A0A087Y1U5_POEFO Loading...

Tyrosine aminotransferase

Transaminase involved in tyrosine breakdown. Converts tyrosine to p-hydroxyphenylpyruvate.

AlphaFold DB , UniProt , Accession A0A087Y1U5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 449 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	30.6	Very low	245 Å²	245	167.9 Å²	167.9	100%	1.207	86%	0.859	S	S	*	*				0	114.1	0	-82	178.8	178.3	0	0	107.2
2	D	30	Very low	30.8	Very low	150 Å²	150	163.9 Å²	163.9	80%	0.802	86%	0.857	S	S	*	*			trans	-54.5	141.1	-175.7	-79	-41.1	0	0	0	113.9
3	T	31.3	Very low	30.9	Very low	145 Å²	145	166.6 Å²	166.6	89%	0.89	86%	0.858	S	S	*	*			trans	-122	105.5	154.8	28.5	0	0	0	0	108.8
4	K	32	Very low	31.1	Very low	181 Å²	181	163.7 Å²	163.7	79%	0.787	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-72.3	131	180	-73.2	178.2	175.2	176.7	0	110.9
5	A	31.7	Very low	31	Very low	94 Å²	94	163.6 Å²	163.6	78%	0.777	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-72.2	135.2	166.3	0	0	0	0	0	110.8
6	Y	29.4	Very low	31.1	Very low	233 Å²	233	161.8 Å²	161.8	91%	0.914	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-84.2	118.6	170.8	-80.1	-93.8	0	0	0	109.8
7	V	28.8	Very low	31.2	Very low	128 Å²	128	161.9 Å²	161.9	78%	0.776	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-101.2	117.9	170.5	175.3	0	0	0	0	108.1
8	V	29.7	Very low	31.4	Very low	127 Å²	127	159.7 Å²	159.7	77%	0.77	85%	0.853	S	S	*	*			trans	-90.7	107.2	171	177.7	0	0	0	0	108.4
9	Q	28.6	Very low	31.5	Very low	168 Å²	168	155.4 Å²	155.4	79%	0.785	85%	0.85	S	S	*	*			trans	-78.1	115.3	167.9	-86	-174.9	-24.7	0	0	110
10	M	27.8	Very low	31.8	Very low	180 Å²	180	158.1 Å²	158.1	89%	0.887	85%	0.853	S	S	*	*			trans	-88.5	114.9	162.5	-74.2	-163.6	-178.3	0	0	109.9
11	K	29.8	Very low	32.1	Very low	196 Å²	196	157.5 Å²	157.5	85%	0.852	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-86.1	116.2	165.7	-77.4	-179	176.2	176.8	0	108.9
12	S	32.4	Very low	32	Very low	120 Å²	120	149.6 Å²	149.6	84%	0.839	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-92.5	128.6	167	51.8	0	0	0	0	110.4
13	K	33	Very low	32.3	Very low	199 Å²	199	145.3 Å²	145.3	87%	0.865	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-91.6	148.1	162.9	-82.4	-176.6	175.2	-179.1	0	108.8
14	P	32.8	Very low	32.8	Very low	126 Å²	126	147.3 Å²	147.3	82%	0.818	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-82.4	133.2	177.6	32.1	-29.8	0	0	0	111
15	L	30.3	Very low	33.5	Very low	162 Å²	162	147.6 Å²	147.6	85%	0.848	83%	0.833	S	S	*	*			trans	-99.8	114.3	163.6	-103.1	131.6	0	0	0	107.7
16	T	32.7	Very low	34.3	Very low	135 Å²	135	149 Å²	149	83%	0.828	83%	0.834	S	S	*	*			trans	-81.5	118.9	168.2	38.4	0	0	0	0	109.6
17	L	33.2	Very low	35.4	Very low	164 Å²	164	142.4 Å²	142.4	86%	0.859	83%	0.828	S	S	*	*			trans	-129.4	111.5	163.5	-87	162.9	0	0	0	108.9
18	S	33.7	Very low	36.9	Very low	121 Å²	121	144.9 Å²	144.9	85%	0.846	83%	0.828	S	S	*	*			trans	-84.4	135.9	167.9	58	0	0	0	0	110
19	G	32.8	Very low	38.1	Very low	78 Å²	78	144.7 Å²	144.7	80%	0.804	83%	0.83	S	S	*	*			trans	166.3	101.6	165.5	0	0	0	0	0	113.4
20	K	39.1	Very low	39.3	Very low	210 Å²	210	145 Å²	145	91%	0.913	83%	0.831	S	S	*	*			trans	-68	135.7	175.1	-70.1	175.3	173.9	178.1	0	111.4
21	V	36.6	Very low	41.2	Very low	146 Å²	146	141.5 Å²	141.5	89%	0.885	82%	0.824	S	S	*	*			trans	-140.9	129.4	147	-176.1	0	0	0	0	108
