CD1-CB 3.96Å; L202-L204 HydrophobicContact CD1-CD1 4.31Å; L202-L204 HydrophobicContact CD2-CB 4.12Å; L202-L204 HydrophobicContact CG-CB 3.98Å; L202-F244 CarbonylContact O-C 3.49Å; L202-F244 VanDerWaalsContact O-CA 3.27Å; L202-F244 WeakPolarHBondContact O-CA 3.47Å; L202-S245 PolarHBondContact N-OG 3Å; L202-S245 PolarHBondContact O-N 3.44Å; L202-A248 WeakPolarHBondContact O-CB 3.37Å
203	Y	97.7	Very high	81.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	88.5	165.4	175.1	-152.3	0	0	0	107.8	C237 Y242 V243 F244 V272 A276 P283 S284	Y203-C237 HydrophobicContact CD2-CB 4.33Å; Y203-C237 HydrophobicContact CE1-CB 4.31Å; Y203-C237 HydrophobicContact CE2-CB 3.56Å; Y203-C237 WeakPolarHBondContact OH-CB 3Å; Y203-C237 PolarHBondContact OH-N 3.05Å; Y203-C237 VanDerWaalsContact OH-N 3.08Å; Y203-Y242 HydrophobicContact CE2-CD1 4.45Å; Y203-Y242 AromaticContact CE2-CD2 3.98Å; Y203-Y242 HydrophobicContact CE2-CD2 3.98Å; Y203-Y242 AromaticContact CE2-CG 3.85Å; Y203-Y242 HydrophobicContact CE2-CG 3.85Å; Y203-V243 CarbonylContact C-O 3.31Å; Y203-V243 WeakPolarHBondContact CA-O 3.37Å; Y203-F244 HydrophobicContact CD1-CE1 4.21Å; Y203-F244 AromaticContact CD2-CD1 3.75Å; Y203-F244 HydrophobicContact CD2-CD1 3.75Å; Y203-F244 AromaticContact CD2-CE1 3.09Å; Y203-F244 HydrophobicContact CD2-CE1 3.09Å; Y203-F244 HydrophobicContact CD2-CE2 4.5Å; Y203-F244 AromaticContact CD2-CZ 3.54Å; Y203-F244 HydrophobicContact CD2-CZ 3.54Å; Y203-F244 AromaticContact CE2-CE1 3.65Å; Y203-F244 HydrophobicContact CE2-CE1 3.65Å; Y203-F244 HydrophobicContact CE2-CE2 4.47Å; Y203-F244 AromaticContact CE2-CZ 3.57Å; Y203-F244 HydrophobicContact CE2-CZ 3.57Å; Y203-F244 HydrophobicContact CG-CD1 4.1Å; Y203-F244 AromaticContact CG-CE1 3.43Å; Y203-F244 HydrophobicContact CG-CE1 3.43Å; Y203-F244 VanDerWaalsContact CG-CE1 3.43Å; Y203-F244 HydrophobicContact CG-CZ 4.2Å; Y203-V272 HydrophobicContact CE1-CG1 4.46Å; Y203-V272 HydrophobicContact CE2-CG1 4.14Å; Y203-V272 WeakPolarHBondContact OH-CG1 3.17Å; Y203-A276 HydrophobicContact CD1-CB 3.91Å; Y203-A276 HydrophobicContact CE1-CB 4.03Å; Y203-P283 HydrophobicContact CD1-CB 3.71Å; Y203-P283 HydrophobicContact CE1-CB 3.97Å; Y203-P283 HydrophobicContact CG-CB 4.46Å; Y203-P283 CarbonylContact O-C 3.57Å; Y203-P283 WeakPolarHBondContact O-CA 3.47Å; Y203-S284 PolarHBondContact O-N 3.15Å
204	L	97.3	Very high	83.8	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	138.5	-171	-172.9	73.3	0	0	0	111.3	L186 F189 L190 L202 Y242 V243 S284 C286 F289	L186-L204 HydrophobicContact CD1-CD2 4.07Å; F189-L204 HydrophobicContact CD1-CD2 3.84Å; F189-L204 HydrophobicContact CE1-CD1 3.76Å; F189-L204 HydrophobicContact CE1-CD2 3.59Å; F189-L204 HydrophobicContact CE1-CG 4.34Å; F189-L204 HydrophobicContact CZ-CD1 4.19Å; L190-L204 HydrophobicContact CD2-CD2 4.3Å; L202-L204 HydrophobicContact CD1-CB 3.96Å; L202-L204 HydrophobicContact CD1-CD1 4.31Å; L202-L204 HydrophobicContact CD2-CB 4.12Å; L202-L204 HydrophobicContact CG-CB 3.98Å; L204-Y242 CarbonylContact O-C 3.57Å; L204-Y242 VanDerWaalsContact O-CA 3.25Å; L204-Y242 WeakPolarHBondContact O-CA 3.33Å; L204-Y242 WeakPolarHBondContact O-CB 3.48Å; L204-V243 HydrophobicContact CB-CB 4.23Å; L204-V243 PolarHBondContact N-O 2.9Å; L204-V243 PolarHBondContact O-N 3.43Å; L204-S284 WeakPolarHBondContact CA-O 3.26Å; L204-C286 HydrophobicContact CD1-CB 3.72Å; L204-C286 HydrophobicContact CG-CB 4.12Å; L204-F289 HydrophobicContact CD2-CE2 3.97Å; L204-F289 HydrophobicContact CD2-CZ 4.24Å; L204-F289 HydrophobicContact CG-CE2 4.09Å; L204-F289 HydrophobicContact CG-CZ 4.43Å
205	G	97.9	Very high	85.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.2	-165.2	170.7	0	0	0	0	0	112.7	V207 S284 H285 C286	G205-V207 PolarHBondContact O-N 2.88Å; G205-S284 PolarHBondContact N-O 3.28Å; G205-S284 VanDerWaalsContact N-O 3.1Å; G205-H285 WeakPolarHBondContact O-CA 3.21Å; G205-C286 PolarHBondContact O-N 3.36Å
206	R	97.8	Very high	87.9	Confident	90 Å²	90	61.7 Å²	61.7	34%	0.34	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	106.5	170.6	-179.7	59.4	173.8	-102.9	-0.5	109.2	C237 S238 F289 S290	R206-C237 CarbonylContact O-C 3.31Å; R206-C237 WeakPolarHBondContact O-CA 3.41Å; R206-S238 WeakPolarHBondContact O-CB 3.4Å; R206-S238 PolarHBondContact O-N 3.45Å; R206-F289 HydrophobicContact CB-CB 3.87Å; R206-F289 PolarHBondContact NH1-O 2.78Å; R206-S290 PolarHBondContact NH1-O 2.78Å
207	V	98.3	Very high	89.7	Confident	15 Å²	15	61.4 Å²	61.4	9%	0.091	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.2	-176.3	179.8	0	0	0	0	112.3	G205 L209 D235 Y236 P283 H285	G205-V207 PolarHBondContact O-N 2.88Å; V207-L209 HydrophobicContact CG1-CD2 3.63Å; V207-L209 HydrophobicContact CG1-CG 4.22Å; V207-D235 HydrophobicContact CG1-CB 4.06Å; V207-Y236 CarbonylContact C-O 3.58Å; V207-Y236 WeakPolarHBondContact CA-O 3.48Å; V207-P283 HydrophobicContact CG1-CB 4.4Å; V207-P283 HydrophobicContact CG1-CG 4.2Å; V207-P283 HydrophobicContact CG2-CB 3.79Å; V207-P283 HydrophobicContact CG2-CG 4.39Å; V207-H285 HydrophobicContact CB-CB 4.09Å; V207-H285 HydrophobicContact CG2-CB 3.86Å; V207-H285 PolarHBondContact N-ND1 3.15Å
208	H	97.6	Very high	91.6	Very high	56 Å²	56	64.9 Å²	64.9	26%	0.259	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122.7	164	-73.1	-71	0	0	0	109.1	V211 D235 Y236 S238	H208-V211 HydrophobicContact CB-CG2 3.76Å; H208-D235 WeakPolarHBondContact O-CA 3.27Å; H208-Y236 HydrophobicContact CB-CD1 4.27Å; H208-Y236 HydrophobicContact CB-CD2 4.27Å; H208-Y236 HydrophobicContact CB-CE1 3.91Å; H208-Y236 HydrophobicContact CB-CE2 3.9Å; H208-Y236 HydrophobicContact CB-CG 4.44Å; H208-Y236 AromaticContact CD2-CE2 3.65Å; H208-Y236 AromaticContact CG-CE2 3.99Å; H208-Y236 PolarHBondContact N-O 2.73Å; H208-Y236 PolarHBondContact O-N 3.07Å; H208-S238 WeakPolarHBondContact NE2-CB 3.3Å; H208-S238 PolarHBondContact NE2-OG 3.2Å
209	L	96.9	Very high	93.7	Very high	111 Å²	111	60.9 Å²	60.9	58%	0.581	32%	0.323	S	S	*	.			trans	-104.3	133.1	-177.9	-61.9	174.2	0	0	0	110	V207 V211 D235	V207-L209 HydrophobicContact CG1-CD2 3.63Å; V207-L209 HydrophobicContact CG1-CG 4.22Å; L209-V211 PolarHBondContact O-N 2.6Å; L209-V211 VanDerWaalsContact O-N 3.1Å; L209-D235 WeakPolarHBondContact CA-OD1 3.12Å; L209-D235 HydrophobicContact CD2-CB 4.12Å; L209-D235 VanDerWaalsContact CD2-CG 3.45Å; L209-D235 WeakPolarHBondContact CD2-OD2 3.39Å
210	H	94.3	Very high	95.1	Very high	139 Å²	139	59 Å²	59	64%	0.644	31%	0.312	S	S	*	.	S	Bend	trans	48.8	39.7	170.6	-56.3	-56.6	0	0	0	115.3	V232 D235	H210-V232 VanDerWaalsContact CA-CG1 3.47Å; H210-V232 HydrophobicContact CB-CG1 3.92Å; H210-D235 PolarHBondContact N-OD1 2.93Å
211	V	97.4	Very high	95.7	Very high	44 Å²	44	61.4 Å²	61.4	27%	0.267	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-72.1	131.7	179	176.9	0	0	0	0	110.1	H208 L209 F233 Y236	H208-V211 HydrophobicContact CB-CG2 3.76Å; L209-V211 PolarHBondContact O-N 2.6Å; L209-V211 VanDerWaalsContact O-N 3.1Å; V211-F233 HydrophobicContact CB-CD2 4.25Å; V211-F233 HydrophobicContact CG1-CD2 4.16Å; V211-F233 VanDerWaalsContact O-CD2 3.31Å; V211-F233 WeakPolarHBondContact O-CD2 3.29Å; V211-F233 PolarHBondContact O-N 2.74Å; V211-Y236 HydrophobicContact CB-CE1 4.07Å; V211-Y236 HydrophobicContact CG2-CE1 4.23Å
212	A	97.5	Very high	95.9	Very high	64 Å²	64	63 Å²	63	53%	0.529	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-81.1	140.5	173.6	0	0	0	0	0	110.9	N214 S231	A212-N214 PolarHBondContact O-N 2.82Å; A212-S231 WeakPolarHBondContact CA-O 3.22Å
213	P	97	Very high	95.9	Very high	11 Å²	11	63 Å²	63	7%	0.071	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-60.1	134.1	172.4	-17.4	27.9	0	0	0	111.1	R215 Y228 S231 F233	P213-R215 VanDerWaalsContact CB-CZ 3.49Å; P213-R215 PolarHBondContact O-N 3.11Å; P213-Y228 HydrophobicContact CG-CD1 3.61Å; P213-Y228 HydrophobicContact CG-CE1 3.93Å; P213-S231 WeakPolarHBondContact CD-O 3.44Å; P213-F233 VanDerWaalsContact CA-CZ 3.49Å; P213-F233 HydrophobicContact CB-CE1 3.94Å; P213-F233 HydrophobicContact CB-CE2 3.99Å; P213-F233 HydrophobicContact CB-CZ 3.43Å; P213-F233 VanDerWaalsContact CB-CZ 3.43Å; P213-F233 HydrophobicContact CG-CD1 4.15Å; P213-F233 HydrophobicContact CG-CE1 3.6Å; P213-F233 HydrophobicContact CG-CE2 4.03Å; P213-F233 HydrophobicContact CG-CZ 3.54Å
214	N	96.6	Very high	95.8	Very high	63 Å²	63	64.4 Å²	64.4	34%	0.337	33%	0.329	S	S	.	.	B	Isolated β-bridge	trans	-76.3	118.6	175.1	-168	-30.8	0	0	0	109.4	A212 D216 S219 H221 Y222 L223	A212-N214 PolarHBondContact O-N 2.82Å; N214-D216 VanDerWaalsContact OD1-CB 3.23Å; N214-D216 WeakPolarHBondContact OD1-CB 3.37Å; N214-D216 PolarHBondContact OD1-N 3.13Å; N214-S219 WeakPolarHBondContact ND2-CB 3.4Å; N214-S219 PolarHBondContact ND2-OG 3.02Å; N214-H221 HydrophobicContact CB-CB 4.34Å; N214-Y222 WeakPolarHBondContact O-CA 3.5Å; N214-L223 PolarHBondContact O-N 2.77Å
215	R	96.3	Very high	95.7	Very high	80 Å²	80	67.8 Å²	67.8	30%	0.302	35%	0.353	S	S	.	.			trans	-98.9	1.8	-177.3	-52.3	-52.9	-169.8	174.8	5.9	113.5	P213 P217 Y222 L223 P224 Y228 L230	P213-R215 VanDerWaalsContact CB-CZ 3.49Å; P213-R215 PolarHBondContact O-N 3.11Å; R215-P217 WeakPolarHBondContact O-CD 3.43Å; R215-Y222 WeakPolarHBondContact O-CE2 3.42Å; R215-L223 WeakPolarHBondContact CD-O 3.46Å; R215-L223 PolarHBondContact NH1-O 2.83Å; R215-P224 PolarHBondContact NH1-O 2.79Å; R215-P224 VanDerWaalsContact NH1-O 3.07Å; R215-Y228 VanDerWaalsContact CZ-O 3.28Å; R215-Y228 PolarHBondContact NH1-O 2.74Å; R215-Y228 PolarHBondContact NH2-O 3.32Å; R215-L230 PolarHBondContact NH2-O 3.46Å
216	D	96.1	Very high	95.5	Very high	81 Å²	81	71.7 Å²	71.7	43%	0.433	39%	0.393	S	S	.	.			trans	-76.6	116.3	175.4	-179.6	1.3	0	0	0	110	N214 D218 S219 Y222	N214-D216 VanDerWaalsContact OD1-CB 3.23Å; N214-D216 WeakPolarHBondContact OD1-CB 3.37Å; N214-D216 PolarHBondContact OD1-N 3.13Å; D216-D218 PolarHBondContact O-N 2.89Å; D216-D218 PolarHBondContact OD1-N 3.1Å; D216-S219 VanDerWaalsContact O-CB 3.29Å; D216-S219 WeakPolarHBondContact O-CB 3.34Å; D216-S219 PolarHBondContact O-N 3.41Å; D216-S219 VanDerWaalsContact O-N 3.08Å; D216-Y222 VanDerWaalsContact C-CD2 3.43Å; D216-Y222 VanDerWaalsContact O-CB 3.3Å; D216-Y222 WeakPolarHBondContact O-CB 3.46Å; D216-Y222 WeakPolarHBondContact O-CD2 3.49Å
217	P	93.5	Very high	95.2	Very high	86 Å²	86	68.7 Å²	68.7	56%	0.558	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.5	179	-23.5	35.3	0	0	0	114.7	R215 S219 Y222	R215-P217 WeakPolarHBondContact O-CD 3.43Å; P217-S219 VanDerWaalsContact C-N 3.32Å; P217-Y222 HydrophobicContact CB-CE1 4.42Å; P217-Y222 HydrophobicContact CB-CE2 4.37Å; P217-Y222 HydrophobicContact CG-CE2 4.1Å
218	D	94.1	Very high	95.1	Very high	153 Å²	153	69.1 Å²	69.1	82%	0.818	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-8.6	-179.4	-64.2	-33.2	0	0	0	112.5	D216	D216-D218 PolarHBondContact O-N 2.89Å; D216-D218 PolarHBondContact OD1-N 3.1Å