22	G	36.9	Very low	43.2	Very low	78 Å²	78	142.6 Å²	142.6	80%	0.804	82%	0.823	S	S	*	*			trans	-77.4	153.4	-175.4	0	0	0	0	0	114
23	G	34.8	Very low	45.1	Very low	60 Å²	60	146.9 Å²	146.9	62%	0.619	82%	0.82	S	S	*	*			trans	-158.7	105.8	162.9	0	0	0	0	0	107.6	F25	G23-F25 VanDerWaalsContact C-N 3.32Å; G23-F25 PolarHBondContact O-N 2.88Å
24	L	43.3	Very low	47.4	Very low	187 Å²	187	146.9 Å²	146.9	98%	0.979	82%	0.824	S	S	*	*			trans	-69.3	91.2	170.2	-90.4	103.7	0	0	0	108.5
25	F	46	Very low	50	Low	188 Å²	188	149.5 Å²	149.5	83%	0.825	82%	0.817	S	S	*	*			trans	-89.9	131.8	150.8	-72.1	-84.9	0	0	0	107.1	G23 A27	G23-F25 VanDerWaalsContact C-N 3.32Å; G23-F25 PolarHBondContact O-N 2.88Å; F25-A27 PolarHBondContact O-N 3.36Å
26	P	48.9	Very low	52.8	Low	123 Å²	123	153.3 Å²	153.3	80%	0.799	82%	0.82	S	S	*	*			trans	-61.1	115.2	171.5	25	-30	0	0	0	107.6	K28	P26-K28 PolarHBondContact O-N 3.06Å
27	A	53	Low	55.5	Low	95 Å²	95	151 Å²	151	79%	0.785	80%	0.8	S	S	*	*			trans	-58.6	113	176.5	0	0	0	0	0	108.2	F25	F25-A27 PolarHBondContact O-N 3.36Å
28	K	58.6	Low	58.4	Low	179 Å²	179	149.1 Å²	149.1	78%	0.778	80%	0.795	S	S	*	*			trans	-54.9	129.1	168.4	-74.6	-176.8	177.7	-179.7	0	107.1	P26 H30	P26-K28 PolarHBondContact O-N 3.06Å; K28-H30 PolarHBondContact O-N 3.08Å
29	P	54.8	Low	61.3	Low	124 Å²	124	149.8 Å²	149.8	81%	0.805	78%	0.783	S	S	*	*			trans	-60.5	114.7	177.2	23.2	-29.9	0	0	0	107.8	S31	P29-S31 PolarHBondContact O-N 2.68Å
30	H	55.7	Low	64.3	Low	174 Å²	174	149.6 Å²	149.6	81%	0.806	77%	0.768	S	S	*	*			trans	-67.6	82.8	167.8	-73.9	-44.4	0	0	0	107.7	K28 R32	K28-H30 PolarHBondContact O-N 3.08Å; H30-R32 PolarHBondContact O-N 3.32Å
31	S	66.3	Low	67	Low	106 Å²	106	143 Å²	143	74%	0.741	75%	0.747	S	S	*	*			trans	-59.6	86.7	161	159.9	0	0	0	0	107.3	P29 R33	P29-S31 PolarHBondContact O-N 2.68Å; S31-R33 PolarHBondContact O-N 3.02Å
32	R	71.9	Confident	69.7	Low	220 Å²	220	142.6 Å²	142.6	83%	0.83	74%	0.736	S	S	*	*			trans	-63.4	117	167	-76.8	-176	175.5	-176.8	-1	106.4	H30 Q34	H30-R32 PolarHBondContact O-N 3.32Å; R32-Q34 PolarHBondContact O-N 3.4Å; R32-Q34 VanDerWaalsContact O-N 3.14Å
33	R	73.2	Confident	72.5	Confident	210 Å²	210	143.3 Å²	143.3	79%	0.792	72%	0.72	S	S	*	*			trans	-52.9	120.7	174	-66.4	-178.5	178.7	178.9	-1.6	108.2	S31	S31-R33 PolarHBondContact O-N 3.02Å
34	Q	81.1	Confident	75.4	Confident	199 Å²	199	143.4 Å²	143.4	93%	0.93	71%	0.711	S	S	*	*	S	Bend	trans	-87	-12.2	-178.8	-65.5	-172.8	-6.8	0	0	112.9	R32	R32-Q34 PolarHBondContact O-N 3.4Å; R32-Q34 VanDerWaalsContact O-N 3.14Å
35	R	87.2	Confident	77.8	Confident	180 Å²	180	141.3 Å²	141.3	68%	0.679	69%	0.69	S	S	*	*	S	Bend	trans	-151.6	161.6	177	65.7	-177.8	-174.4	-175.8	1.4	110.9	E37	R35-E37 IonicContact CZ-OE2 3.72Å; R35-E37 IonicContact NE-OE2 2.68Å; R35-E37 PolarHBondContact NE-OE2 3.03Å; R35-E37 IonicContact NH2-OE2 2.88Å; R35-E37 PolarHBondContact NH2-OE2 2.94Å; R35-E37 PolarHBondContact O-N 3.29Å
36	W	89.5	Confident	80	Confident	242 Å²	242	136.2 Å²	136.2	92%	0.917	67%	0.671	S	S	*	*			trans	-66.8	119.2	169.4	-66.9	101	0	0	0	109.8
37	E	89.6	Confident	82.2	Confident	86 Å²	86	133.7 Å²	133.7	40%	0.402	65%	0.654	S	S	.	*			trans	-142.1	78.1	175.9	-165.2	172.3	146	0	0	108	R35 K39	R35-E37 IonicContact CZ-OE2 3.72Å; R35-E37 IonicContact NE-OE2 2.68Å; R35-E37 PolarHBondContact NE-OE2 3.03Å; R35-E37 IonicContact NH2-OE2 2.88Å; R35-E37 PolarHBondContact NH2-OE2 2.94Å; R35-E37 PolarHBondContact O-N 3.29Å; E37-K39 WeakPolarHBondContact OE1-CE 3.41Å; E37-K39 IonicContact OE1-NZ 2.66Å; E37-K39 PolarHBondContact OE1-NZ 3.17Å