219	S	93.8	Very high	94.9	Very high	25 Å²	25	71.5 Å²	71.5	18%	0.175	41%	0.408	C	S	.	.	S	Bend	trans	-76.4	136.1	177.1	-178.2	0	0	0	0	111.8	N214 D216 P217 H221 Y222	N214-S219 WeakPolarHBondContact ND2-CB 3.4Å; N214-S219 PolarHBondContact ND2-OG 3.02Å; D216-S219 VanDerWaalsContact O-CB 3.29Å; D216-S219 WeakPolarHBondContact O-CB 3.34Å; D216-S219 PolarHBondContact O-N 3.41Å; D216-S219 VanDerWaalsContact O-N 3.08Å; P217-S219 VanDerWaalsContact C-N 3.32Å; S219-H221 PolarHBondContact O-N 3.49Å; S219-H221 PolarHBondContact OG-N 3.12Å; S219-Y222 WeakPolarHBondContact O-CB 3.5Å; S219-Y222 PolarHBondContact O-N 3.27Å
220	K	90.6	Very high	94.9	Very high	148 Å²	148	71.2 Å²	71.2	64%	0.643	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.7	169.5	67.7	172.5	-177.2	173	0	113.6	Y148	Y148-K220 HydrophobicContact CE1-CB 4Å; Y148-K220 HydrophobicContact CE1-CD 4.27Å; Y148-K220 HydrophobicContact CE1-CG 4.33Å; Y148-K220 WeakPolarHBondContact CE1-O 3.42Å
221	H	93.1	Very high	95	Very high	76 Å²	76	69 Å²	69	35%	0.352	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	18.2	176.6	-53.1	146.8	0	0	0	112.4	Y148 N214 S219 L223 P267	Y148-H221 PolarHBondContact OH-CD2 2.96Å; Y148-H221 VanDerWaalsContact OH-CD2 3.26Å; Y148-H221 PolarHBondContact OH-NE2 3.41Å; Y148-H221 VanDerWaalsContact OH-NE2 3.1Å; N214-H221 HydrophobicContact CB-CB 4.34Å; S219-H221 PolarHBondContact O-N 3.49Å; S219-H221 PolarHBondContact OG-N 3.12Å; H221-L223 PolarHBondContact O-N 2.8Å; H221-P267 HydrophobicContact CB-CG 4.25Å
222	Y	94.6	Very high	95.1	Very high	79 Å²	79	69.6 Å²	69.6	31%	0.31	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-55.7	127.7	-179.4	174.7	-126.4	0	0	0	111.9	N214 R215 D216 P217 S219 P224 P264	N214-Y222 WeakPolarHBondContact O-CA 3.5Å; R215-Y222 WeakPolarHBondContact O-CE2 3.42Å; D216-Y222 VanDerWaalsContact C-CD2 3.43Å; D216-Y222 VanDerWaalsContact O-CB 3.3Å; D216-Y222 WeakPolarHBondContact O-CB 3.46Å; D216-Y222 WeakPolarHBondContact O-CD2 3.49Å; P217-Y222 HydrophobicContact CB-CE1 4.42Å; P217-Y222 HydrophobicContact CB-CE2 4.37Å; P217-Y222 HydrophobicContact CG-CE2 4.1Å; S219-Y222 WeakPolarHBondContact O-CB 3.5Å; S219-Y222 PolarHBondContact O-N 3.27Å; Y222-P224 HydrophobicContact CE1-CG 4.34Å; Y222-P224 HydrophobicContact CE2-CB 4.31Å; Y222-P264 HydrophobicContact CD1-CG 4.46Å
223	L	95.3	Very high	95.1	Very high	1 Å²	1	67 Å²	67	1%	0.005	39%	0.387	C	S	.	.			trans	-140.2	111.1	172.1	-169.6	63.6	0	0	0	108.8	N214 R215 H221 A227 Y228 F233 P266	N214-L223 PolarHBondContact O-N 2.77Å; R215-L223 WeakPolarHBondContact CD-O 3.46Å; R215-L223 PolarHBondContact NH1-O 2.83Å; H221-L223 PolarHBondContact O-N 2.8Å; L223-A227 HydrophobicContact CD1-CB 3.66Å; L223-A227 HydrophobicContact CG-CB 4.29Å; L223-Y228 HydrophobicContact CD2-CG 4.21Å; L223-F233 HydrophobicContact CD2-CE1 3.65Å; L223-F233 HydrophobicContact CD2-CZ 3.67Å; L223-P266 HydrophobicContact CD1-CB 4.37Å; L223-P266 HydrophobicContact CD1-CG 4.41Å; L223-P266 HydrophobicContact CD2-CB 4.27Å
224	P	95.4	Very high	95.1	Very high	28 Å²	28	67.7 Å²	67.7	18%	0.182	39%	0.391	C	S	.	.			trans	-70.2	157.2	-179.1	24.5	-31.1	0	0	0	112.6	R215 Y222 G226 A227 Y228 P264	R215-P224 PolarHBondContact NH1-O 2.79Å; R215-P224 VanDerWaalsContact NH1-O 3.07Å; Y222-P224 HydrophobicContact CE1-CG 4.34Å; Y222-P224 HydrophobicContact CE2-CB 4.31Å; P224-G226 PolarHBondContact O-N 3.38Å; P224-A227 HydrophobicContact CG-CB 3.87Å; P224-A227 PolarHBondContact O-N 3.19Å; P224-Y228 PolarHBondContact O-N 3.23Å; P224-P264 HydrophobicContact CG-CG 4.2Å
225	S	95.3	Very high	95.2	Very high	73 Å²	73	67.3 Å²	67.3	51%	0.51	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.2	176.8	-55.9	0	0	0	0	112.9	A227 Y228 P229	S225-A227 VanDerWaalsContact C-N 3.31Å; S225-A227 PolarHBondContact O-N 3.12Å; S225-Y228 WeakPolarHBondContact CA-O 3.43Å; S225-Y228 CarbonylContact O-C 3.55Å; S225-Y228 PolarHBondContact O-N 3.41Å; S225-P229 VanDerWaalsContact O-CA 3.23Å; S225-P229 WeakPolarHBondContact O-CA 3.24Å
226	G	94	Very high	95.3	Very high	83 Å²	83	64.2 Å²	64.2	86%	0.856	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-29.4	174.3	0	0	0	0	0	113.8	P224	P224-G226 PolarHBondContact O-N 3.38Å
227	A	92.6	Very high	95.4	Very high	26 Å²	26	60.3 Å²	60.3	22%	0.215	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-34.7	175.2	0	0	0	0	0	112	L223 P224 S225	L223-A227 HydrophobicContact CD1-CB 3.66Å; L223-A227 HydrophobicContact CG-CB 4.29Å; P224-A227 HydrophobicContact CG-CB 3.87Å; P224-A227 PolarHBondContact O-N 3.19Å; S225-A227 VanDerWaalsContact C-N 3.31Å; S225-A227 PolarHBondContact O-N 3.12Å
228	Y	94.9	Very high	95.6	Very high	25 Å²	25	56.5 Å²	56.5	10%	0.098	33%	0.332	C	S	.	.			trans	-146.1	105.9	176.3	-172.9	-98.2	0	0	0	110.4	P213 R215 L223 P224 S225 L230 V232 F233 L274	P213-Y228 HydrophobicContact CG-CD1 3.61Å; P213-Y228 HydrophobicContact CG-CE1 3.93Å; R215-Y228 VanDerWaalsContact CZ-O 3.28Å; R215-Y228 PolarHBondContact NH1-O 2.74Å; R215-Y228 PolarHBondContact NH2-O 3.32Å; L223-Y228 HydrophobicContact CD2-CG 4.21Å; P224-Y228 PolarHBondContact O-N 3.23Å; S225-Y228 WeakPolarHBondContact CA-O 3.43Å; S225-Y228 CarbonylContact O-C 3.55Å; S225-Y228 PolarHBondContact O-N 3.41Å; Y228-L230 HydrophobicContact CD1-CB 4.31Å; Y228-L230 WeakPolarHBondContact CD1-O 3.45Å; Y228-L230 HydrophobicContact CE1-CB 3.59Å; Y228-L230 HydrophobicContact CE1-CG 4.44Å; Y228-L230 WeakPolarHBondContact CE1-O 3.48Å; Y228-V232 PolarHBondContact OH-O 2.95Å; Y228-V232 VanDerWaalsContact OH-O 3.04Å; Y228-F233 AromaticContact CD1-CD1 3.93Å; Y228-F233 HydrophobicContact CD1-CD1 3.93Å; Y228-F233 AromaticContact CD1-CE1 3.63Å; Y228-F233 HydrophobicContact CD1-CE1 3.63Å; Y228-F233 HydrophobicContact CD2-CE1 4.44Å; Y228-F233 AromaticContact CE1-CD1 3.48Å; Y228-F233 HydrophobicContact CE1-CD1 3.48Å; Y228-F233 VanDerWaalsContact CE1-CD1 3.48Å; Y228-F233 AromaticContact CE1-CE1 3.71Å; Y228-F233 HydrophobicContact CE1-CE1 3.71Å; Y228-F233 HydrophobicContact CE2-CD1 4.27Å; Y228-F233 HydrophobicContact CG-CD1 4.44Å; Y228-F233 AromaticContact CG-CE1 3.99Å; Y228-F233 HydrophobicContact CG-CE1 3.99Å; Y228-F233 AromaticContact CZ-CD1 3.68Å; Y228-L274 HydrophobicContact CD2-CD1 4.43Å; Y228-L274 HydrophobicContact CD2-CD2 4.42Å; Y228-L274 HydrophobicContact CE2-CD1 4.33Å; Y228-L274 HydrophobicContact CE2-CD2 3.56Å
229	P	94.8	Very high	95.7	Very high	105 Å²	105	49.6 Å²	49.6	68%	0.682	30%	0.297	S	S	*	.			trans	-80.5	-19.9	-169.2	29.7	-35.5	0	0	0	114.2	S225	S225-P229 VanDerWaalsContact O-CA 3.23Å; S225-P229 WeakPolarHBondContact O-CA 3.24Å
230	L	96.3	Very high	95.9	Very high	106 Å²	106	48.8 Å²	48.8	56%	0.555	29%	0.292	S	S	*	.	S	Bend	trans	-74.9	155.9	-177.7	-52.5	178.1	0	0	0	111.3	R215 Y228	R215-L230 PolarHBondContact NH2-O 3.46Å; Y228-L230 HydrophobicContact CD1-CB 4.31Å; Y228-L230 WeakPolarHBondContact CD1-O 3.45Å; Y228-L230 HydrophobicContact CE1-CB 3.59Å; Y228-L230 HydrophobicContact CE1-CG 4.44Å; Y228-L230 WeakPolarHBondContact CE1-O 3.48Å
231	S	96.9	Very high	96.2	Very high	93 Å²	93	41.8 Å²	41.8	65%	0.65	26%	0.261	S	S	*	.	S	Bend	trans	-82.3	-16.1	-178.3	53	0	0	0	0	114	A212 P213	A212-S231 WeakPolarHBondContact CA-O 3.22Å; P213-S231 WeakPolarHBondContact CD-O 3.44Å
232	V	97.5	Very high	96.5	Very high	55 Å²	55	38.2 Å²	38.2	33%	0.333	25%	0.245	S	C	.	.	S	Bend	trans	-143.5	134.4	-172.8	-179.3	0	0	0	0	108.9	H210 Y228	H210-V232 VanDerWaalsContact CA-CG1 3.47Å; H210-V232 HydrophobicContact CB-CG1 3.92Å; Y228-V232 PolarHBondContact OH-O 2.95Å; Y228-V232 VanDerWaalsContact OH-O 3.04Å
233	F	97.8	Very high	96.7	Very high	10 Å²	10	34.5 Å²	34.5	4%	0.044	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-73	152.6	172.2	-62	-52.5	0	0	0	111.5	V211 P213 L223 Y228 Y236 V270	V211-F233 HydrophobicContact CB-CD2 4.25Å; V211-F233 HydrophobicContact CG1-CD2 4.16Å; V211-F233 VanDerWaalsContact O-CD2 3.31Å; V211-F233 WeakPolarHBondContact O-CD2 3.29Å; V211-F233 PolarHBondContact O-N 2.74Å; P213-F233 VanDerWaalsContact CA-CZ 3.49Å; P213-F233 HydrophobicContact CB-CE1 3.94Å; P213-F233 HydrophobicContact CB-CE2 3.99Å; P213-F233 HydrophobicContact CB-CZ 3.43Å; P213-F233 VanDerWaalsContact CB-CZ 3.43Å; P213-F233 HydrophobicContact CG-CD1 4.15Å; P213-F233 HydrophobicContact CG-CE1 3.6Å; P213-F233 HydrophobicContact CG-CE2 4.03Å; P213-F233 HydrophobicContact CG-CZ 3.54Å; L223-F233 HydrophobicContact CD2-CE1 3.65Å; L223-F233 HydrophobicContact CD2-CZ 3.67Å; Y228-F233 AromaticContact CD1-CD1 3.93Å; Y228-F233 HydrophobicContact CD1-CD1 3.93Å; Y228-F233 AromaticContact CD1-CE1 3.63Å; Y228-F233 HydrophobicContact CD1-CE1 3.63Å; Y228-F233 HydrophobicContact CD2-CE1 4.44Å; Y228-F233 AromaticContact CE1-CD1 3.48Å; Y228-F233 HydrophobicContact CE1-CD1 3.48Å; Y228-F233 VanDerWaalsContact CE1-CD1 3.48Å; Y228-F233 AromaticContact CE1-CE1 3.71Å; Y228-F233 HydrophobicContact CE1-CE1 3.71Å; Y228-F233 HydrophobicContact CE2-CD1 4.27Å; Y228-F233 HydrophobicContact CG-CD1 4.44Å; Y228-F233 AromaticContact CG-CE1 3.99Å; Y228-F233 HydrophobicContact CG-CE1 3.99Å; Y228-F233 AromaticContact CZ-CD1 3.68Å; F233-Y236 HydrophobicContact CB-CD1 4.44Å; F233-Y236 HydrophobicContact CB-CE1 4.24Å; F233-Y236 HydrophobicContact CD2-CE1 4.26Å; F233-V270 HydrophobicContact CD1-CG1 3.48Å; F233-V270 VanDerWaalsContact CD1-CG1 3.48Å; F233-V270 HydrophobicContact CD2-CG1 4.03Å; F233-V270 HydrophobicContact CD2-CG2 3.9Å; F233-V270 HydrophobicContact CE1-CG1 3.43Å; F233-V270 VanDerWaalsContact CE1-CG1 3.43Å; F233-V270 HydrophobicContact CE2-CG1 3.99Å; F233-V270 HydrophobicContact CE2-CG2 3.77Å; F233-V270 HydrophobicContact CG-CG1 3.78Å; F233-V270 HydrophobicContact CG-CG2 4.41Å; F233-V270 HydrophobicContact CZ-CG1 3.69Å; F233-V270 HydrophobicContact CZ-CG2 4.19Å
234	P	97.4	Very high	96.8	Very high	25 Å²	25	34.4 Å²	34.4	16%	0.162	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-60.2	154.7	161.7	30.3	-35.1	0	0	0	109.5	Y236 L274 Y277	P234-Y236 WeakPolarHBondContact O-CD1 3.48Å; P234-L274 HydrophobicContact CG-CD2 3.76Å; P234-L274 HydrophobicContact CG-CG 4.41Å; P234-Y277 HydrophobicContact CB-CD2 3.76Å; P234-Y277 HydrophobicContact CB-CG 3.84Å; P234-Y277 HydrophobicContact CG-CG 4.27Å
235	D	98.3	Very high	96.9	Very high	55 Å²	55	33.3 Å²	33.3	29%	0.294	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-59.3	142.3	177.7	-59.2	-23.8	0	0	0	111.1	V207 H208 L209 H210 P283	V207-D235 HydrophobicContact CG1-CB 4.06Å; H208-D235 WeakPolarHBondContact O-CA 3.27Å; L209-D235 WeakPolarHBondContact CA-OD1 3.12Å; L209-D235 HydrophobicContact CD2-CB 4.12Å; L209-D235 VanDerWaalsContact CD2-CG 3.45Å; L209-D235 WeakPolarHBondContact CD2-OD2 3.39Å; H210-D235 PolarHBondContact N-OD1 2.93Å; D235-P283 HydrophobicContact CB-CG 3.76Å; D235-P283 WeakPolarHBondContact O-CG 3.3Å
236	Y	98.4	Very high	96.8	Very high	15 Å²	15	34.7 Å²	34.7	6%	0.059	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	155.8	-176.1	63.7	-86.5	0	0	0	111.9	V207 H208 V211 F233 P234 D269 V270	V207-Y236 CarbonylContact C-O 3.58Å; V207-Y236 WeakPolarHBondContact CA-O 3.48Å; H208-Y236 HydrophobicContact CB-CD1 4.27Å; H208-Y236 HydrophobicContact CB-CD2 4.27Å; H208-Y236 HydrophobicContact CB-CE1 3.91Å; H208-Y236 HydrophobicContact CB-CE2 3.9Å; H208-Y236 HydrophobicContact CB-CG 4.44Å; H208-Y236 AromaticContact CD2-CE2 3.65Å; H208-Y236 AromaticContact CG-CE2 3.99Å; H208-Y236 PolarHBondContact N-O 2.73Å; H208-Y236 PolarHBondContact O-N 3.07Å; V211-Y236 HydrophobicContact CB-CE1 4.07Å; V211-Y236 HydrophobicContact CG2-CE1 4.23Å; F233-Y236 HydrophobicContact CB-CD1 4.44Å; F233-Y236 HydrophobicContact CB-CE1 4.24Å; F233-Y236 HydrophobicContact CD2-CE1 4.26Å; P234-Y236 WeakPolarHBondContact O-CD1 3.48Å; Y236-D269 HydrophobicContact CD2-CB 3.85Å; Y236-D269 HydrophobicContact CE2-CB 4Å; Y236-D269 WeakPolarHBondContact CE2-OD2 3.37Å; Y236-V270 HydrophobicContact CE1-CG2 3.96Å; Y236-V270 HydrophobicContact CE2-CG2 4.07Å