38	V	93.1	Very high	83.9	Confident	125 Å²	125	134.5 Å²	134.5	76%	0.758	64%	0.644	S	S	*	*			trans	-86.5	120.2	177	-176.1	0	0	0	0	107.8
39	K	94.3	Very high	85.5	Confident	135 Å²	135	128.8 Å²	128.8	59%	0.587	62%	0.622	S	S	*	*			trans	-112.1	142.2	179.2	-64.6	-176.9	-178.5	172.7	0	110.1	E37	E37-K39 WeakPolarHBondContact OE1-CE 3.41Å; E37-K39 IonicContact OE1-NZ 2.66Å; E37-K39 PolarHBondContact OE1-NZ 3.17Å
40	P	96	Very high	87.1	Confident	75 Å²	75	123.5 Å²	123.5	49%	0.487	59%	0.588	S	S	.	*			trans	-63.8	153.2	170.7	26.1	-31.3	0	0	0	110.7	R45	P40-R45 HydrophobicContact CB-CG 4.25Å; P40-R45 HydrophobicContact CG-CG 3.86Å; P40-R45 PolarHBondContact O-NE 3.45Å; P40-R45 PolarHBondContact O-NH2 2.83Å
41	S	96.2	Very high	88.6	Confident	70 Å²	70	116.7 Å²	116.7	49%	0.49	56%	0.557	S	S	.	*			trans	-64.8	157.1	175.2	70.2	0	0	0	0	110.9	S44 R45	S41-S44 PolarHBondContact N-OG 2.98Å; S41-S44 PolarHBondContact O-N 3.1Å; S41-S44 PolarHBondContact O-OG 3.04Å; S41-S44 WeakPolarHBondContact OG-CB 3.47Å; S41-S44 PolarHBondContact OG-N 3Å; S41-S44 PolarHBondContact OG-OG 3.29Å; S41-R45 PolarHBondContact O-N 3.1Å; S41-R45 VanDerWaalsContact O-N 3.16Å
42	E	94.2	Very high	89.6	Confident	139 Å²	139	118.8 Å²	118.8	65%	0.65	55%	0.549	S	S	*	.	H	α-helix	trans	-63	-44.4	176.6	-69	174.9	177.2	0	0	111.4	S44 R45 N46	E42-S44 VanDerWaalsContact C-N 3.31Å; E42-S44 PolarHBondContact O-N 3.42Å; E42-R45 PolarHBondContact O-N 2.98Å; E42-N46 WeakPolarHBondContact O-CB 3.31Å; E42-N46 VanDerWaalsContact O-CG 3.28Å; E42-N46 PolarHBondContact O-N 3.39Å
43	M	94.9	Very high	90.3	Very high	92 Å²	92	110.6 Å²	110.6	45%	0.453	53%	0.528	S	S	.	.	H	α-helix	trans	-50.2	-50.7	172.8	177.6	177.5	-168	0	0	111.6	R45 N46 T47 S173	M43-R45 VanDerWaalsContact C-N 3.3Å; M43-R45 PolarHBondContact O-N 2.65Å; M43-N46 PolarHBondContact O-N 3.48Å; M43-N46 VanDerWaalsContact O-N 3.13Å; M43-T47 PolarHBondContact O-N 3.33Å; M43-T47 PolarHBondContact O-OG1 3.15Å; M43-S173 WeakPolarHBondContact CG-O 3.41Å
44	S	95.8	Very high	91	Very high	62 Å²	62	102.5 Å²	102.5	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-65.3	-31.2	-178.9	67.4	0	0	0	0	113.6	S41 E42	S41-S44 PolarHBondContact N-OG 2.98Å; S41-S44 PolarHBondContact O-N 3.1Å; S41-S44 PolarHBondContact O-OG 3.04Å; S41-S44 WeakPolarHBondContact OG-CB 3.47Å; S41-S44 PolarHBondContact OG-N 3Å; S41-S44 PolarHBondContact OG-OG 3.29Å; E42-S44 VanDerWaalsContact C-N 3.31Å; E42-S44 PolarHBondContact O-N 3.42Å
45	R	93.7	Very high	91.3	Very high	143 Å²	143	94 Å²	94	54%	0.54	46%	0.462	S	S	.	.	H	α-helix	trans	-73.7	-31.8	174.7	-78.3	-176.8	-98.6	148.5	-5.4	112.4	P40 S41 E42 M43	P40-R45 HydrophobicContact CB-CG 4.25Å; P40-R45 HydrophobicContact CG-CG 3.86Å; P40-R45 PolarHBondContact O-NE 3.45Å; P40-R45 PolarHBondContact O-NH2 2.83Å; S41-R45 PolarHBondContact O-N 3.1Å; S41-R45 VanDerWaalsContact O-N 3.16Å; E42-R45 PolarHBondContact O-N 2.98Å; M43-R45 VanDerWaalsContact C-N 3.3Å; M43-R45 PolarHBondContact O-N 2.65Å
46	N	92.8	Very high	91.4	Very high	81 Å²	81	91 Å²	91	43%	0.433	46%	0.459	S	S	.	.	H	α-helix	trans	-87.5	-14.3	-178.3	-65.3	-6.2	0	0	0	112.9	E42 M43 L48	E42-N46 WeakPolarHBondContact O-CB 3.31Å; E42-N46 VanDerWaalsContact O-CG 3.28Å; E42-N46 PolarHBondContact O-N 3.39Å; M43-N46 PolarHBondContact O-N 3.48Å; M43-N46 VanDerWaalsContact O-N 3.13Å; N46-L48 PolarHBondContact O-N 2.73Å; N46-L48 VanDerWaalsContact O-N 3.1Å