237	C	98.4	Very high	96.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	140	173.2	-63.1	0	0	0	0	110	Y203 R206	Y203-C237 HydrophobicContact CD2-CB 4.33Å; Y203-C237 HydrophobicContact CE1-CB 4.31Å; Y203-C237 HydrophobicContact CE2-CB 3.56Å; Y203-C237 WeakPolarHBondContact OH-CB 3Å; Y203-C237 PolarHBondContact OH-N 3.05Å; Y203-C237 VanDerWaalsContact OH-N 3.08Å; R206-C237 CarbonylContact O-C 3.31Å; R206-C237 WeakPolarHBondContact O-CA 3.41Å
238	S	97.7	Very high	97	Very high	5 Å²	5	31.4 Å²	31.4	4%	0.035	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.9	138	174.2	-171.2	0	0	0	0	111.8	R206 H208 T240	R206-S238 WeakPolarHBondContact O-CB 3.4Å; R206-S238 PolarHBondContact O-N 3.45Å; H208-S238 WeakPolarHBondContact NE2-CB 3.3Å; H208-S238 PolarHBondContact NE2-OG 3.2Å; S238-T240 PolarHBondContact O-N 3.37Å; S238-T240 VanDerWaalsContact O-N 3.13Å
239	G	96.4	Very high	97.2	Very high	8 Å²	8	30.8 Å²	30.8	8%	0.082	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	-22.6	179.2	0	0	0	0	0	114.4	K174 A241 D269	K174-G239 WeakPolarHBondContact CD-O 3.35Å; K174-G239 PolarHBondContact NZ-O 2.99Å; G239-A241 PolarHBondContact O-N 3.33Å; G239-D269 PolarHBondContact N-OD2 3.46Å; G239-D269 VanDerWaalsContact N-OD2 3.16Å
240	T	97.2	Very high	97.2	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	-44.6	-173.3	65.1	0	0	0	0	112.9	D176 S238 G291 H309	D176-T240 PolarHBondContact N-O 2.91Å; D176-T240 WeakPolarHBondContact OD2-CA 3.46Å; S238-T240 PolarHBondContact O-N 3.37Å; S238-T240 VanDerWaalsContact O-N 3.13Å; T240-G291 WeakPolarHBondContact CG2-O 3.37Å; T240-G291 PolarHBondContact OG1-O 2.84Å; T240-H309 HydrophobicContact CG2-CB 3.99Å; T240-H309 VanDerWaalsContact CG2-CD2 3.5Å; T240-H309 WeakPolarHBondContact CG2-CD2 3.41Å; T240-H309 VanDerWaalsContact CG2-CG 3.47Å
241	A	98.5	Very high	97.3	Very high	1 Å²	1	29 Å²	29	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	140.7	168.2	0	0	0	0	0	111.8	K174 G239 F289	K174-A241 VanDerWaalsContact O-CA 3.23Å; K174-A241 WeakPolarHBondContact O-CA 3.43Å; G239-A241 PolarHBondContact O-N 3.33Å; A241-F289 HydrophobicContact CB-CD1 4.04Å; A241-F289 HydrophobicContact CB-CE1 4.13Å; A241-F289 WeakPolarHBondContact O-CD1 3.35Å
242	Y	98.7	Very high	97.4	Very high	1 Å²	1	24.6 Å²	24.6	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	160.5	172.3	55.6	-107.7	0	0	0	111.6	A173 K174 Y203 L204 F244 E268	A173-Y242 CarbonylContact C-O 3.53Å; A173-Y242 WeakPolarHBondContact CA-O 3.46Å; K174-Y242 HydrophobicContact CB-CD1 4.48Å; K174-Y242 HydrophobicContact CB-CD2 3.8Å; K174-Y242 HydrophobicContact CB-CE1 4.11Å; K174-Y242 HydrophobicContact CB-CE2 3.3Å; K174-Y242 HydrophobicContact CB-CG 4.35Å; K174-Y242 VanDerWaalsContact CB-CZ 3.49Å; K174-Y242 HydrophobicContact CD-CD1 4.27Å; K174-Y242 HydrophobicContact CD-CE1 3.68Å; K174-Y242 HydrophobicContact CD-CE2 4.46Å; K174-Y242 HydrophobicContact CG-CE1 4.12Å; K174-Y242 HydrophobicContact CG-CE2 4.03Å; K174-Y242 PolarHBondContact N-O 2.92Å; K174-Y242 PolarHBondContact O-N 2.74Å; Y203-Y242 HydrophobicContact CE2-CD1 4.45Å; Y203-Y242 AromaticContact CE2-CD2 3.98Å; Y203-Y242 HydrophobicContact CE2-CD2 3.98Å; Y203-Y242 AromaticContact CE2-CG 3.85Å; Y203-Y242 HydrophobicContact CE2-CG 3.85Å; L204-Y242 CarbonylContact O-C 3.57Å; L204-Y242 VanDerWaalsContact O-CA 3.25Å; L204-Y242 WeakPolarHBondContact O-CA 3.33Å; L204-Y242 WeakPolarHBondContact O-CB 3.48Å; Y242-F244 HydrophobicContact CD2-CD2 4.11Å; Y242-F244 AromaticContact CD2-CE2 3.67Å; Y242-F244 HydrophobicContact CD2-CE2 3.67Å; Y242-F244 HydrophobicContact CD2-CZ 4.16Å; Y242-F244 HydrophobicContact CE2-CD2 4.01Å; Y242-F244 AromaticContact CE2-CE2 3.35Å; Y242-F244 HydrophobicContact CE2-CE2 3.35Å; Y242-F244 HydrophobicContact CE2-CZ 4.06Å; Y242-E268 PolarHBondContact OH-OE1 3.42Å
243	V	98.4	Very high	97.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.5	-176.5	-176.1	0	0	0	0	110.8	F171 L172 A173 L186 Y203 L204 F289	F171-V243 HydrophobicContact CB-CG1 4.05Å; F171-V243 HydrophobicContact CD1-CG1 4.05Å; F171-V243 HydrophobicContact CG-CG1 4.39Å; L172-V243 CarbonylContact O-C 3.51Å; L172-V243 VanDerWaalsContact O-CA 3.26Å; L172-V243 WeakPolarHBondContact O-CA 3.41Å; A173-V243 HydrophobicContact CB-CG2 4.05Å; L186-V243 HydrophobicContact CD1-CG2 4.03Å; L186-V243 HydrophobicContact CD2-CG2 3.77Å; Y203-V243 CarbonylContact C-O 3.31Å; Y203-V243 WeakPolarHBondContact CA-O 3.37Å; L204-V243 HydrophobicContact CB-CB 4.23Å; L204-V243 PolarHBondContact N-O 2.9Å; L204-V243 PolarHBondContact O-N 3.43Å; V243-F289 HydrophobicContact CG2-CE1 4.37Å; V243-F289 HydrophobicContact CG2-CZ 4.01Å
244	F	97.9	Very high	97.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	137.4	169.5	-69.3	-62.9	0	0	0	111.2	L159 F171 L172 L202 Y203 Y242 A248 L249 V252 V272	L159-F244 HydrophobicContact CD2-CD2 4.25Å; L159-F244 HydrophobicContact CD2-CE2 4.01Å; F171-F244 VanDerWaalsContact CA-O 3.26Å; F171-F244 WeakPolarHBondContact CA-O 3.39Å; L172-F244 HydrophobicContact CD2-CD2 4.46Å; L172-F244 PolarHBondContact N-O 3.1Å; L172-F244 PolarHBondContact O-N 3.09Å; L202-F244 CarbonylContact O-C 3.49Å; L202-F244 VanDerWaalsContact O-CA 3.27Å; L202-F244 WeakPolarHBondContact O-CA 3.47Å; Y203-F244 HydrophobicContact CD1-CE1 4.21Å; Y203-F244 AromaticContact CD2-CD1 3.75Å; Y203-F244 HydrophobicContact CD2-CD1 3.75Å; Y203-F244 AromaticContact CD2-CE1 3.09Å; Y203-F244 HydrophobicContact CD2-CE1 3.09Å; Y203-F244 HydrophobicContact CD2-CE2 4.5Å; Y203-F244 AromaticContact CD2-CZ 3.54Å; Y203-F244 HydrophobicContact CD2-CZ 3.54Å; Y203-F244 AromaticContact CE2-CE1 3.65Å; Y203-F244 HydrophobicContact CE2-CE1 3.65Å; Y203-F244 HydrophobicContact CE2-CE2 4.47Å; Y203-F244 AromaticContact CE2-CZ 3.57Å; Y203-F244 HydrophobicContact CE2-CZ 3.57Å; Y203-F244 HydrophobicContact CG-CD1 4.1Å; Y203-F244 AromaticContact CG-CE1 3.43Å; Y203-F244 HydrophobicContact CG-CE1 3.43Å; Y203-F244 VanDerWaalsContact CG-CE1 3.43Å; Y203-F244 HydrophobicContact CG-CZ 4.2Å; Y242-F244 HydrophobicContact CD2-CD2 4.11Å; Y242-F244 AromaticContact CD2-CE2 3.67Å; Y242-F244 HydrophobicContact CD2-CE2 3.67Å; Y242-F244 HydrophobicContact CD2-CZ 4.16Å; Y242-F244 HydrophobicContact CE2-CD2 4.01Å; Y242-F244 AromaticContact CE2-CE2 3.35Å; Y242-F244 HydrophobicContact CE2-CE2 3.35Å; Y242-F244 HydrophobicContact CE2-CZ 4.06Å; F244-A248 HydrophobicContact CB-CB 4.43Å; F244-A248 HydrophobicContact CD1-CB 3.96Å; F244-L249 HydrophobicContact CB-CB 3.94Å; F244-V252 HydrophobicContact CD1-CG2 4.44Å; F244-V252 HydrophobicContact CE1-CB 4.4Å; F244-V252 HydrophobicContact CE1-CG1 4.37Å; F244-V252 HydrophobicContact CE1-CG2 3.86Å; F244-V252 HydrophobicContact CZ-CB 4.46Å; F244-V252 HydrophobicContact CZ-CG1 4.01Å; F244-V252 HydrophobicContact CZ-CG2 4.32Å; F244-V272 HydrophobicContact CE2-CG1 4.25Å; F244-V272 HydrophobicContact CZ-CG1 3.58Å
245	S	96.4	Very high	97.3	Very high	4 Å²	4	25.7 Å²	25.7	3%	0.028	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	161	155.9	65.6	0	0	0	0	109.9	G200 L202 S247 A248 L249	G200-S245 PolarHBondContact O-OG 2.86Å; L202-S245 PolarHBondContact N-OG 3Å; L202-S245 PolarHBondContact O-N 3.44Å; S245-S247 VanDerWaalsContact C-N 3.3Å; S245-S247 PolarHBondContact O-N 3.18Å; S245-S247 PolarHBondContact OG-OG 2.95Å; S245-S247 VanDerWaalsContact OG-OG 3.08Å; S245-A248 PolarHBondContact O-N 2.95Å; S245-A248 PolarHBondContact OG-N 3.17Å; S245-L249 WeakPolarHBondContact O-CB 3.29Å; S245-L249 PolarHBondContact O-N 3.41Å
246	R	94.9	Very high	97.1	Very high	102 Å²	102	23.1 Å²	23.1	39%	0.385	12%	0.12	S	C	.	.	H	α-helix	trans	-51.2	-46.4	177	-174.2	-173	-60	167.6	12.3	113.5	P167 Q168 A169 H170 L249 L250	P167-R246 WeakPolarHBondContact O-CD 3.41Å; P167-R246 PolarHBondContact O-NE 3.17Å; Q168-R246 PolarHBondContact O-NH2 2.92Å; A169-R246 PolarHBondContact O-NE 2.94Å; A169-R246 PolarHBondContact O-NH2 3.33Å; H170-R246 PolarHBondContact CD2-NH2 3.43Å; H170-R246 PolarHBondContact NE2-NH2 3.02Å; H170-R246 PolarHBondContact O-N 2.97Å; R246-L249 PolarHBondContact O-N 3.06Å; R246-L250 PolarHBondContact O-N 3.25Å
247	S	94.3	Very high	96.8	Very high	41 Å²	41	25.3 Å²	25.3	29%	0.287	14%	0.138	S	C	.	.	H	α-helix	trans	-65	-45.1	-179.9	46.3	0	0	0	0	111.7	G200 D201 S245 L250 K251	G200-S247 PolarHBondContact O-OG 3.1Å; D201-S247 WeakPolarHBondContact OD1-CB 3.23Å; D201-S247 PolarHBondContact OD1-OG 3.26Å; S245-S247 VanDerWaalsContact C-N 3.3Å; S245-S247 PolarHBondContact O-N 3.18Å; S245-S247 PolarHBondContact OG-OG 2.95Å; S245-S247 VanDerWaalsContact OG-OG 3.08Å; S247-L250 PolarHBondContact O-N 3.08Å; S247-K251 WeakPolarHBondContact O-CG 3.29Å; S247-K251 PolarHBondContact O-N 3.35Å; S247-K251 VanDerWaalsContact O-N 3.11Å
248	A	96.6	Very high	96.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.2	-46.5	175.2	0	0	0	0	0	111.7	D201 L202 F244 S245 L250 K251 V252 V281	D201-A248 HydrophobicContact CB-CB 4.03Å; L202-A248 WeakPolarHBondContact O-CB 3.37Å; F244-A248 HydrophobicContact CB-CB 4.43Å; F244-A248 HydrophobicContact CD1-CB 3.96Å; S245-A248 PolarHBondContact O-N 2.95Å; S245-A248 PolarHBondContact OG-N 3.17Å; A248-L250 VanDerWaalsContact C-N 3.29Å; A248-L250 PolarHBondContact O-N 3.42Å; A248-K251 PolarHBondContact O-N 2.73Å; A248-V252 WeakPolarHBondContact O-CB 3.35Å; A248-V252 VanDerWaalsContact O-CG2 3.22Å; A248-V252 WeakPolarHBondContact O-CG2 3.3Å; A248-V252 PolarHBondContact O-N 2.73Å; A248-V281 HydrophobicContact CB-CG1 4.05Å
249	L	97.3	Very high	96.2	Very high	11 Å²	11	30.8 Å²	30.8	6%	0.058	18%	0.18	C	C	.	.	H	α-helix	trans	-54.2	-47.4	175.8	171	59.2	0	0	0	111	L159 A162 L172 F244 S245 R246 K251 A253	L159-L249 HydrophobicContact CD2-CD1 3.61Å; A162-L249 HydrophobicContact CB-CD2 4.06Å; L172-L249 HydrophobicContact CB-CD2 4.05Å; L172-L249 HydrophobicContact CD2-CD1 3.58Å; L172-L249 HydrophobicContact CD2-CD2 4.06Å; L172-L249 HydrophobicContact CD2-CG 4.41Å; F244-L249 HydrophobicContact CB-CB 3.94Å; S245-L249 WeakPolarHBondContact O-CB 3.29Å; S245-L249 PolarHBondContact O-N 3.41Å; R246-L249 PolarHBondContact O-N 3.06Å; L249-K251 PolarHBondContact O-N 2.77Å; L249-A253 HydrophobicContact CD1-CB 4.43Å; L249-A253 WeakPolarHBondContact O-CB 3.14Å; L249-A253 PolarHBondContact O-N 3.18Å