47	T	94.9	Very high	91.3	Very high	70 Å²	70	82.3 Å²	82.3	43%	0.429	45%	0.445	S	S	.	.			trans	-72.3	101.4	174.9	-57	0	0	0	0	110.7	M43 T169 S173	M43-T47 PolarHBondContact O-N 3.33Å; M43-T47 PolarHBondContact O-OG1 3.15Å; T47-T169 HydrophobicContact CG2-CG2 4.15Å; T47-S173 VanDerWaalsContact OG1-CB 3.27Å; T47-S173 WeakPolarHBondContact OG1-CB 3.4Å
48	L	89.4	Confident	91.3	Very high	112 Å²	112	79.1 Å²	79.1	59%	0.586	43%	0.43	S	S	*	.			trans	-126.2	131.3	173.5	-175.9	69.2	0	0	0	109.6	N46 P50 A53 T169	N46-L48 PolarHBondContact O-N 2.73Å; N46-L48 VanDerWaalsContact O-N 3.1Å; L48-P50 WeakPolarHBondContact O-CD 3.35Å; L48-A53 HydrophobicContact CD1-CB 3.95Å; L48-A53 HydrophobicContact CD2-CB 4.2Å; L48-A53 HydrophobicContact CG-CB 4.15Å; L48-T169 WeakPolarHBondContact O-CG2 3.37Å; L48-T169 PolarHBondContact O-OG1 3.43Å
49	N	91.2	Very high	91.1	Very high	59 Å²	59	80.4 Å²	80.4	32%	0.316	43%	0.426	S	S	.	.			trans	-95.1	112.6	170.2	-175.6	-35.8	0	0	0	109.3	I51 R52 A53 S165	N49-I51 VanDerWaalsContact C-N 3.26Å; N49-I51 PolarHBondContact O-N 3.39Å; N49-I51 WeakPolarHBondContact OD1-CB 3.41Å; N49-I51 PolarHBondContact OD1-N 3.34Å; N49-R52 HydrophobicContact CB-CB 4.23Å; N49-R52 HydrophobicContact CB-CG 4.25Å; N49-R52 PolarHBondContact O-N 3.07Å; N49-A53 PolarHBondContact O-N 2.74Å; N49-S165 PolarHBondContact OD1-OG 3.43Å
50	P	87.9	Confident	91	Very high	14 Å²	14	76.6 Å²	76.6	9%	0.091	41%	0.412	C	S	.	.	H	α-helix	trans	-52.4	-39.2	-178.6	-29.1	33.8	0	0	0	114.5	L48 R52 A53 I54 K168	L48-P50 WeakPolarHBondContact O-CD 3.35Å; P50-R52 PolarHBondContact O-N 3.3Å; P50-A53 PolarHBondContact O-N 3.31Å; P50-I54 PolarHBondContact O-N 2.94Å; P50-I54 VanDerWaalsContact O-N 3.09Å; P50-K168 HydrophobicContact CG-CD 4.38Å
51	I	86.9	Confident	91	Very high	30 Å²	30	79 Å²	79	15%	0.154	42%	0.419	C	S	.	.	H	α-helix	trans	-61.8	-45.4	178	-62.8	169.7	0	0	0	110.3	N49 V55 S165 L400 A404 F405	N49-I51 VanDerWaalsContact C-N 3.26Å; N49-I51 PolarHBondContact O-N 3.39Å; N49-I51 WeakPolarHBondContact OD1-CB 3.41Å; N49-I51 PolarHBondContact OD1-N 3.34Å; I51-V55 HydrophobicContact CG2-CG2 4.15Å; I51-V55 VanDerWaalsContact O-CB 3.27Å; I51-V55 WeakPolarHBondContact O-CB 3.48Å; I51-V55 WeakPolarHBondContact O-CG2 3.44Å; I51-V55 PolarHBondContact O-N 2.68Å; I51-S165 VanDerWaalsContact CD1-OG 3.3Å; I51-S165 WeakPolarHBondContact CD1-OG 3.38Å; I51-L400 HydrophobicContact CG2-CD1 4.13Å; I51-L400 HydrophobicContact CG2-CD2 4.31Å; I51-A404 HydrophobicContact CB-CB 4.47Å; I51-A404 HydrophobicContact CG1-CB 3.98Å; I51-F405 HydrophobicContact CD1-CE1 3.83Å; I51-F405 HydrophobicContact CD1-CZ 4.26Å; I51-F405 HydrophobicContact CG1-CE1 4.26Å
52	R	87.2	Confident	91	Very high	150 Å²	150	78.2 Å²	78.2	57%	0.566	41%	0.412	S	S	*	.	H	α-helix	trans	-69.9	-39.6	178.3	-67.9	-65.5	178.6	-172.7	-2.8	111.8	N49 P50 I54 V55 D56	N49-R52 HydrophobicContact CB-CB 4.23Å; N49-R52 HydrophobicContact CB-CG 4.25Å; N49-R52 PolarHBondContact O-N 3.07Å; P50-R52 PolarHBondContact O-N 3.3Å; R52-I54 PolarHBondContact O-N 3.36Å; R52-V55 PolarHBondContact O-N 3.19Å; R52-D56 WeakPolarHBondContact O-CB 3.33Å; R52-D56 PolarHBondContact O-N 2.87Å
53	A	86.8	Confident	91.1	Very high	49 Å²	49	73.6 Å²	73.6	41%	0.405	39%	0.392	S	S	.	.	H	α-helix	trans	-56.3	-38.8	177.5	0	0	0	0	0	112.3	L48 N49 P50	L48-A53 HydrophobicContact CD1-CB 3.95Å; L48-A53 HydrophobicContact CD2-CB 4.2Å; L48-A53 HydrophobicContact CG-CB 4.15Å; N49-A53 PolarHBondContact O-N 2.74Å; P50-A53 PolarHBondContact O-N 3.31Å
54	I	88.4	Confident	91.2	Very high	39 Å²	39	75.8 Å²	75.8	20%	0.2	41%	0.413	C	S	.	.	H	α-helix	trans	-79.9	-57.2	176	-63.8	-177.2	0	0	0	110.9	P50 R52 D56 G57 M58 V385 P401 A404	P50-I54 PolarHBondContact O-N 2.94Å; P50-I54 VanDerWaalsContact O-N 3.09Å; R52-I54 PolarHBondContact O-N 3.36Å; I54-D56 VanDerWaalsContact C-N 3.31Å; I54-D56 PolarHBondContact O-N 3.34Å; I54-G57 WeakPolarHBondContact O-CA 3.36Å; I54-G57 PolarHBondContact O-N 3.07Å; I54-M58 HydrophobicContact CG2-CG 4.26Å; I54-M58 HydrophobicContact CG2-SD 4.02Å; I54-M58 WeakPolarHBondContact O-CG 3.49Å; I54-M58 PolarHBondContact O-N 3.38Å; I54-M58 VanDerWaalsContact O-N 3.15Å; I54-V385 HydrophobicContact CG2-CG1 4.19Å; I54-V385 HydrophobicContact CG2-CG2 3.96Å; I54-P401 HydrophobicContact CG2-CG 4Å; I54-A404 HydrophobicContact CD1-CB 4.03Å; I54-A404 VanDerWaalsContact CD1-N 3.31Å
55	V	87.8	Confident	91.3	Very high	22 Å²	22	77 Å²	77	13%	0.133	43%	0.427	C	S	.	.	H	α-helix	trans	-61	-37.7	-172.1	173.5	0	0	0	0	112.6	I51 R52 G57 M58 L60 F398 L400	I51-V55 HydrophobicContact CG2-CG2 4.15Å; I51-V55 VanDerWaalsContact O-CB 3.27Å; I51-V55 WeakPolarHBondContact O-CB 3.48Å; I51-V55 WeakPolarHBondContact O-CG2 3.44Å; I51-V55 PolarHBondContact O-N 2.68Å; R52-V55 PolarHBondContact O-N 3.19Å; V55-G57 PolarHBondContact O-N 3.14Å; V55-M58 HydrophobicContact CG2-SD 4.47Å; V55-M58 PolarHBondContact O-N 3.45Å; V55-L60 HydrophobicContact CG1-CD1 4.11Å; V55-F398 HydrophobicContact CG1-CE1 4.43Å; V55-F398 HydrophobicContact CG1-CZ 4.15Å; V55-F398 HydrophobicContact CG2-CZ 4.14Å; V55-L400 HydrophobicContact CG2-CD1 3.56Å
56	D	88.3	Confident	91.5	Very high	116 Å²	116	73.2 Å²	73.2	62%	0.62	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-20.3	179.3	-60.2	-15.4	0	0	0	111.9	R52 I54	R52-D56 WeakPolarHBondContact O-CB 3.33Å; R52-D56 PolarHBondContact O-N 2.87Å; I54-D56 VanDerWaalsContact C-N 3.31Å; I54-D56 PolarHBondContact O-N 3.34Å
57	G	87.8	Confident	91.7	Very high	60 Å²	60	74 Å²	74	62%	0.619	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-14.8	172.2	0	0	0	0	0	113.8	I54 V55	I54-G57 WeakPolarHBondContact O-CA 3.36Å; I54-G57 PolarHBondContact O-N 3.07Å; V55-G57 PolarHBondContact O-N 3.14Å
58	M	90.3	Very high	91.8	Very high	18 Å²	18	74.7 Å²	74.7	9%	0.089	42%	0.423	C	S	.	.	S	Bend	trans	-77.5	144.9	-174.3	-72.8	172.9	84.8	0	0	113.4	I54 V55 L60 V385 T388 E389 F398 P401	I54-M58 HydrophobicContact CG2-CG 4.26Å; I54-M58 HydrophobicContact CG2-SD 4.02Å; I54-M58 WeakPolarHBondContact O-CG 3.49Å; I54-M58 PolarHBondContact O-N 3.38Å; I54-M58 VanDerWaalsContact O-N 3.15Å; V55-M58 HydrophobicContact CG2-SD 4.47Å; V55-M58 PolarHBondContact O-N 3.45Å; M58-L60 HydrophobicContact CB-CD1 4.44Å; M58-L60 HydrophobicContact CB-CD2 3.86Å; M58-L60 HydrophobicContact CB-CG 3.85Å; M58-L60 HydrophobicContact CE-CD2 3.9Å; M58-L60 PolarHBondContact O-N 2.95Å; M58-L60 VanDerWaalsContact O-N 3.17Å; M58-L60 HydrophobicContact SD-CD2 4.3Å; M58-V385 HydrophobicContact CE-CG1 4.09Å; M58-V385 HydrophobicContact CG-CG1 3.76Å; M58-V385 HydrophobicContact SD-CG1 4.19Å; M58-T388 VanDerWaalsContact CE-OG1 3.3Å; M58-T388 WeakPolarHBondContact CE-OG1 3.43Å; M58-E389 WeakPolarHBondContact CA-OE1 3.5Å; M58-E389 HydrophobicContact CB-CG 4.06Å; M58-E389 WeakPolarHBondContact CB-OE1 3.29Å; M58-E389 HydrophobicContact CE-CB 4.43Å; M58-E389 HydrophobicContact CE-CG 3.53Å; M58-E389 HydrophobicContact CG-CG 4.06Å; M58-F398 HydrophobicContact CE-CE2 4.08Å; M58-F398 HydrophobicContact SD-CE2 4.25Å; M58-P401 HydrophobicContact CE-CG 4.07Å; M58-P401 HydrophobicContact SD-CG 3.97Å