250	L	96.4	Very high	95.8	Very high	87 Å²	87	35.9 Å²	35.9	46%	0.455	21%	0.212	S	C	.	.	H	α-helix	trans	-58.8	-50	179.1	177.9	60.7	0	0	0	111.4	R163 R246 S247 A248 L254	R163-L250 HydrophobicContact CG-CD1 4.08Å; R246-L250 PolarHBondContact O-N 3.25Å; S247-L250 PolarHBondContact O-N 3.08Å; A248-L250 VanDerWaalsContact C-N 3.29Å; A248-L250 PolarHBondContact O-N 3.42Å; L250-L254 HydrophobicContact CD1-CD1 3.96Å; L250-L254 HydrophobicContact CD1-CG 4.31Å; L250-L254 HydrophobicContact CG-CD1 4.17Å; L250-L254 WeakPolarHBondContact O-CB 3.4Å; L250-L254 VanDerWaalsContact O-CG 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.35Å; L250-L254 PolarHBondContact O-N 3.01Å; L250-L254 VanDerWaalsContact O-N 3.08Å
251	K	97.4	Very high	95.4	Very high	88 Å²	88	38 Å²	38	38%	0.383	22%	0.223	S	C	.	.	H	α-helix	trans	-66.2	-47.3	-177.7	-65.3	178.5	178.9	178.1	0	112.2	D201 S247 A248 L249 L254 A255 A279 V281	D201-K251 VanDerWaalsContact CG-NZ 3.25Å; D201-K251 WeakPolarHBondContact OD1-CD 3.37Å; D201-K251 WeakPolarHBondContact OD1-CE 3.02Å; D201-K251 IonicContact OD1-NZ 3.72Å; D201-K251 PolarHBondContact OD1-NZ 2.95Å; D201-K251 VanDerWaalsContact OD1-NZ 3.14Å; D201-K251 IonicContact OD2-NZ 3.17Å; D201-K251 PolarHBondContact OD2-NZ 3.04Å; S247-K251 WeakPolarHBondContact O-CG 3.29Å; S247-K251 PolarHBondContact O-N 3.35Å; S247-K251 VanDerWaalsContact O-N 3.11Å; A248-K251 PolarHBondContact O-N 2.73Å; L249-K251 PolarHBondContact O-N 2.77Å; K251-L254 PolarHBondContact O-N 2.9Å; K251-A255 WeakPolarHBondContact O-CB 3.41Å; K251-A255 PolarHBondContact O-N 3.45Å; K251-A279 HydrophobicContact CB-CB 3.95Å; K251-V281 HydrophobicContact CB-CG2 4.15Å; K251-V281 HydrophobicContact CD-CG2 4.03Å
252	V	98.2	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.4	-44.4	-179.7	175.9	0	0	0	0	110.7	L159 F244 A248 L254 A255 A256 V272 C275 A276 V281	L159-V252 HydrophobicContact CD1-CG1 4.37Å; F244-V252 HydrophobicContact CD1-CG2 4.44Å; F244-V252 HydrophobicContact CE1-CB 4.4Å; F244-V252 HydrophobicContact CE1-CG1 4.37Å; F244-V252 HydrophobicContact CE1-CG2 3.86Å; F244-V252 HydrophobicContact CZ-CB 4.46Å; F244-V252 HydrophobicContact CZ-CG1 4.01Å; F244-V252 HydrophobicContact CZ-CG2 4.32Å; A248-V252 WeakPolarHBondContact O-CB 3.35Å; A248-V252 VanDerWaalsContact O-CG2 3.22Å; A248-V252 WeakPolarHBondContact O-CG2 3.3Å; A248-V252 PolarHBondContact O-N 2.73Å; V252-L254 VanDerWaalsContact C-N 3.34Å; V252-L254 PolarHBondContact O-N 2.81Å; V252-A255 PolarHBondContact O-N 3.21Å; V252-A256 WeakPolarHBondContact O-CB 3.37Å; V252-A256 PolarHBondContact O-N 3.02Å; V252-V272 HydrophobicContact CG1-CG1 4.44Å; V252-C275 HydrophobicContact CG1-CB 4.09Å; V252-A276 HydrophobicContact CG2-CB 4.07Å; V252-V281 HydrophobicContact CG2-CB 4.33Å; V252-V281 HydrophobicContact CG2-CG1 4.49Å; V252-V281 HydrophobicContact CG2-CG2 4.29Å
253	A	97.3	Very high	94.3	Very high	5 Å²	5	45.8 Å²	45.8	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-65.8	-35.3	178.7	0	0	0	0	0	112.6	L159 R163 L249 S257	L159-A253 HydrophobicContact CB-CB 4.06Å; R163-A253 HydrophobicContact CB-CB 4.28Å; L249-A253 HydrophobicContact CD1-CB 4.43Å; L249-A253 WeakPolarHBondContact O-CB 3.14Å; L249-A253 PolarHBondContact O-N 3.18Å; A253-S257 WeakPolarHBondContact O-CB 3.24Å; A253-S257 PolarHBondContact O-N 2.78Å; A253-S257 PolarHBondContact O-OG 2.86Å
254	L	96.4	Very high	94	Very high	85 Å²	85	48 Å²	48	45%	0.445	29%	0.287	S	S	.	.	H	α-helix	trans	-66.3	-47.9	173.1	-73.9	171.8	0	0	0	111.4	L250 K251 V252 A256 S257 A258	L250-L254 HydrophobicContact CD1-CD1 3.96Å; L250-L254 HydrophobicContact CD1-CG 4.31Å; L250-L254 HydrophobicContact CG-CD1 4.17Å; L250-L254 WeakPolarHBondContact O-CB 3.4Å; L250-L254 VanDerWaalsContact O-CG 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.35Å; L250-L254 PolarHBondContact O-N 3.01Å; L250-L254 VanDerWaalsContact O-N 3.08Å; K251-L254 PolarHBondContact O-N 2.9Å; V252-L254 VanDerWaalsContact C-N 3.34Å; V252-L254 PolarHBondContact O-N 2.81Å; L254-A256 VanDerWaalsContact C-N 3.3Å; L254-A256 PolarHBondContact O-N 3.48Å; L254-S257 PolarHBondContact O-N 3.35Å; L254-S257 PolarHBondContact O-OG 3.39Å; L254-A258 PolarHBondContact O-N 3.14Å; L254-A258 VanDerWaalsContact O-N 3.12Å
255	A	97.3	Very high	93.7	Very high	22 Å²	22	49.6 Å²	49.6	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-58.5	-43.4	175.5	0	0	0	0	0	111.7	K251 V252 S257 A258 S259 C275 A279	K251-A255 WeakPolarHBondContact O-CB 3.41Å; K251-A255 PolarHBondContact O-N 3.45Å; V252-A255 PolarHBondContact O-N 3.21Å; A255-S257 PolarHBondContact O-N 3.39Å; A255-A258 CarbonylContact O-C 3.16Å; A255-A258 PolarHBondContact O-N 3.16Å; A255-S259 PolarHBondContact O-N 3.34Å; A255-C275 HydrophobicContact CB-CB 4.25Å; A255-C275 WeakPolarHBondContact CB-O 3.4Å; A255-A279 HydrophobicContact CB-CB 4.1Å
256	A	95.3	Very high	93.5	Very high	1 Å²	1	50 Å²	50	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-41	177.7	0	0	0	0	0	112.4	L156 L159 V252 L254 A258 S259 F271 C275	L156-A256 HydrophobicContact CD2-CB 3.59Å; L159-A256 HydrophobicContact CD1-CB 4.43Å; V252-A256 WeakPolarHBondContact O-CB 3.37Å; V252-A256 PolarHBondContact O-N 3.02Å; L254-A256 VanDerWaalsContact C-N 3.3Å; L254-A256 PolarHBondContact O-N 3.48Å; A256-A258 VanDerWaalsContact C-N 3.26Å; A256-A258 PolarHBondContact O-N 2.86Å; A256-S259 PolarHBondContact O-N 3.09Å; A256-F271 HydrophobicContact CB-CE1 4.01Å; A256-F271 HydrophobicContact CB-CZ 4.35Å; A256-C275 WeakPolarHBondContact CA-SG 3.46Å; A256-C275 HydrophobicContact CB-CB 4.2Å
257	S	91.7	Very high	93.6	Very high	62 Å²	62	46.3 Å²	46.3	43%	0.434	29%	0.286	S	S	.	.	H	α-helix	trans	-68.2	-24.5	176.6	69.4	0	0	0	0	114	A253 L254 A255	A253-S257 WeakPolarHBondContact O-CB 3.24Å; A253-S257 PolarHBondContact O-N 2.78Å; A253-S257 PolarHBondContact O-OG 2.86Å; L254-S257 PolarHBondContact O-N 3.35Å; L254-S257 PolarHBondContact O-OG 3.39Å; A255-S257 PolarHBondContact O-N 3.39Å
258	A	92.8	Very high	93.7	Very high	81 Å²	81	45 Å²	45	67%	0.669	28%	0.276	S	S	*	.	H	α-helix	trans	-95.2	-9.6	178	0	0	0	0	0	113	L254 A255 A256	L254-A258 PolarHBondContact O-N 3.14Å; L254-A258 VanDerWaalsContact O-N 3.12Å; A255-A258 CarbonylContact O-C 3.16Å; A255-A258 PolarHBondContact O-N 3.16Å; A256-A258 VanDerWaalsContact C-N 3.26Å; A256-A258 PolarHBondContact O-N 2.86Å
259	S	90.1	Very high	93.7	Very high	38 Å²	38	46.4 Å²	46.4	27%	0.266	28%	0.283	S	S	.	.	S	Bend	trans	-73.4	130.8	-176.6	-172.8	0	0	0	0	110.6	A255 A256 L261	A255-S259 PolarHBondContact O-N 3.34Å; A256-S259 PolarHBondContact O-N 3.09Å; S259-L261 PolarHBondContact O-N 2.72Å
260	P	88.4	Confident	93.7	Very high	116 Å²	116	46 Å²	46	75%	0.753	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-62.8	139.1	167	28.1	-32.7	0	0	0	109.2
261	L	88.2	Confident	93.8	Very high	53 Å²	53	42 Å²	42	28%	0.277	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-93	122.9	175.8	-61	-177.5	0	0	0	109.3	L153 L156 S259 L265 F271	L153-L261 HydrophobicContact CD2-CD1 3.88Å; L156-L261 HydrophobicContact CD1-CD1 4.32Å; L156-L261 HydrophobicContact CD1-CD2 3.85Å; S259-L261 PolarHBondContact O-N 2.72Å; L261-L265 HydrophobicContact CB-CD2 3.88Å; L261-L265 HydrophobicContact CD1-CD2 4.29Å; L261-L265 HydrophobicContact CD2-CD2 4.07Å; L261-L265 HydrophobicContact CG-CD2 4.29Å; L261-F271 HydrophobicContact CD2-CE2 3.8Å; L261-F271 HydrophobicContact CD2-CZ 3.99Å
262	S	88.4	Confident	93.8	Very high	28 Å²	28	37.9 Å²	37.9	20%	0.196	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-78.3	164.4	172.9	62.2	0	0	0	0	111.3	P264 L265 P266	S262-P264 CarbonylContact C-O 3.24Å; S262-P264 VanDerWaalsContact C-O 3.24Å; S262-P264 CarbonylContact O-C 3.54Å; S262-P264 PolarHBondContact OG-O 2.68Å; S262-L265 PolarHBondContact O-N 3.06Å; S262-P266 WeakPolarHBondContact OG-CD 3.4Å
263	T	87.4	Confident	93.8	Very high	138 Å²	138	37.9 Å²	37.9	85%	0.847	24%	0.242	S	C	*	.	S	Bend	trans	-123.4	119.3	166.8	-59.1	0	0	0	0	108.8
264	P	90.3	Very high	93.8	Very high	47 Å²	47	39.7 Å²	39.7	31%	0.305	25%	0.251	S	S	.	.	S	Bend	cis	-64.6	161.8	-3.8	30.7	-36.1	0	0	0	112.7	Y222 P224 S262	Y222-P264 HydrophobicContact CD1-CG 4.46Å; P224-P264 HydrophobicContact CG-CG 4.2Å; S262-P264 CarbonylContact C-O 3.24Å; S262-P264 VanDerWaalsContact C-O 3.24Å; S262-P264 CarbonylContact O-C 3.54Å; S262-P264 PolarHBondContact OG-O 2.68Å
265	L	91.6	Very high	93.9	Very high	33 Å²	33	35.8 Å²	35.8	17%	0.173	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-65.3	142.7	170.4	-71.1	170.9	0	0	0	109.3	T152 L153 L261 S262	T152-L265 HydrophobicContact CG2-CD2 4.36Å; L153-L265 HydrophobicContact CD1-CD1 4.31Å; L153-L265 HydrophobicContact CD2-CD1 4.2Å; L153-L265 HydrophobicContact CG-CD1 3.8Å; L261-L265 HydrophobicContact CB-CD2 3.88Å; L261-L265 HydrophobicContact CD1-CD2 4.29Å; L261-L265 HydrophobicContact CD2-CD2 4.07Å; L261-L265 HydrophobicContact CG-CD2 4.29Å; S262-L265 PolarHBondContact O-N 3.06Å
266	P	93.9	Very high	94	Very high	12 Å²	12	34.8 Å²	34.8	8%	0.078	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-61.8	154.6	169.9	-16.2	31.1	0	0	0	110.2	T152 L223 S262 E268 V270 F271	T152-P266 PolarHBondContact OG1-O 2.87Å; L223-P266 HydrophobicContact CD1-CB 4.37Å; L223-P266 HydrophobicContact CD1-CG 4.41Å; L223-P266 HydrophobicContact CD2-CB 4.27Å; S262-P266 WeakPolarHBondContact OG-CD 3.4Å; P266-E268 PolarHBondContact O-N 2.74Å; P266-V270 HydrophobicContact CB-CG1 4.33Å; P266-F271 HydrophobicContact CB-CB 4.28Å; P266-F271 HydrophobicContact CG-CD2 4.4Å
267	P	95.6	Very high	94.1	Very high	24 Å²	24	43 Å²	43	16%	0.156	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-47.5	141.8	163.9	-26.2	35	0	0	0	110.6	H221 D269 V270 F271	H221-P267 HydrophobicContact CB-CG 4.25Å; P267-D269 VanDerWaalsContact C-N 3.34Å; P267-D269 PolarHBondContact O-N 2.7Å; P267-V270 HydrophobicContact CB-CB 4.27Å; P267-V270 HydrophobicContact CB-CG2 4.04Å; P267-V270 HydrophobicContact CG-CG2 4.31Å; P267-V270 WeakPolarHBondContact O-CB 3.15Å; P267-V270 PolarHBondContact O-N 2.92Å; P267-F271 PolarHBondContact O-N 2.96Å
268	E	96.4	Very high	94.4	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.065	27%	0.265	C	S	.	.	H	α-helix	trans	-58.8	-42.9	-169.1	176.6	-85.4	160.7	0	0	113.4	L151 T152 T155 K174 Y242 P266 F271 V272	L151-E268 HydrophobicContact CB-CB 3.89Å; L151-E268 HydrophobicContact CB-CG 4.46Å; T152-E268 WeakPolarHBondContact OG1-CA 3.23Å; T155-E268 VanDerWaalsContact CB-CG 3.49Å; T155-E268 VanDerWaalsContact CB-OE1 3.29Å; T155-E268 WeakPolarHBondContact CB-OE1 3.31Å; T155-E268 HydrophobicContact CG2-CG 4.09Å; T155-E268 WeakPolarHBondContact CG2-OE1 3.35Å; T155-E268 WeakPolarHBondContact OG1-CG 3.25Å; T155-E268 PolarHBondContact OG1-OE1 3.49Å; K174-E268 IonicContact NZ-OE2 2.8Å; Y242-E268 PolarHBondContact OH-OE1 3.42Å; P266-E268 PolarHBondContact O-N 2.74Å; E268-F271 WeakPolarHBondContact O-CB 3.42Å; E268-F271 PolarHBondContact O-N 3.4Å; E268-V272 WeakPolarHBondContact O-CG2 3.42Å; E268-V272 PolarHBondContact O-N 3.19Å; E268-V272 WeakPolarHBondContact OE1-CG2 3.23Å
269	D	97.4	Very high	94.7	Very high	29 Å²	29	41.2 Å²	41.2	16%	0.155	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-37.9	-179.7	56.2	-4.7	0	0	0	112.5	Y236 G239 P267 V272 G273	Y236-D269 HydrophobicContact CD2-CB 3.85Å; Y236-D269 HydrophobicContact CE2-CB 4Å; Y236-D269 WeakPolarHBondContact CE2-OD2 3.37Å; G239-D269 PolarHBondContact N-OD2 3.46Å; G239-D269 VanDerWaalsContact N-OD2 3.16Å; P267-D269 VanDerWaalsContact C-N 3.34Å; P267-D269 PolarHBondContact O-N 2.7Å; D269-V272 PolarHBondContact O-N 3.2Å; D269-G273 PolarHBondContact O-N 3.47Å