59	K	89	Confident	92.2	Very high	153 Å²	153	69.7 Å²	69.7	67%	0.665	40%	0.397	S	S	*	.			trans	-85.8	77.5	171.6	-68.4	178.1	-174.6	166.8	0	111.6	I61 E389	K59-I61 VanDerWaalsContact C-N 3.31Å; K59-I61 PolarHBondContact O-N 2.87Å; K59-E389 PolarHBondContact N-OE1 3.4Å
60	L	90.8	Very high	92.5	Very high	55 Å²	55	67.8 Å²	67.8	29%	0.288	39%	0.389	S	S	.	.			trans	-85.9	61.3	-178.3	-55.8	178.3	0	0	0	112.7	V55 M58 P62 V392 F398	V55-L60 HydrophobicContact CG1-CD1 4.11Å; M58-L60 HydrophobicContact CB-CD1 4.44Å; M58-L60 HydrophobicContact CB-CD2 3.86Å; M58-L60 HydrophobicContact CB-CG 3.85Å; M58-L60 HydrophobicContact CE-CD2 3.9Å; M58-L60 PolarHBondContact O-N 2.95Å; M58-L60 VanDerWaalsContact O-N 3.17Å; M58-L60 HydrophobicContact SD-CD2 4.3Å; L60-P62 VanDerWaalsContact O-CD 3.32Å; L60-P62 WeakPolarHBondContact O-CD 3.44Å; L60-V392 HydrophobicContact CB-CG1 4.38Å; L60-V392 HydrophobicContact CD2-CB 4.46Å; L60-V392 HydrophobicContact CD2-CG1 4.45Å; L60-V392 HydrophobicContact CD2-CG2 4.06Å; L60-F398 HydrophobicContact CD1-CD1 4.37Å; L60-F398 HydrophobicContact CD1-CE1 3.77Å; L60-F398 HydrophobicContact CD1-CE2 4.31Å; L60-F398 HydrophobicContact CD1-CZ 3.75Å; L60-F398 HydrophobicContact CD2-CD2 4.09Å; L60-F398 HydrophobicContact CD2-CE2 3.85Å; L60-F398 HydrophobicContact CD2-CZ 4.13Å
61	I	95.9	Very high	92.9	Very high	125 Å²	125	67.1 Å²	67.1	64%	0.641	38%	0.384	S	S	*	.			trans	-94.7	105	175.2	-57.7	175.1	0	0	0	108.3	K59 T393	K59-I61 VanDerWaalsContact C-N 3.31Å; K59-I61 PolarHBondContact O-N 2.87Å; I61-T393 VanDerWaalsContact O-CA 3.29Å; I61-T393 WeakPolarHBondContact O-CA 3.39Å
62	P	96.4	Very high	93.3	Very high	54 Å²	54	66.4 Å²	66.4	35%	0.351	38%	0.382	S	S	.	.			trans	-70.9	157.9	-176.5	29.8	-35.4	0	0	0	112.4	L60 P64 M68 V392	L60-P62 VanDerWaalsContact O-CD 3.32Å; L60-P62 WeakPolarHBondContact O-CD 3.44Å; P62-P64 WeakPolarHBondContact O-CD 3.3Å; P62-M68 HydrophobicContact CB-SD 4.05Å; P62-V392 WeakPolarHBondContact CA-O 3.24Å; P62-V392 HydrophobicContact CB-CG1 4.44Å
63	N	96.8	Very high	93.4	Very high	41 Å²	41	62.5 Å²	62.5	22%	0.219	37%	0.371	C	S	.	.			trans	-60.8	119.9	169.6	-176.9	-26.1	0	0	0	110	A65 K66 T393 E394 S396	N63-A65 PolarHBondContact O-N 3.47Å; N63-A65 VanDerWaalsContact O-N 3.11Å; N63-A65 WeakPolarHBondContact OD1-CB 3.37Å; N63-A65 PolarHBondContact OD1-N 3.03Å; N63-K66 HydrophobicContact CB-CB 4.32Å; N63-K66 PolarHBondContact O-N 3.36Å; N63-T393 WeakPolarHBondContact CB-O 3.47Å; N63-T393 PolarHBondContact N-O 3.49Å; N63-E394 PolarHBondContact ND2-O 3.34Å; N63-S396 WeakPolarHBondContact CA-OG 3.48Å; N63-S396 WeakPolarHBondContact CB-OG 3.4Å; N63-S396 PolarHBondContact N-OG 3.48Å; N63-S396 PolarHBondContact O-OG 3.41Å
64	P	97	Very high	93.6	Very high	138 Å²	138	61.4 Å²	61.4	90%	0.896	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.6	-174.4	27.5	-36.1	0	0	0	113.9	P62	P62-P64 WeakPolarHBondContact O-CD 3.3Å
65	A	97.4	Very high	94	Very high	87 Å²	87	62.1 Å²	62.1	72%	0.719	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.8	177.3	0	0	0	0	0	113.4	N63	N63-A65 PolarHBondContact O-N 3.47Å; N63-A65 VanDerWaalsContact O-N 3.11Å; N63-A65 WeakPolarHBondContact OD1-CB 3.37Å; N63-A65 PolarHBondContact OD1-N 3.03Å
66	K	97.5	Very high	94.3	Very high	64 Å²	64	61.1 Å²	61.1	28%	0.278	36%	0.363	S	S	.	.	S	Bend	trans	-122.7	125.5	-174.1	-73.7	179.4	178.8	173.1	0	110.6	N63 M68 S396	N63-K66 HydrophobicContact CB-CB 4.32Å; N63-K66 PolarHBondContact O-N 3.36Å; K66-M68 PolarHBondContact O-N 2.93Å; K66-S396 VanDerWaalsContact O-CB 3.29Å; K66-S396 WeakPolarHBondContact O-CB 3.07Å; K66-S396 PolarHBondContact O-OG 3.31Å
67	P	97.3	Very high	94.6	Very high	98 Å²	98	58.1 Å²	58.1	64%	0.636	35%	0.349	S	S	*	.			trans	-57	139.5	171.2	-23.8	33.6	0	0	0	111.1	R428	P67-R428 PolarHBondContact O-NH1 3.37Å
68	M	97.7	Very high	95	Very high	85 Å²	85	58.8 Å²	58.8	42%	0.419	34%	0.34	S	S	.	.			trans	-69.5	128.4	178.9	-175.2	65.5	162.4	0	0	111.2	P62 K66 V392 S396 F398	P62-M68 HydrophobicContact CB-SD 4.05Å; K66-M68 PolarHBondContact O-N 2.93Å; M68-V392 HydrophobicContact CE-CG1 4.1Å; M68-V392 HydrophobicContact CE-CG2 4.32Å; M68-V392 HydrophobicContact SD-CG1 4.46Å; M68-S396 CarbonylContact C-O 3.51Å; M68-S396 WeakPolarHBondContact CA-O 2.99Å; M68-S396 VanDerWaalsContact SD-O 3.38Å; M68-F398 HydrophobicContact CE-CB 3.39Å; M68-F398 HydrophobicContact CE-CD1 4.32Å; M68-F398 HydrophobicContact CE-CG 4.19Å
69	I	97.8	Very high	95.2	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	111.2	169.5	-53.8	174.9	0	0	0	107.7	L71 S396 V397 F398 L421 E424 A425	I69-L71 HydrophobicContact CG2-CD2 4.12Å; I69-L71 HydrophobicContact CG2-CG 4.39Å; I69-S396 PolarHBondContact N-O 3.45Å; I69-V397 WeakPolarHBondContact O-CA 3.43Å; I69-F398 PolarHBondContact O-N 2.94Å; I69-L421 HydrophobicContact CD1-CD2 4.27Å; I69-L421 HydrophobicContact CG1-CD2 4.44Å; I69-L421 HydrophobicContact CG2-CB 4.45Å; I69-E424 HydrophobicContact CD1-CB 4.13Å; I69-E424 HydrophobicContact CD1-CG 3.6Å; I69-A425 HydrophobicContact CD1-CB 4.25Å; I69-A425 HydrophobicContact CG2-CB 4.03Å
70	S	96.8	Very high	95.5	Very high	20 Å²	20	56.4 Å²	56.4	14%	0.14	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	110.7	179.1	-170.5	0	0	0	0	110.5	S72 I73	S70-S72 PolarHBondContact OG-OG 3.49Å; S70-I73 WeakPolarHBondContact OG-CD1 3.4Å; S70-I73 WeakPolarHBondContact OG-CG1 3.45Å
71	L	97.2	Very high	95.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	35%	0.345	C	S	.	.			trans	-100.1	13.2	173.5	-60.1	-177.2	0	0	0	112.4	I69 V397 F398 V413 V414 V417 A425 I429	I69-L71 HydrophobicContact CG2-CD2 4.12Å; I69-L71 HydrophobicContact CG2-CG 4.39Å; L71-V397 HydrophobicContact CD1-CG1 3.96Å; L71-V397 HydrophobicContact CG-CG1 4.35Å; L71-F398 CarbonylContact C-O 3.59Å; L71-F398 VanDerWaalsContact C-O 3.29Å; L71-F398 VanDerWaalsContact CA-O 3.28Å; L71-F398 WeakPolarHBondContact CA-O 3.42Å; L71-F398 WeakPolarHBondContact CB-O 3.48Å; L71-F398 PolarHBondContact N-O 2.99Å; L71-V413 HydrophobicContact CB-CG1 4.28Å; L71-V413 HydrophobicContact CD1-CG1 3.99Å; L71-V413 HydrophobicContact CD1-CG2 4.47Å; L71-V414 WeakPolarHBondContact O-CG1 3.46Å; L71-V414 PolarHBondContact O-N 3.42Å; L71-V417 HydrophobicContact CD2-CB 4.49Å; L71-V417 HydrophobicContact CD2-CG1 3.7Å; L71-V417 HydrophobicContact CD2-CG2 4.01Å; L71-A425 HydrophobicContact CD1-CB 3.72Å; L71-A425 HydrophobicContact CD2-CB 4.43Å; L71-A425 HydrophobicContact CG-CB 4.31Å; L71-I429 HydrophobicContact CD1-CD1 4.36Å