270	V	97.6	Very high	95	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-47	168.5	175	0	0	0	0	110.6	F233 Y236 P266 P267 V272 G273 L274	F233-V270 HydrophobicContact CD1-CG1 3.48Å; F233-V270 VanDerWaalsContact CD1-CG1 3.48Å; F233-V270 HydrophobicContact CD2-CG1 4.03Å; F233-V270 HydrophobicContact CD2-CG2 3.9Å; F233-V270 HydrophobicContact CE1-CG1 3.43Å; F233-V270 VanDerWaalsContact CE1-CG1 3.43Å; F233-V270 HydrophobicContact CE2-CG1 3.99Å; F233-V270 HydrophobicContact CE2-CG2 3.77Å; F233-V270 HydrophobicContact CG-CG1 3.78Å; F233-V270 HydrophobicContact CG-CG2 4.41Å; F233-V270 HydrophobicContact CZ-CG1 3.69Å; F233-V270 HydrophobicContact CZ-CG2 4.19Å; Y236-V270 HydrophobicContact CE1-CG2 3.96Å; Y236-V270 HydrophobicContact CE2-CG2 4.07Å; P266-V270 HydrophobicContact CB-CG1 4.33Å; P267-V270 HydrophobicContact CB-CB 4.27Å; P267-V270 HydrophobicContact CB-CG2 4.04Å; P267-V270 HydrophobicContact CG-CG2 4.31Å; P267-V270 WeakPolarHBondContact O-CB 3.15Å; P267-V270 PolarHBondContact O-N 2.92Å; V270-V272 PolarHBondContact O-N 2.61Å; V270-G273 WeakPolarHBondContact O-CA 3.22Å; V270-G273 PolarHBondContact O-N 2.96Å; V270-G273 VanDerWaalsContact O-N 3.15Å; V270-L274 HydrophobicContact CG1-CD1 4.18Å; V270-L274 HydrophobicContact CG1-CG 4.45Å; V270-L274 WeakPolarHBondContact O-CG 3.48Å; V270-L274 PolarHBondContact O-N 3.12Å
271	F	97.5	Very high	95.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-44.3	178.8	177.6	-95.4	0	0	0	111.7	T152 L156 A256 L261 P266 P267 E268 G273 L274 C275	T152-F271 HydrophobicContact CG2-CB 3.87Å; T152-F271 HydrophobicContact CG2-CD1 3.56Å; T152-F271 HydrophobicContact CG2-CD2 3.83Å; T152-F271 HydrophobicContact CG2-CE1 4.01Å; T152-F271 HydrophobicContact CG2-CE2 4.26Å; T152-F271 HydrophobicContact CG2-CG 3.45Å; T152-F271 VanDerWaalsContact CG2-CG 3.45Å; T152-F271 HydrophobicContact CG2-CZ 4.34Å; L156-F271 HydrophobicContact CD1-CE1 4.06Å; L156-F271 HydrophobicContact CD1-CZ 4.07Å; L156-F271 HydrophobicContact CD2-CE1 3.65Å; L156-F271 HydrophobicContact CD2-CZ 3.88Å; L156-F271 HydrophobicContact CG-CE1 3.78Å; L156-F271 HydrophobicContact CG-CZ 4.2Å; A256-F271 HydrophobicContact CB-CE1 4.01Å; A256-F271 HydrophobicContact CB-CZ 4.35Å; L261-F271 HydrophobicContact CD2-CE2 3.8Å; L261-F271 HydrophobicContact CD2-CZ 3.99Å; P266-F271 HydrophobicContact CB-CB 4.28Å; P266-F271 HydrophobicContact CG-CD2 4.4Å; P267-F271 PolarHBondContact O-N 2.96Å; E268-F271 WeakPolarHBondContact O-CB 3.42Å; E268-F271 PolarHBondContact O-N 3.4Å; F271-G273 VanDerWaalsContact C-N 3.31Å; F271-G273 PolarHBondContact O-N 2.77Å; F271-L274 PolarHBondContact O-N 3.06Å; F271-C275 VanDerWaalsContact CE1-SG 3.56Å; F271-C275 PolarHBondContact O-N 3.15Å; F271-C275 PolarHBondContact O-SG 3.18Å
272	V	98.3	Very high	95.8	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-41.6	174.4	173.9	0	0	0	0	111.1	T155 Y203 F244 V252 E268 D269 V270 C275 A276	T155-V272 HydrophobicContact CG2-CG2 3.59Å; Y203-V272 HydrophobicContact CE1-CG1 4.46Å; Y203-V272 HydrophobicContact CE2-CG1 4.14Å; Y203-V272 WeakPolarHBondContact OH-CG1 3.17Å; F244-V272 HydrophobicContact CE2-CG1 4.25Å; F244-V272 HydrophobicContact CZ-CG1 3.58Å; V252-V272 HydrophobicContact CG1-CG1 4.44Å; E268-V272 WeakPolarHBondContact O-CG2 3.42Å; E268-V272 PolarHBondContact O-N 3.19Å; E268-V272 WeakPolarHBondContact OE1-CG2 3.23Å; D269-V272 PolarHBondContact O-N 3.2Å; V270-V272 PolarHBondContact O-N 2.61Å; V272-C275 PolarHBondContact O-N 3.4Å; V272-A276 WeakPolarHBondContact O-CB 3.47Å; V272-A276 PolarHBondContact O-N 2.83Å
273	G	98.3	Very high	96.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.9	-46.1	173.3	0	0	0	0	0	113.7	D269 V270 F271 C275 A276 Y277	D269-G273 PolarHBondContact O-N 3.47Å; V270-G273 WeakPolarHBondContact O-CA 3.22Å; V270-G273 PolarHBondContact O-N 2.96Å; V270-G273 VanDerWaalsContact O-N 3.15Å; F271-G273 VanDerWaalsContact C-N 3.31Å; F271-G273 PolarHBondContact O-N 2.77Å; G273-C275 VanDerWaalsContact C-N 3.34Å; G273-C275 PolarHBondContact O-N 3.45Å; G273-A276 PolarHBondContact O-N 3.35Å; G273-Y277 WeakPolarHBondContact O-CB 3.31Å; G273-Y277 PolarHBondContact O-N 2.87Å
274	L	97.9	Very high	96.6	Very high	42 Å²	42	39.2 Å²	39.2	22%	0.22	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-43.3	175.3	-68	168.9	0	0	0	111.4	Y228 P234 V270 F271 Y277 A278	Y228-L274 HydrophobicContact CD2-CD1 4.43Å; Y228-L274 HydrophobicContact CD2-CD2 4.42Å; Y228-L274 HydrophobicContact CE2-CD1 4.33Å; Y228-L274 HydrophobicContact CE2-CD2 3.56Å; P234-L274 HydrophobicContact CG-CD2 3.76Å; P234-L274 HydrophobicContact CG-CG 4.41Å; V270-L274 HydrophobicContact CG1-CD1 4.18Å; V270-L274 HydrophobicContact CG1-CG 4.45Å; V270-L274 WeakPolarHBondContact O-CG 3.48Å; V270-L274 PolarHBondContact O-N 3.12Å; F271-L274 PolarHBondContact O-N 3.06Å; L274-Y277 PolarHBondContact O-N 3.26Å; L274-A278 WeakPolarHBondContact O-CB 3.43Å; L274-A278 PolarHBondContact O-N 2.91Å
275	C	98.4	Very high	96.9	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.02	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-41.2	177.4	-64.1	0	0	0	0	111.9	V252 A255 A256 F271 V272 G273 A278 A279	V252-C275 HydrophobicContact CG1-CB 4.09Å; A255-C275 HydrophobicContact CB-CB 4.25Å; A255-C275 WeakPolarHBondContact CB-O 3.4Å; A256-C275 WeakPolarHBondContact CA-SG 3.46Å; A256-C275 HydrophobicContact CB-CB 4.2Å; F271-C275 VanDerWaalsContact CE1-SG 3.56Å; F271-C275 PolarHBondContact O-N 3.15Å; F271-C275 PolarHBondContact O-SG 3.18Å; V272-C275 PolarHBondContact O-N 3.4Å; G273-C275 VanDerWaalsContact C-N 3.34Å; G273-C275 PolarHBondContact O-N 3.45Å; C275-A278 PolarHBondContact O-N 3.17Å; C275-A279 WeakPolarHBondContact O-CB 3.09Å; C275-A279 PolarHBondContact O-N 2.75Å
276	A	98.4	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-44.8	175.9	0	0	0	0	0	111.4	Y203 V252 V272 G273 A279 G280 V281	Y203-A276 HydrophobicContact CD1-CB 3.91Å; Y203-A276 HydrophobicContact CE1-CB 4.03Å; V252-A276 HydrophobicContact CG2-CB 4.07Å; V272-A276 WeakPolarHBondContact O-CB 3.47Å; V272-A276 PolarHBondContact O-N 2.83Å; G273-A276 PolarHBondContact O-N 3.35Å; A276-A279 CarbonylContact O-C 3.56Å; A276-A279 WeakPolarHBondContact O-CB 3.46Å; A276-A279 PolarHBondContact O-N 3.34Å; A276-A279 VanDerWaalsContact O-N 3.15Å; A276-G280 PolarHBondContact O-N 2.88Å; A276-G280 VanDerWaalsContact O-N 3.11Å; A276-V281 CarbonylContact C-O 3.59Å; A276-V281 VanDerWaalsContact C-O 3.31Å; A276-V281 HydrophobicContact CB-CB 4.29Å; A276-V281 WeakPolarHBondContact CB-O 3.32Å; A276-V281 PolarHBondContact O-N 3.49Å; A276-V281 VanDerWaalsContact O-O 3.11Å
277	Y	98.1	Very high	97.1	Very high	173 Å²	173	44.2 Å²	44.2	68%	0.678	25%	0.246	S	C	*	.	H	α-helix	trans	-58.7	-49.1	174.9	-178.4	-96.5	0	0	0	111.9	P234 G273 L274 A279 G280	P234-Y277 HydrophobicContact CB-CD2 3.76Å; P234-Y277 HydrophobicContact CB-CG 3.84Å; P234-Y277 HydrophobicContact CG-CG 4.27Å; G273-Y277 WeakPolarHBondContact O-CB 3.31Å; G273-Y277 PolarHBondContact O-N 2.87Å; L274-Y277 PolarHBondContact O-N 3.26Å; Y277-A279 PolarHBondContact O-N 3.08Å; Y277-G280 PolarHBondContact O-N 2.94Å
278	A	97.9	Very high	97.1	Very high	80 Å²	80	45.2 Å²	45.2	66%	0.661	25%	0.25	S	C	*	.	H	α-helix	trans	-61.7	-32	176.7	0	0	0	0	0	112.8	L274 C275 G280	L274-A278 WeakPolarHBondContact O-CB 3.43Å; L274-A278 PolarHBondContact O-N 2.91Å; C275-A278 PolarHBondContact O-N 3.17Å; A278-G280 VanDerWaalsContact C-N 3.3Å
279	A	97.7	Very high	97.2	Very high	27 Å²	27	44.6 Å²	44.6	22%	0.223	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.6	176.9	0	0	0	0	0	114.4	K251 A255 C275 A276 Y277 V281	K251-A279 HydrophobicContact CB-CB 3.95Å; A255-A279 HydrophobicContact CB-CB 4.1Å; C275-A279 WeakPolarHBondContact O-CB 3.09Å; C275-A279 PolarHBondContact O-N 2.75Å; A276-A279 CarbonylContact O-C 3.56Å; A276-A279 WeakPolarHBondContact O-CB 3.46Å; A276-A279 PolarHBondContact O-N 3.34Å; A276-A279 VanDerWaalsContact O-N 3.15Å; Y277-A279 PolarHBondContact O-N 3.08Å; A279-V281 HydrophobicContact CB-CG2 4.07Å; A279-V281 PolarHBondContact O-N 3.3Å
280	G	97.1	Very high	97.1	Very high	60 Å²	60	43.6 Å²	43.6	62%	0.619	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	70	17.9	-173.8	0	0	0	0	0	114	A276 Y277 A278	A276-G280 PolarHBondContact O-N 2.88Å; A276-G280 VanDerWaalsContact O-N 3.11Å; Y277-G280 PolarHBondContact O-N 2.94Å; A278-G280 VanDerWaalsContact C-N 3.3Å
281	V	97	Very high	96.8	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.018	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-96.5	120.3	178.3	180	0	0	0	0	109	D201 A248 K251 V252 A276 A279	D201-V281 HydrophobicContact CB-CB 4.49Å; D201-V281 HydrophobicContact CB-CG1 4.04Å; D201-V281 HydrophobicContact CB-CG2 3.93Å; A248-V281 HydrophobicContact CB-CG1 4.05Å; K251-V281 HydrophobicContact CB-CG2 4.15Å; K251-V281 HydrophobicContact CD-CG2 4.03Å; V252-V281 HydrophobicContact CG2-CB 4.33Å; V252-V281 HydrophobicContact CG2-CG1 4.49Å; V252-V281 HydrophobicContact CG2-CG2 4.29Å; A276-V281 CarbonylContact C-O 3.59Å; A276-V281 VanDerWaalsContact C-O 3.31Å; A276-V281 HydrophobicContact CB-CB 4.29Å; A276-V281 WeakPolarHBondContact CB-O 3.32Å; A276-V281 PolarHBondContact O-N 3.49Å; A276-V281 VanDerWaalsContact O-O 3.11Å; A279-V281 HydrophobicContact CB-CG2 4.07Å; A279-V281 PolarHBondContact O-N 3.3Å
282	R	96.4	Very high	96.1	Very high	211 Å²	211	44.6 Å²	44.6	80%	0.796	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-93.2	138.9	179.6	-68.3	-177.8	174	178	-2.5	111.3
283	P	97.3	Very high	95.6	Very high	32 Å²	32	48.5 Å²	48.5	21%	0.208	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	145.6	172.5	33.1	-38.4	0	0	0	110.7	Y203 V207 D235	Y203-P283 HydrophobicContact CD1-CB 3.71Å; Y203-P283 HydrophobicContact CE1-CB 3.97Å; Y203-P283 HydrophobicContact CG-CB 4.46Å; Y203-P283 CarbonylContact O-C 3.57Å; Y203-P283 WeakPolarHBondContact O-CA 3.47Å; V207-P283 HydrophobicContact CG1-CB 4.4Å; V207-P283 HydrophobicContact CG1-CG 4.2Å; V207-P283 HydrophobicContact CG2-CB 3.79Å; V207-P283 HydrophobicContact CG2-CG 4.39Å; D235-P283 HydrophobicContact CB-CG 3.76Å; D235-P283 WeakPolarHBondContact O-CG 3.3Å
284	S	95.6	Very high	95	Very high	24 Å²	24	52.3 Å²	52.3	17%	0.168	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.1	178.9	-64.8	0	0	0	0	108.9	Y203 L204 G205	Y203-S284 PolarHBondContact O-N 3.15Å; L204-S284 WeakPolarHBondContact CA-O 3.26Å; G205-S284 PolarHBondContact N-O 3.28Å; G205-S284 VanDerWaalsContact N-O 3.1Å
285	H	96.3	Very high	94.7	Very high	109 Å²	109	52.1 Å²	52.1	51%	0.505	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	133	-177.6	-175.5	90.1	0	0	0	112	G205 V207	G205-H285 WeakPolarHBondContact O-CA 3.21Å; V207-H285 HydrophobicContact CB-CB 4.09Å; V207-H285 HydrophobicContact CG2-CB 3.86Å; V207-H285 PolarHBondContact N-ND1 3.15Å
286	C	95.1	Very high	94.5	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.041	34%	0.338	C	S	.	.			trans	-134.5	119.5	170.6	-177.2	0	0	0	0	110.4	F189 L204 G205 L288 F289	F189-C286 HydrophobicContact CZ-CB 4.49Å; L204-C286 HydrophobicContact CD1-CB 3.72Å; L204-C286 HydrophobicContact CG-CB 4.12Å; G205-C286 PolarHBondContact O-N 3.36Å; C286-L288 PolarHBondContact O-N 3.41Å; C286-F289 HydrophobicContact CB-CD2 3.7Å; C286-F289 HydrophobicContact CB-CE2 4Å; C286-F289 PolarHBondContact O-N 2.93Å
287	S	94.6	Very high	94.3	Very high	83 Å²	83	60.9 Å²	60.9	58%	0.58	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.9	-179.2	57.1	0	0	0	0	113.8	F289	S287-F289 PolarHBondContact O-N 3.26Å
288	L	96	Very high	94.2	Very high	45 Å²	45	54 Å²	54	24%	0.236	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-8	175.1	-52.4	-178.4	0	0	0	112.6	V185 F189 C286 M305 V306 S307	V185-L288 HydrophobicContact CG1-CD1 4.05Å; F189-L288 HydrophobicContact CD2-CD1 4.22Å; C286-L288 PolarHBondContact O-N 3.41Å; L288-M305 VanDerWaalsContact O-CE 3.29Å; L288-M305 WeakPolarHBondContact O-CE 3.29Å; L288-V306 HydrophobicContact CB-CB 4.07Å; L288-V306 HydrophobicContact CB-CG2 3.68Å; L288-V306 HydrophobicContact CD1-CG2 4.08Å; L288-V306 PolarHBondContact O-N 2.82Å; L288-S307 PolarHBondContact O-N 3.05Å; L288-S307 VanDerWaalsContact O-N 3.14Å
289	F	97.7	Very high	94	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-96.8	117.5	168.6	-66.9	-108.9	0	0	0	108.4	L186 L204 R206 A241 V243 C286 S287 G291 V306 S307	L186-F289 HydrophobicContact CD1-CZ 4.33Å; L204-F289 HydrophobicContact CD2-CE2 3.97Å; L204-F289 HydrophobicContact CD2-CZ 4.24Å; L204-F289 HydrophobicContact CG-CE2 4.09Å; L204-F289 HydrophobicContact CG-CZ 4.43Å; R206-F289 HydrophobicContact CB-CB 3.87Å; R206-F289 PolarHBondContact NH1-O 2.78Å; A241-F289 HydrophobicContact CB-CD1 4.04Å; A241-F289 HydrophobicContact CB-CE1 4.13Å; A241-F289 WeakPolarHBondContact O-CD1 3.35Å; V243-F289 HydrophobicContact CG2-CE1 4.37Å; V243-F289 HydrophobicContact CG2-CZ 4.01Å; C286-F289 HydrophobicContact CB-CD2 3.7Å; C286-F289 HydrophobicContact CB-CE2 4Å; C286-F289 PolarHBondContact O-N 2.93Å; S287-F289 PolarHBondContact O-N 3.26Å; F289-G291 VanDerWaalsContact C-N 3.34Å; F289-G291 PolarHBondContact O-N 3.23Å; F289-V306 HydrophobicContact CD1-CG1 4.34Å; F289-V306 HydrophobicContact CD2-CB 4.15Å; F289-V306 HydrophobicContact CD2-CG1 4.27Å; F289-V306 HydrophobicContact CE1-CG1 3.77Å; F289-V306 HydrophobicContact CE2-CB 3.93Å; F289-V306 HydrophobicContact CE2-CG1 3.69Å; F289-V306 HydrophobicContact CE2-CG2 4.21Å; F289-V306 HydrophobicContact CZ-CB 4.17Å; F289-V306 HydrophobicContact CZ-CG1 3.42Å; F289-V306 VanDerWaalsContact CZ-CG1 3.42Å; F289-S307 WeakPolarHBondContact CA-OG 3.3Å; F289-S307 VanDerWaalsContact CD1-OG 3.3Å; F289-S307 WeakPolarHBondContact CD1-OG 2.85Å
290	S	94.9	Very high	93.8	Very high	7 Å²	7	51.9 Å²	51.9	5%	0.049	30%	0.304	C	S	.	.			trans	-61.4	-38.9	-178.5	51.4	0	0	0	0	113.3	R206 S307 V308 H309	R206-S290 PolarHBondContact NH1-O 2.78Å; S290-S307 VanDerWaalsContact CB-O 3.29Å; S290-S307 WeakPolarHBondContact CB-O 3.23Å; S290-S307 PolarHBondContact N-O 3.48Å; S290-S307 PolarHBondContact OG-O 3.45Å; S290-V308 VanDerWaalsContact OG-CA 3.29Å; S290-V308 WeakPolarHBondContact OG-CA 3.38Å; S290-H309 PolarHBondContact OG-N 3.25Å
291	G	92.2	Very high	93.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.285	C	S	.	.			trans	81.5	-147.3	-172.3	0	0	0	0	0	112.3	T240 F289 H309	T240-G291 WeakPolarHBondContact CG2-O 3.37Å; T240-G291 PolarHBondContact OG1-O 2.84Å; F289-G291 VanDerWaalsContact C-N 3.34Å; F289-G291 PolarHBondContact O-N 3.23Å; G291-H309 WeakPolarHBondContact O-CB 3.29Å
292	G	83.4	Confident	93.5	Very high	28 Å²	28	50.6 Å²	50.6	29%	0.289	29%	0.285	S	S	.	.	S	Bend	trans	-69.5	-44.9	-176.5	0	0	0	0	0	116.1	H309	G292-H309 PolarHBondContact O-ND1 3.24Å; G292-H309 VanDerWaalsContact O-ND1 3.16Å
293	P	86.7	Confident	93.4	Very high	84 Å²	84	43 Å²	43	55%	0.545	26%	0.259	S	S	.	.	S	Bend	trans	-66.1	141.9	-176.7	-23.3	34.6	0	0	0	113.1
294	P	85.6	Confident	93.2	Very high	80 Å²	80	43.8 Å²	43.8	52%	0.519	27%	0.267	S	S	.	.			trans	-65	144.3	173.6	27	-32.9	0	0	0	110.7	Q310	P294-Q310 HydrophobicContact CB-CB 4.47Å
295	V	92.6	Very high	93.3	Very high	37 Å²	37	43.8 Å²	43.8	22%	0.224	27%	0.265	C	S	.	.			trans	-109.4	118.5	172.5	-178.4	0	0	0	0	108.1	Y302 V308	V295-Y302 PolarHBondContact O-OH 3.1Å; V295-V308 HydrophobicContact CB-CG1 3.77Å; V295-V308 HydrophobicContact CG2-CG1 4.22Å
296	P	93.4	Very high	93.3	Very high	113 Å²	113	38.7 Å²	38.7	73%	0.734	24%	0.241	S	C	*	.			trans	-52.8	143.5	177.6	-26.7	34.5	0	0	0	111.8	G298	P296-G298 PolarHBondContact O-N 2.96Å; P296-G298 VanDerWaalsContact O-N 3.16Å
297	Y	95.1	Very high	93.5	Very high	76 Å²	76	38.4 Å²	38.4	30%	0.298	24%	0.24	S	C	.	.			trans	-60.3	123.6	-179.8	-176.5	-109.4	0	0	0	111	Y302 Y319 D322	Y297-Y302 HydrophobicContact CD2-CD1 4.06Å; Y297-Y302 HydrophobicContact CD2-CD2 4.01Å; Y297-Y302 AromaticContact CD2-CE1 3.97Å; Y297-Y302 HydrophobicContact CD2-CE1 3.97Å; Y297-Y302 AromaticContact CD2-CE2 3.95Å; Y297-Y302 HydrophobicContact CD2-CE2 3.95Å; Y297-Y302 HydrophobicContact CD2-CG 4.06Å; Y297-Y302 AromaticContact CD2-CZ 3.9Å; Y297-Y302 HydrophobicContact CE2-CD1 4.12Å; Y297-Y302 HydrophobicContact CE2-CD2 4.35Å; Y297-Y302 HydrophobicContact CE2-CE1 4.46Å; Y297-Y302 HydrophobicContact CE2-CG 4.05Å; Y297-Y319 HydrophobicContact CD1-CD1 4.26Å; Y297-Y319 HydrophobicContact CD1-CE1 4.05Å; Y297-Y319 AromaticContact CD2-CD1 3.49Å; Y297-Y319 HydrophobicContact CD2-CD1 3.49Å; Y297-Y319 VanDerWaalsContact CD2-CD1 3.49Å; Y297-Y319 AromaticContact CD2-CD2 3.5Å; Y297-Y319 HydrophobicContact CD2-CD2 3.5Å; Y297-Y319 VanDerWaalsContact CD2-CD2 3.5Å; Y297-Y319 AromaticContact CD2-CE1 3.66Å; Y297-Y319 HydrophobicContact CD2-CE1 3.66Å; Y297-Y319 AromaticContact CD2-CE2 3.62Å; Y297-Y319 HydrophobicContact CD2-CE2 3.62Å; Y297-Y319 AromaticContact CD2-CG 3.42Å; Y297-Y319 HydrophobicContact CD2-CG 3.42Å; Y297-Y319 VanDerWaalsContact CD2-CG 3.42Å; Y297-Y319 AromaticContact CD2-CZ 3.72Å; Y297-Y319 HydrophobicContact CE1-CD1 4.21Å; Y297-Y319 HydrophobicContact CE1-CE1 4.43Å; Y297-Y319 AromaticContact CE2-CD1 3.46Å; Y297-Y319 HydrophobicContact CE2-CD1 3.46Å; Y297-Y319 VanDerWaalsContact CE2-CD1 3.46Å; Y297-Y319 AromaticContact CE2-CD2 3.87Å; Y297-Y319 HydrophobicContact CE2-CD2 3.87Å; Y297-Y319 HydrophobicContact CE2-CE1 4.09Å; Y297-Y319 HydrophobicContact CE2-CE2 4.41Å; Y297-Y319 AromaticContact CE2-CG 3.35Å; Y297-Y319 HydrophobicContact CE2-CG 3.35Å; Y297-Y319 AromaticContact CG-CD1 3.91Å; Y297-Y319 HydrophobicContact CG-CD1 3.91Å; Y297-Y319 HydrophobicContact CG-CD2 4.36Å; Y297-Y319 AromaticContact CG-CE1 3.64Å; Y297-Y319 HydrophobicContact CG-CE1 3.64Å; Y297-Y319 HydrophobicContact CG-CE2 4.08Å; Y297-Y319 HydrophobicContact CG-CG 4.28Å; Y297-Y319 AromaticContact CG-CZ 3.73Å; Y297-Y319 AromaticContact CZ-CD1 3.82Å; Y297-D322 WeakPolarHBondContact OH-CB 3.48Å; Y297-D322 PolarHBondContact OH-OD2 3.32Å
298	G	94.6	Very high	93.6	Very high	27 Å²	27	34.4 Å²	34.4	28%	0.278	21%	0.212	S	C	.	.			trans	-147.6	114.6	172.3	0	0	0	0	0	107.6	P296 C300 C301 Y302	P296-G298 PolarHBondContact O-N 2.96Å; P296-G298 VanDerWaalsContact O-N 3.16Å; G298-C300 VanDerWaalsContact C-N 3.27Å; G298-C300 PolarHBondContact O-N 2.83Å; G298-C300 VanDerWaalsContact O-N 3.16Å; G298-C301 WeakPolarHBondContact O-CA 3.17Å; G298-C301 VanDerWaalsContact O-CB 3.26Å; G298-C301 WeakPolarHBondContact O-CB 3.45Å; G298-C301 PolarHBondContact O-N 2.86Å; G298-Y302 WeakPolarHBondContact O-CD2 3.31Å; G298-Y302 PolarHBondContact O-N 3.18Å
299	R	94.1	Very high	93.7	Very high	51 Å²	51	33.6 Å²	33.6	19%	0.192	21%	0.207	C	C	.	.	H	α-helix	trans	-49.1	-47.2	-172.5	-170.8	177.5	-173.6	-139.3	-9.1	113	Y302 Q303 D322 V323 S325 P327 C329	R299-Y302 PolarHBondContact O-N 2.62Å; R299-Q303 WeakPolarHBondContact O-CG 3.18Å; R299-Q303 PolarHBondContact O-N 2.76Å; R299-D322 WeakPolarHBondContact CD-OD2 3.46Å; R299-D322 VanDerWaalsContact CZ-O 3.3Å; R299-D322 IonicContact CZ-OD1 3.99Å; R299-D322 PolarHBondContact NE-O 3.33Å; R299-D322 IonicContact NE-OD1 2.82Å; R299-D322 PolarHBondContact NE-OD1 3.13Å; R299-D322 VanDerWaalsContact NE-OD1 3.17Å; R299-D322 IonicContact NE-OD2 3.75Å; R299-D322 PolarHBondContact NH2-O 3.2Å; R299-V323 HydrophobicContact CG-CG1 4.33Å; R299-S325 VanDerWaalsContact NH2-C 3.35Å; R299-S325 PolarHBondContact NH2-O 3.15Å; R299-P327 VanDerWaalsContact CZ-O 3.25Å; R299-P327 PolarHBondContact NH1-O 3.07Å; R299-P327 PolarHBondContact NH2-O 3.14Å; R299-C329 HydrophobicContact CB-CB 4.47Å; R299-C329 HydrophobicContact CG-CB 4.11Å
300	C	93.8	Very high	93.6	Very high	13 Å²	13	38.4 Å²	38.4	9%	0.088	23%	0.229	C	C	.	.	H	α-helix	trans	-68.3	-35.5	177.1	-68.5	0	0	0	0	114.6	G298 Q303 A304 C329 W331	G298-C300 VanDerWaalsContact C-N 3.27Å; G298-C300 PolarHBondContact O-N 2.83Å; G298-C300 VanDerWaalsContact O-N 3.16Å; C300-Q303 PolarHBondContact O-N 3.23Å; C300-A304 WeakPolarHBondContact O-CB 3.28Å; C300-A304 PolarHBondContact O-N 2.75Å; C300-C329 WeakPolarHBondContact CA-SG 3.49Å; C300-C329 HydrophobicContact CB-CB 3.99Å; C300-C329 WeakPolarHBondContact CB-SG 3.48Å; C300-C329 WeakPolarHBondContact SG-CB 3.27Å; C300-C329 CovalentContact SG-SG 2.01Å; C300-C329 PolarHBondContact SG-SG 3.4Å; C300-W331 VanDerWaalsContact C-CZ2 3.49Å; C300-W331 HydrophobicContact CB-CD2 3.67Å; C300-W331 HydrophobicContact CB-CE3 4Å; C300-W331 HydrophobicContact CB-CG 4.43Å; C300-W331 HydrophobicContact CB-CH2 3.51Å; C300-W331 HydrophobicContact CB-CZ2 3.13Å; C300-W331 HydrophobicContact CB-CZ3 3.92Å
301	C	93.9	Very high	93.7	Very high	32 Å²	32	38.4 Å²	38.4	22%	0.216	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-49.2	174.7	-174.8	0	0	0	0	109.4	G298 Q303 A304 M305 W331	G298-C301 WeakPolarHBondContact O-CA 3.17Å; G298-C301 VanDerWaalsContact O-CB 3.26Å; G298-C301 WeakPolarHBondContact O-CB 3.45Å; G298-C301 PolarHBondContact O-N 2.86Å; C301-Q303 VanDerWaalsContact C-N 3.32Å; C301-Q303 PolarHBondContact O-N 3.16Å; C301-A304 PolarHBondContact O-N 2.88Å; C301-M305 WeakPolarHBondContact O-CB 3.49Å; C301-M305 WeakPolarHBondContact O-CG 3.49Å; C301-M305 PolarHBondContact O-N 2.75Å; C301-W331 HydrophobicContact CB-CH2 4.24Å
302	Y	95	Very high	93.9	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-69.1	-28.4	-177.8	-79.4	-123.5	0	0	0	112.8	F180 V295 Y297 G298 R299 A304 V308 I311 Y319	F180-Y302 HydrophobicContact CD1-CD1 4.1Å; F180-Y302 HydrophobicContact CD2-CD1 4.39Å; F180-Y302 HydrophobicContact CE1-CD1 4.35Å; F180-Y302 HydrophobicContact CG-CD1 4.13Å; F180-Y302 HydrophobicContact CG-CE1 4.5Å; V295-Y302 PolarHBondContact O-OH 3.1Å; Y297-Y302 HydrophobicContact CD2-CD1 4.06Å; Y297-Y302 HydrophobicContact CD2-CD2 4.01Å; Y297-Y302 AromaticContact CD2-CE1 3.97Å; Y297-Y302 HydrophobicContact CD2-CE1 3.97Å; Y297-Y302 AromaticContact CD2-CE2 3.95Å; Y297-Y302 HydrophobicContact CD2-CE2 3.95Å; Y297-Y302 HydrophobicContact CD2-CG 4.06Å; Y297-Y302 AromaticContact CD2-CZ 3.9Å; Y297-Y302 HydrophobicContact CE2-CD1 4.12Å; Y297-Y302 HydrophobicContact CE2-CD2 4.35Å; Y297-Y302 HydrophobicContact CE2-CE1 4.46Å; Y297-Y302 HydrophobicContact CE2-CG 4.05Å; G298-Y302 WeakPolarHBondContact O-CD2 3.31Å; G298-Y302 PolarHBondContact O-N 3.18Å; R299-Y302 PolarHBondContact O-N 2.62Å; Y302-A304 VanDerWaalsContact C-N 3.31Å; Y302-V308 HydrophobicContact CD1-CG2 4.26Å; Y302-V308 HydrophobicContact CD2-CG2 4.39Å; Y302-V308 HydrophobicContact CE1-CB 4.02Å; Y302-V308 HydrophobicContact CE1-CG1 3.99Å; Y302-V308 HydrophobicContact CE1-CG2 4.18Å; Y302-V308 HydrophobicContact CE2-CG1 4.16Å; Y302-V308 HydrophobicContact CE2-CG2 4.29Å; Y302-V308 HydrophobicContact CG-CG2 4.38Å; Y302-V308 WeakPolarHBondContact OH-CG1 3.36Å; Y302-I311 HydrophobicContact CE1-CD1 3.91Å; Y302-I311 WeakPolarHBondContact OH-CD1 3.42Å; Y302-Y319 HydrophobicContact CD1-CD2 4.21Å; Y302-Y319 AromaticContact CE1-CD2 3.64Å; Y302-Y319 HydrophobicContact CE1-CD2 3.64Å; Y302-Y319 HydrophobicContact CE1-CE2 4.12Å
303	Q	93.8	Very high	94.7	Very high	52 Å²	52	42.9 Å²	42.9	24%	0.243	25%	0.251	C	S	.	.	H	α-helix	trans	-67.9	-29.1	169.3	-77.9	-174.9	-32.2	0	0	113.2	V185 R299 C300 C301 V323 C329	V185-Q303 VanDerWaalsContact CG2-O 3.27Å; V185-Q303 WeakPolarHBondContact CG2-O 3.47Å; R299-Q303 WeakPolarHBondContact O-CG 3.18Å; R299-Q303 PolarHBondContact O-N 2.76Å; C300-Q303 PolarHBondContact O-N 3.23Å; C301-Q303 VanDerWaalsContact C-N 3.32Å; C301-Q303 PolarHBondContact O-N 3.16Å; Q303-V323 HydrophobicContact CG-CB 3.73Å; Q303-V323 HydrophobicContact CG-CG1 4.23Å; Q303-V323 PolarHBondContact NE2-O 2.93Å; Q303-C329 PolarHBondContact OE1-SG 3.16Å
304	A	93.9	Very high	95.2	Very high	47 Å²	47	46 Å²	46	39%	0.388	26%	0.256	S	S	.	.	H	α-helix	trans	-95.1	-24.5	-176.3	0	0	0	0	0	114	V185 C300 C301 Y302	V185-A304 VanDerWaalsContact CG1-O 3.31Å; V185-A304 WeakPolarHBondContact CG1-O 3.31Å; C300-A304 WeakPolarHBondContact O-CB 3.28Å; C300-A304 PolarHBondContact O-N 2.75Å; C301-A304 PolarHBondContact O-N 2.88Å; Y302-A304 VanDerWaalsContact C-N 3.31Å
305	M	96.1	Very high	95.8	Very high	25 Å²	25	45.1 Å²	45.1	12%	0.123	25%	0.245	C	C	.	.			trans	-79.5	146.7	-177.4	-68.9	-67.6	-76.6	0	0	111.9	N182 L288 C301 V308	N182-M305 VanDerWaalsContact CB-O 3.32Å; N182-M305 WeakPolarHBondContact CB-O 3.44Å; L288-M305 VanDerWaalsContact O-CE 3.29Å; L288-M305 WeakPolarHBondContact O-CE 3.29Å; C301-M305 WeakPolarHBondContact O-CB 3.49Å; C301-M305 WeakPolarHBondContact O-CG 3.49Å; C301-M305 PolarHBondContact O-N 2.75Å; M305-V308 HydrophobicContact CB-CG2 3.86Å; M305-V308 HydrophobicContact CG-CG2 4.22Å
306	V	97.6	Very high	96.1	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.234	C	C	.	.	S	Bend	trans	-79.8	-42.8	169.9	171.9	0	0	0	0	110.4	F181 N182 V185 L186 L288 F289	F181-V306 CarbonylContact C-O 3.48Å; F181-V306 WeakPolarHBondContact CA-O 3.42Å; F181-V306 HydrophobicContact CD2-CG1 4.23Å; F181-V306 WeakPolarHBondContact CD2-O 3.42Å; F181-V306 HydrophobicContact CE2-CG1 3.84Å; N182-V306 PolarHBondContact N-O 2.74Å; V185-V306 HydrophobicContact CB-CG2 4.27Å; V185-V306 HydrophobicContact CG1-CG2 3.62Å; L186-V306 HydrophobicContact CB-CG1 3.98Å; L186-V306 HydrophobicContact CB-CG2 4.32Å; L186-V306 HydrophobicContact CD1-CG1 4.33Å; L288-V306 HydrophobicContact CB-CB 4.07Å; L288-V306 HydrophobicContact CB-CG2 3.68Å; L288-V306 HydrophobicContact CD1-CG2 4.08Å; L288-V306 PolarHBondContact O-N 2.82Å; F289-V306 HydrophobicContact CD1-CG1 4.34Å; F289-V306 HydrophobicContact CD2-CB 4.15Å; F289-V306 HydrophobicContact CD2-CG1 4.27Å; F289-V306 HydrophobicContact CE1-CG1 3.77Å; F289-V306 HydrophobicContact CE2-CB 3.93Å; F289-V306 HydrophobicContact CE2-CG1 3.69Å; F289-V306 HydrophobicContact CE2-CG2 4.21Å; F289-V306 HydrophobicContact CZ-CB 4.17Å; F289-V306 HydrophobicContact CZ-CG1 3.42Å; F289-V306 VanDerWaalsContact CZ-CG1 3.42Å
307	S	97.8	Very high	96.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.1	178.8	71	0	0	0	0	113.3	F180 L288 F289 S290	F180-S307 WeakPolarHBondContact O-CA 2.8Å; L288-S307 PolarHBondContact O-N 3.05Å; L288-S307 VanDerWaalsContact O-N 3.14Å; F289-S307 WeakPolarHBondContact CA-OG 3.3Å; F289-S307 VanDerWaalsContact CD1-OG 3.3Å; F289-S307 WeakPolarHBondContact CD1-OG 2.85Å; S290-S307 VanDerWaalsContact CB-O 3.29Å; S290-S307 WeakPolarHBondContact CB-O 3.23Å; S290-S307 PolarHBondContact N-O 3.48Å; S290-S307 PolarHBondContact OG-O 3.45Å
308	V	97.8	Very high	96.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.3	170.4	-171.1	0	0	0	0	109.7	V179 F180 S290 V295 Y302 M305 I311	V179-V308 CarbonylContact C-O 3.5Å; V179-V308 WeakPolarHBondContact CA-O 3.46Å; F180-V308 HydrophobicContact CB-CB 4.34Å; F180-V308 PolarHBondContact N-O 2.72Å; F180-V308 PolarHBondContact O-N 3.1Å; S290-V308 VanDerWaalsContact OG-CA 3.29Å; S290-V308 WeakPolarHBondContact OG-CA 3.38Å; V295-V308 HydrophobicContact CB-CG1 3.77Å; V295-V308 HydrophobicContact CG2-CG1 4.22Å; Y302-V308 HydrophobicContact CD1-CG2 4.26Å; Y302-V308 HydrophobicContact CD2-CG2 4.39Å; Y302-V308 HydrophobicContact CE1-CB 4.02Å; Y302-V308 HydrophobicContact CE1-CG1 3.99Å; Y302-V308 HydrophobicContact CE1-CG2 4.18Å; Y302-V308 HydrophobicContact CE2-CG1 4.16Å; Y302-V308 HydrophobicContact CE2-CG2 4.29Å; Y302-V308 HydrophobicContact CG-CG2 4.38Å; Y302-V308 WeakPolarHBondContact OH-CG1 3.36Å; M305-V308 HydrophobicContact CB-CG2 3.86Å; M305-V308 HydrophobicContact CG-CG2 4.22Å; V308-I311 HydrophobicContact CG1-CD1 4.12Å; V308-I311 HydrophobicContact CG1-CG1 4.49Å; V308-I311 WeakPolarHBondContact O-CG1 3.42Å
309	H	96.9	Very high	96.6	Very high	28 Å²	28	42.7 Å²	42.7	13%	0.13	22%	0.22	C	C	.	.			trans	-91.8	163.9	-176.7	177.8	-120.2	0	0	0	112.6	D178 V179 T240 S290 G291 G292	D178-H309 IonicContact OD1-CD2 2.67Å; D178-H309 PolarHBondContact OD1-CD2 2.97Å; D178-H309 VanDerWaalsContact OD1-CD2 3.24Å; D178-H309 IonicContact OD1-NE2 3.14Å; D178-H309 IonicContact OD2-CD2 3.37Å; D178-H309 IonicContact OD2-NE2 2.61Å; D178-H309 PolarHBondContact OD2-NE2 3.48Å; V179-H309 HydrophobicContact CG2-CB 4.25Å; T240-H309 HydrophobicContact CG2-CB 3.99Å; T240-H309 VanDerWaalsContact CG2-CD2 3.5Å; T240-H309 WeakPolarHBondContact CG2-CD2 3.41Å; T240-H309 VanDerWaalsContact CG2-CG 3.47Å; S290-H309 PolarHBondContact OG-N 3.25Å; G291-H309 WeakPolarHBondContact O-CB 3.29Å; G292-H309 PolarHBondContact O-ND1 3.24Å; G292-H309 VanDerWaalsContact O-ND1 3.16Å
310	Q	95.7	Very high	96.7	Very high	102 Å²	102	41.7 Å²	41.7	48%	0.477	22%	0.217	S	C	.	.	S	Bend	trans	65.8	46.3	-177.2	-49.6	-169.4	-7.5	0	0	113.9	D178 P294	D178-Q310 PolarHBondContact O-N 3Å; D178-Q310 VanDerWaalsContact O-N 3.12Å; P294-Q310 HydrophobicContact CB-CB 4.47Å
311	I	97.3	Very high	96.9	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.036	24%	0.244	C	C	.	.			trans	-107.1	117.9	-179.9	-54.1	-60.3	0	0	0	109.4	D178 F180 Y302 V308 E315 M316 Y319	D178-I311 WeakPolarHBondContact CA-O 3.42Å; D178-I311 PolarHBondContact O-N 2.86Å; F180-I311 HydrophobicContact CB-CB 4.48Å; F180-I311 HydrophobicContact CB-CG1 3.91Å; F180-I311 HydrophobicContact CB-CG2 4.45Å; Y302-I311 HydrophobicContact CE1-CD1 3.91Å; Y302-I311 WeakPolarHBondContact OH-CD1 3.42Å; V308-I311 HydrophobicContact CG1-CD1 4.12Å; V308-I311 HydrophobicContact CG1-CG1 4.49Å; V308-I311 WeakPolarHBondContact O-CG1 3.42Å; I311-E315 HydrophobicContact CG2-CB 3.89Å; I311-M316 HydrophobicContact CG2-CB 3.91Å; I311-Y319 HydrophobicContact CD1-CD2 4.44Å; I311-Y319 HydrophobicContact CD1-CE2 4.22Å; I311-Y319 HydrophobicContact CG2-CD2 4.48Å
312	T	98	Very high	97	Very high	68 Å²	68	49.8 Å²	49.8	42%	0.417	25%	0.249	S	C	.	.			trans	-69.3	159.7	175.8	65.3	0	0	0	0	111.3	K314 E315 M316	T312-K314 PolarHBondContact O-N 3.23Å; T312-E315 VanDerWaalsContact CB-OE2 3.3Å; T312-E315 WeakPolarHBondContact CB-OE2 3.39Å; T312-E315 VanDerWaalsContact CG2-OE2 3.28Å; T312-E315 WeakPolarHBondContact CG2-OE2 3.34Å; T312-E315 PolarHBondContact N-OE2 3.34Å; T312-E315 PolarHBondContact O-N 3.47Å; T312-E315 WeakPolarHBondContact OG1-CB 3.47Å; T312-E315 WeakPolarHBondContact OG1-CG 3.48Å; T312-E315 PolarHBondContact OG1-N 3.48Å; T312-E315 PolarHBondContact OG1-OE2 3.02Å; T312-M316 WeakPolarHBondContact O-CB 3.47Å; T312-M316 PolarHBondContact O-N 3.3Å
313	P	98.6	Very high	96.9	Very high	53 Å²	53	49.8 Å²	49.8	34%	0.344	25%	0.25	S	C	.	.	H	α-helix	trans	-56.8	-36.4	178.3	-26.7	35.3	0	0	0	113.6	A92 A95 L317	A92-P313 HydrophobicContact CB-CG 4.03Å; A95-P313 HydrophobicContact CB-CB 3.8Å; P313-L317 WeakPolarHBondContact O-CG 3.41Å; P313-L317 PolarHBondContact O-N 3.22Å
314	K	98.4	Very high	96.8	Very high	150 Å²	150	52.2 Å²	52.2	65%	0.652	26%	0.261	S	S	*	.	H	α-helix	trans	-68.1	-49.2	177	-176.9	-176.8	174.9	-171.9	0	111.3	T312 M316 L317 D318	T312-K314 PolarHBondContact O-N 3.23Å; K314-M316 VanDerWaalsContact C-N 3.26Å; K314-M316 PolarHBondContact O-N 2.98Å; K314-L317 PolarHBondContact O-N 2.67Å; K314-D318 PolarHBondContact O-N 3.03Å
315	E	98.1	Very high	96.7	Very high	61 Å²	61	52 Å²	52	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-39.1	176.8	-73.5	163.9	153.9	0	0	111.5	I311 T312 L317 D318 Y319	I311-E315 HydrophobicContact CG2-CB 3.89Å; T312-E315 VanDerWaalsContact CB-OE2 3.3Å; T312-E315 WeakPolarHBondContact CB-OE2 3.39Å; T312-E315 VanDerWaalsContact CG2-OE2 3.28Å; T312-E315 WeakPolarHBondContact CG2-OE2 3.34Å; T312-E315 PolarHBondContact N-OE2 3.34Å; T312-E315 PolarHBondContact O-N 3.47Å; T312-E315 WeakPolarHBondContact OG1-CB 3.47Å; T312-E315 WeakPolarHBondContact OG1-CG 3.48Å; T312-E315 PolarHBondContact OG1-N 3.48Å; T312-E315 PolarHBondContact OG1-OE2 3.02Å; E315-L317 VanDerWaalsContact C-N 3.33Å; E315-L317 PolarHBondContact O-N 3.03Å; E315-D318 PolarHBondContact O-N 2.69Å; E315-Y319 HydrophobicContact CB-CD2 4.03Å; E315-Y319 HydrophobicContact CB-CE1 4.38Å; E315-Y319 HydrophobicContact CB-CE2 3.66Å; E315-Y319 HydrophobicContact CG-CE1 4.43Å; E315-Y319 HydrophobicContact CG-CE2 4.07Å; E315-Y319 WeakPolarHBondContact O-CB 3.25Å; E315-Y319 WeakPolarHBondContact O-CD2 3.42Å; E315-Y319 PolarHBondContact O-N 3.02Å
316	M	98.2	Very high	96.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.9	-46.8	176.5	-169.9	176	-66.3	0	0	111.6	A95 I96 T99 W100 V179 I311 T312 K314 W320	A95-M316 HydrophobicContact CB-CB 4.49Å; A95-M316 HydrophobicContact CB-SD 4.22Å; I96-M316 HydrophobicContact CB-SD 4.25Å; I96-M316 HydrophobicContact CD1-CE 4.32Å; I96-M316 HydrophobicContact CG1-CE 3.73Å; I96-M316 HydrophobicContact CG1-SD 3.39Å; I96-M316 WeakPolarHBondContact CG1-SD 3.37Å; T99-M316 HydrophobicContact CG2-CG 4.29Å; W100-M316 PolarHBondContact NE1-SD 3.1Å; W100-M316 VanDerWaalsContact NE1-SD 3.42Å; V179-M316 WeakPolarHBondContact O-CE 3.22Å; I311-M316 HydrophobicContact CG2-CB 3.91Å; T312-M316 WeakPolarHBondContact O-CB 3.47Å; T312-M316 PolarHBondContact O-N 3.3Å; K314-M316 VanDerWaalsContact C-N 3.26Å; K314-M316 PolarHBondContact O-N 2.98Å; M316-W320 WeakPolarHBondContact O-CB 3.38Å; M316-W320 PolarHBondContact O-N 3.39Å
317	L	98.6	Very high	95.8	Very high	73 Å²	73	61.3 Å²	61.3	38%	0.382	32%	0.319	S	S	.	.	H	α-helix	trans	-64.3	-49.2	177.3	-68.6	163.8	0	0	0	111.8	A95 D98 T99 P313 K314 E315 K321	A95-L317 HydrophobicContact CB-CD1 4.45Å; A95-L317 HydrophobicContact CB-CG 4.2Å; D98-L317 HydrophobicContact CB-CD2 3.91Å; T99-L317 HydrophobicContact CG2-CD2 3.81Å; T99-L317 HydrophobicContact CG2-CG 4.45Å; P313-L317 WeakPolarHBondContact O-CG 3.41Å; P313-L317 PolarHBondContact O-N 3.22Å; K314-L317 PolarHBondContact O-N 2.67Å; E315-L317 VanDerWaalsContact C-N 3.33Å; E315-L317 PolarHBondContact O-N 3.03Å; L317-K321 WeakPolarHBondContact O-CB 3.39Å; L317-K321 PolarHBondContact O-N 3.24Å; L317-K321 VanDerWaalsContact O-N 3.12Å
318	D	97.9	Very high	95.1	Very high	85 Å²	85	66.8 Å²	66.8	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-48.4	-176.8	-71.4	-22.3	0	0	0	111.1	K314 E315 K321 D322	K314-D318 PolarHBondContact O-N 3.03Å; E315-D318 PolarHBondContact O-N 2.69Å; D318-K321 PolarHBondContact O-N 3.48Å; D318-D322 PolarHBondContact O-N 3.11Å
319	Y	97.4	Very high	94.5	Very high	44 Å²	44	68 Å²	68	17%	0.173	36%	0.361	C	S	.	.	H	α-helix	trans	-68.4	-41.5	-179.6	-61.3	-10.1	0	0	0	111.1	Y297 Y302 I311 E315 K321 D322 V323	Y297-Y319 HydrophobicContact CD1-CD1 4.26Å; Y297-Y319 HydrophobicContact CD1-CE1 4.05Å; Y297-Y319 AromaticContact CD2-CD1 3.49Å; Y297-Y319 HydrophobicContact CD2-CD1 3.49Å; Y297-Y319 VanDerWaalsContact CD2-CD1 3.49Å; Y297-Y319 AromaticContact CD2-CD2 3.5Å; Y297-Y319 HydrophobicContact CD2-CD2 3.5Å; Y297-Y319 VanDerWaalsContact CD2-CD2 3.5Å; Y297-Y319 AromaticContact CD2-CE1 3.66Å; Y297-Y319 HydrophobicContact CD2-CE1 3.66Å; Y297-Y319 AromaticContact CD2-CE2 3.62Å; Y297-Y319 HydrophobicContact CD2-CE2 3.62Å; Y297-Y319 AromaticContact CD2-CG 3.42Å; Y297-Y319 HydrophobicContact CD2-CG 3.42Å; Y297-Y319 VanDerWaalsContact CD2-CG 3.42Å; Y297-Y319 AromaticContact CD2-CZ 3.72Å; Y297-Y319 HydrophobicContact CE1-CD1 4.21Å; Y297-Y319 HydrophobicContact CE1-CE1 4.43Å; Y297-Y319 AromaticContact CE2-CD1 3.46Å; Y297-Y319 HydrophobicContact CE2-CD1 3.46Å; Y297-Y319 VanDerWaalsContact CE2-CD1 3.46Å; Y297-Y319 AromaticContact CE2-CD2 3.87Å; Y297-Y319 HydrophobicContact CE2-CD2 3.87Å; Y297-Y319 HydrophobicContact CE2-CE1 4.09Å; Y297-Y319 HydrophobicContact CE2-CE2 4.41Å; Y297-Y319 AromaticContact CE2-CG 3.35Å; Y297-Y319 HydrophobicContact CE2-CG 3.35Å; Y297-Y319 AromaticContact CG-CD1 3.91Å; Y297-Y319 HydrophobicContact CG-CD1 3.91Å; Y297-Y319 HydrophobicContact CG-CD2 4.36Å; Y297-Y319 AromaticContact CG-CE1 3.64Å; Y297-Y319 HydrophobicContact CG-CE1 3.64Å; Y297-Y319 HydrophobicContact CG-CE2 4.08Å; Y297-Y319 HydrophobicContact CG-CG 4.28Å; Y297-Y319 AromaticContact CG-CZ 3.73Å; Y297-Y319 AromaticContact CZ-CD1 3.82Å; Y302-Y319 HydrophobicContact CD1-CD2 4.21Å; Y302-Y319 AromaticContact CE1-CD2 3.64Å; Y302-Y319 HydrophobicContact CE1-CD2 3.64Å; Y302-Y319 HydrophobicContact CE1-CE2 4.12Å; I311-Y319 HydrophobicContact CD1-CD2 4.44Å; I311-Y319 HydrophobicContact CD1-CE2 4.22Å; I311-Y319 HydrophobicContact CG2-CD2 4.48Å; E315-Y319 HydrophobicContact CB-CD2 4.03Å; E315-Y319 HydrophobicContact CB-CE1 4.38Å; E315-Y319 HydrophobicContact CB-CE2 3.66Å; E315-Y319 HydrophobicContact CG-CE1 4.43Å; E315-Y319 HydrophobicContact CG-CE2 4.07Å; E315-Y319 WeakPolarHBondContact O-CB 3.25Å; E315-Y319 WeakPolarHBondContact O-CD2 3.42Å; E315-Y319 PolarHBondContact O-N 3.02Å; Y319-K321 VanDerWaalsContact C-N 3.29Å; Y319-K321 PolarHBondContact O-N 3.14Å; Y319-D322 PolarHBondContact O-N 3.26Å; Y319-V323 WeakPolarHBondContact O-CG1 3.43Å; Y319-V323 WeakPolarHBondContact O-CG2 3.4Å; Y319-V323 PolarHBondContact O-N 3.29Å
320	W	96.9	Very high	93.9	Very high	31 Å²	31	70.4 Å²	70.4	12%	0.117	38%	0.381	C	S	.	.	H	α-helix	trans	-60.4	-41.8	178.3	-174.7	-103.2	0	0	0	111.6	T99 W100 Q103 F180 M316 V323 H324	T99-W320 HydrophobicContact CG2-CB 3.58Å; T99-W320 HydrophobicContact CG2-CG 3.69Å; W100-W320 HydrophobicContact CB-CE3 3.95Å; W100-W320 HydrophobicContact CB-CH2 3.54Å; W100-W320 HydrophobicContact CB-CZ2 4.12Å; W100-W320 HydrophobicContact CB-CZ3 3.45Å; W100-W320 VanDerWaalsContact CB-CZ3 3.45Å; Q103-W320 HydrophobicContact CG-CZ2 4.31Å; F180-W320 HydrophobicContact CE1-CE3 4.17Å; F180-W320 HydrophobicContact CE1-CZ3 4.31Å; F180-W320 HydrophobicContact CE2-CB 3.99Å; F180-W320 AromaticContact CE2-CE3 3.69Å; F180-W320 HydrophobicContact CE2-CE3 3.69Å; F180-W320 HydrophobicContact CZ-CD2 4.45Å; F180-W320 AromaticContact CZ-CE3 3.4Å; F180-W320 HydrophobicContact CZ-CE3 3.4Å; F180-W320 AromaticContact CZ-CZ3 3.96Å; F180-W320 HydrophobicContact CZ-CZ3 3.96Å; M316-W320 WeakPolarHBondContact O-CB 3.38Å; M316-W320 PolarHBondContact O-N 3.39Å; W320-V323 WeakPolarHBondContact O-CG2 3.36Å; W320-H324 AromaticContact CD2-CE1 3.56Å; W320-H324 AromaticContact CD2-ND1 3.7Å; W320-H324 AromaticContact CE2-CE1 3.41Å; W320-H324 VanDerWaalsContact CE2-CE1 3.41Å; W320-H324 AromaticContact CE2-ND1 3.64Å; W320-H324 AromaticContact CE3-CE1 3.61Å; W320-H324 AromaticContact CH2-CE1 3.38Å; W320-H324 WeakPolarHBondContact CH2-CE1 3.44Å; W320-H324 AromaticContact CH2-NE2 3.88Å; W320-H324 AromaticContact CZ2-CE1 3.35Å; W320-H324 WeakPolarHBondContact CZ2-CE1 3.13Å; W320-H324 AromaticContact CZ2-NE2 3.87Å; W320-H324 AromaticContact CZ3-CE1 3.5Å; W320-H324 VanDerWaalsContact CZ3-CE1 3.5Å; W320-H324 WeakPolarHBondContact CZ3-CE1 3.38Å; W320-H324 AromaticContact NE1-ND1 3.97Å; W320-H324 PolarHBondContact O-N 3.07Å; W320-H324 PolarHBondContact O-ND1 3.34Å
321	K	96.4	Very high	93	Very high	155 Å²	155	75 Å²	75	67%	0.674	39%	0.394	S	S	*	.	H	α-helix	trans	-63.5	-47.3	175.6	-176.5	-177.4	178	-176	0	111.7	L317 D318 Y319 H324 S325	L317-K321 WeakPolarHBondContact O-CB 3.39Å; L317-K321 PolarHBondContact O-N 3.24Å; L317-K321 VanDerWaalsContact O-N 3.12Å; D318-K321 PolarHBondContact O-N 3.48Å; Y319-K321 VanDerWaalsContact C-N 3.29Å; Y319-K321 PolarHBondContact O-N 3.14Å; K321-H324 PolarHBondContact O-N 3.4Å; K321-S325 PolarHBondContact O-N 3.02Å; K321-S325 VanDerWaalsContact O-N 3.17Å; K321-S325 PolarHBondContact O-OG 3.05Å
322	D	95.8	Very high	91.1	Very high	59 Å²	59	85.1 Å²	85.1	32%	0.316	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-45.7	-177.8	-177.1	38.2	0	0	0	112.1	Y297 R299 D318 Y319 H324 S325	Y297-D322 WeakPolarHBondContact OH-CB 3.48Å; Y297-D322 PolarHBondContact OH-OD2 3.32Å; R299-D322 WeakPolarHBondContact CD-OD2 3.46Å; R299-D322 VanDerWaalsContact CZ-O 3.3Å; R299-D322 IonicContact CZ-OD1 3.99Å; R299-D322 PolarHBondContact NE-O 3.33Å; R299-D322 IonicContact NE-OD1 2.82Å; R299-D322 PolarHBondContact NE-OD1 3.13Å; R299-D322 VanDerWaalsContact NE-OD1 3.17Å; R299-D322 IonicContact NE-OD2 3.75Å; R299-D322 PolarHBondContact NH2-O 3.2Å; D318-D322 PolarHBondContact O-N 3.11Å; Y319-D322 PolarHBondContact O-N 3.26Å; D322-H324 PolarHBondContact O-N 3.05Å; D322-H324 VanDerWaalsContact O-N 3.13Å; D322-S325 PolarHBondContact O-N 3.47Å; D322-S325 VanDerWaalsContact O-N 3.09Å
323	V	94.3	Very high	90.7	Very high	4 Å²	4	86 Å²	86	2%	0.024	45%	0.448	C	S	.	.	H	α-helix	trans	-65.9	-17.2	179.7	-56.8	0	0	0	0	113.5	F180 R299 Q303 Y319 W320	F180-V323 HydrophobicContact CZ-CG2 3.83Å; R299-V323 HydrophobicContact CG-CG1 4.33Å; Q303-V323 HydrophobicContact CG-CB 3.73Å; Q303-V323 HydrophobicContact CG-CG1 4.23Å; Q303-V323 PolarHBondContact NE2-O 2.93Å; Y319-V323 WeakPolarHBondContact O-CG1 3.43Å; Y319-V323 WeakPolarHBondContact O-CG2 3.4Å; Y319-V323 PolarHBondContact O-N 3.29Å; W320-V323 WeakPolarHBondContact O-CG2 3.36Å
324	H	91.1	Very high	90.3	Very high	104 Å²	104	87.7 Å²	87.7	48%	0.481	45%	0.454	S	S	.	.	H	α-helix	trans	-103.4	-1.5	175.5	-67.1	93	0	0	0	113.7	W320 K321 D322	W320-H324 AromaticContact CD2-CE1 3.56Å; W320-H324 AromaticContact CD2-ND1 3.7Å; W320-H324 AromaticContact CE2-CE1 3.41Å; W320-H324 VanDerWaalsContact CE2-CE1 3.41Å; W320-H324 AromaticContact CE2-ND1 3.64Å; W320-H324 AromaticContact CE3-CE1 3.61Å; W320-H324 AromaticContact CH2-CE1 3.38Å; W320-H324 WeakPolarHBondContact CH2-CE1 3.44Å; W320-H324 AromaticContact CH2-NE2 3.88Å; W320-H324 AromaticContact CZ2-CE1 3.35Å; W320-H324 WeakPolarHBondContact CZ2-CE1 3.13Å; W320-H324 AromaticContact CZ2-NE2 3.87Å; W320-H324 AromaticContact CZ3-CE1 3.5Å; W320-H324 VanDerWaalsContact CZ3-CE1 3.5Å; W320-H324 WeakPolarHBondContact CZ3-CE1 3.38Å; W320-H324 AromaticContact NE1-ND1 3.97Å; W320-H324 PolarHBondContact O-N 3.07Å; W320-H324 PolarHBondContact O-ND1 3.34Å; K321-H324 PolarHBondContact O-N 3.4Å; D322-H324 PolarHBondContact O-N 3.05Å; D322-H324 VanDerWaalsContact O-N 3.13Å
325	S	92	Very high	89.9	Confident	42 Å²	42	84.3 Å²	84.3	29%	0.294	44%	0.443	S	S	.	.	S	Bend	trans	-76.7	154.3	178.1	-66.2	0	0	0	0	112	R299 K321 D322	R299-S325 VanDerWaalsContact NH2-C 3.35Å; R299-S325 PolarHBondContact NH2-O 3.15Å; K321-S325 PolarHBondContact O-N 3.02Å; K321-S325 VanDerWaalsContact O-N 3.17Å; K321-S325 PolarHBondContact O-OG 3.05Å; D322-S325 PolarHBondContact O-N 3.47Å; D322-S325 VanDerWaalsContact O-N 3.09Å
326	P	87.8	Confident	89.4	Confident	121 Å²	121	85.6 Å²	85.6	79%	0.786	45%	0.452	S	S	*	.	S	Bend	trans	-83.1	154.4	165.7	32.3	-32.5	0	0	0	111.4
327	P	86.9	Confident	88.9	Confident	100 Å²	100	91 Å²	91	65%	0.649	48%	0.48	S	S	*	.	S	Bend	cis	-69.4	160.7	-10.6	31.8	-35.3	0	0	0	111.1	R299	R299-P327 VanDerWaalsContact CZ-O 3.25Å; R299-P327 PolarHBondContact NH1-O 3.07Å; R299-P327 PolarHBondContact NH2-O 3.14Å
328	T	83.5	Confident	88.2	Confident	115 Å²	115	92.2 Å²	92.2	71%	0.706	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-55.7	147.3	168	49.3	0	0	0	0	109.4
329	C	85.9	Confident	87.5	Confident	27 Å²	27	92.7 Å²	92.7	18%	0.182	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-61.4	152.9	177.8	95.8	0	0	0	0	110	R299 C300 Q303	R299-C329 HydrophobicContact CB-CB 4.47Å; R299-C329 HydrophobicContact CG-CB 4.11Å; C300-C329 WeakPolarHBondContact CA-SG 3.49Å; C300-C329 HydrophobicContact CB-CB 3.99Å; C300-C329 WeakPolarHBondContact CB-SG 3.48Å; C300-C329 WeakPolarHBondContact SG-CB 3.27Å; C300-C329 CovalentContact SG-SG 2.01Å; C300-C329 PolarHBondContact SG-SG 3.4Å; Q303-C329 PolarHBondContact OE1-SG 3.16Å
330	S	82.8	Confident	86.8	Confident	78 Å²	78	96.5 Å²	96.5	55%	0.545	51%	0.513	S	S	.	.			trans	-124.9	135.2	173.6	179.9	0	0	0	0	108.6	L332	S330-L332 WeakPolarHBondContact CB-O 3.4Å; S330-L332 WeakPolarHBondContact OG-CA 3.21Å; S330-L332 WeakPolarHBondContact OG-CB 3.32Å; S330-L332 PolarHBondContact OG-N 3.21Å; S330-L332 PolarHBondContact OG-O 3.14Å
331	W	76.3	Confident	85.9	Confident	199 Å²	199	101.9 Å²	101.9	75%	0.754	55%	0.546	S	S	*	.			trans	-83.3	-6.4	167.2	-64.7	108.2	0	0	0	112.3	C300 C301	C300-W331 VanDerWaalsContact C-CZ2 3.49Å; C300-W331 HydrophobicContact CB-CD2 3.67Å; C300-W331 HydrophobicContact CB-CE3 4Å; C300-W331 HydrophobicContact CB-CG 4.43Å; C300-W331 HydrophobicContact CB-CH2 3.51Å; C300-W331 HydrophobicContact CB-CZ2 3.13Å; C300-W331 HydrophobicContact CB-CZ3 3.92Å; C301-W331 HydrophobicContact CB-CH2 4.24Å
332	L	58.3	Low	85	Confident	219 Å²	219	97.1 Å²	97.1	100%	1.147	54%	0.535	S	S	*	.			trans	-101.3	0	176.6	-59.1	169.6	0	0	0	109.9	S330	S330-L332 WeakPolarHBondContact CB-O 3.4Å; S330-L332 WeakPolarHBondContact OG-CA 3.21Å; S330-L332 WeakPolarHBondContact OG-CB 3.32Å; S330-L332 PolarHBondContact OG-N 3.21Å; S330-L332 PolarHBondContact OG-O 3.14Å

Retrieved 332 of 332 residues in 198.2 ms (Link to these results)

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