72	S	94.6	Very high	95.9	Very high	14 Å²	14	51 Å²	51	10%	0.098	32%	0.318	C	S	.	.			trans	-104.2	-17.9	-173.5	65.1	0	0	0	0	114.1	S70 G74 F398 R412	S70-S72 PolarHBondContact OG-OG 3.49Å; S72-G74 PolarHBondContact O-N 2.87Å; S72-F398 PolarHBondContact N-O 3.08Å; S72-F398 VanDerWaalsContact N-O 3.13Å; S72-F398 WeakPolarHBondContact OG-CD1 3.45Å; S72-F398 WeakPolarHBondContact OG-CE1 3.47Å; S72-R412 PolarHBondContact O-NH2 2.96Å
73	I	90.3	Very high	96	Very high	69 Å²	69	52.6 Å²	52.6	35%	0.354	33%	0.328	S	S	.	.			trans	-85.4	113.4	-169.4	-58.5	165.6	0	0	0	111.1	S70 D75 V78 V414	S70-I73 WeakPolarHBondContact OG-CD1 3.4Å; S70-I73 WeakPolarHBondContact OG-CG1 3.45Å; I73-D75 HydrophobicContact CG2-CB 4.05Å; I73-D75 PolarHBondContact O-N 3.25Å; I73-V78 HydrophobicContact CG2-CG2 3.88Å; I73-V414 WeakPolarHBondContact O-CG1 3.36Å
74	G	91.4	Very high	96.1	Very high	25 Å²	25	51.8 Å²	51.8	26%	0.258	33%	0.325	S	S	.	.			trans	-75.6	14	-177.6	0	0	0	0	0	116.8	S72 K275 Y368	S72-G74 PolarHBondContact O-N 2.87Å; G74-K275 PolarHBondContact O-NZ 3.49Å; G74-Y368 PolarHBondContact O-OH 3.47Å
75	D	95.4	Very high	96.2	Very high	55 Å²	55	47 Å²	47	29%	0.294	29%	0.291	S	S	.	.			trans	-97.5	113.4	175.3	-177.6	-17.2	0	0	0	109.3	I73 T77 V78 P280	I73-D75 HydrophobicContact CG2-CB 4.05Å; I73-D75 PolarHBondContact O-N 3.25Å; D75-T77 PolarHBondContact O-N 2.95Å; D75-T77 WeakPolarHBondContact OD1-CB 3.45Å; D75-T77 PolarHBondContact OD1-N 2.88Å; D75-T77 PolarHBondContact OD1-OG1 3.34Å; D75-V78 HydrophobicContact CB-CG2 3.78Å; D75-V78 WeakPolarHBondContact O-CG2 3.44Å; D75-P280 WeakPolarHBondContact OD1-CG 3.12Å
76	P	94.1	Very high	96.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-12.1	-175.9	30.7	-36.8	0	0	0	113.6	L82 L278 M367 T416	P76-L82 HydrophobicContact CB-CD1 4.26Å; P76-L278 HydrophobicContact CB-CD2 3.81Å; P76-L278 HydrophobicContact CG-CD2 3.72Å; P76-M367 HydrophobicContact CB-CE 4.05Å; P76-M367 HydrophobicContact CB-SD 3.92Å; P76-M367 HydrophobicContact CG-CE 3.97Å; P76-M367 HydrophobicContact CG-SD 4.05Å; P76-T416 HydrophobicContact CB-CG2 3.75Å
77	T	96.1	Very high	96.3	Very high	53 Å²	53	44.6 Å²	44.6	33%	0.325	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-9.8	-171.4	69	0	0	0	0	114	D75 F79 G80 L278 P280	D75-T77 PolarHBondContact O-N 2.95Å; D75-T77 WeakPolarHBondContact OD1-CB 3.45Å; D75-T77 PolarHBondContact OD1-N 2.88Å; D75-T77 PolarHBondContact OD1-OG1 3.34Å; T77-F79 VanDerWaalsContact C-N 3.27Å; T77-F79 PolarHBondContact O-N 3.13Å; T77-G80 PolarHBondContact O-N 2.96Å; T77-G80 VanDerWaalsContact O-N 3.07Å; T77-L278 VanDerWaalsContact CG2-O 3.24Å; T77-L278 WeakPolarHBondContact CG2-O 3.49Å; T77-P280 HydrophobicContact CG2-CG 4.35Å
78	V	95.6	Very high	96.3	Very high	74 Å²	74	40 Å²	40	45%	0.448	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.9	-169.3	171.6	0	0	0	0	113.5	I73 D75	I73-V78 HydrophobicContact CG2-CG2 3.88Å; D75-V78 HydrophobicContact CB-CG2 3.78Å; D75-V78 WeakPolarHBondContact O-CG2 3.44Å
79	F	94.3	Very high	96.4	Very high	67 Å²	67	39.5 Å²	39.5	29%	0.294	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-6.2	-177.1	-61.4	-84.9	0	0	0	113.3	T77 N81 V417 P418 L421	T77-F79 VanDerWaalsContact C-N 3.27Å; T77-F79 PolarHBondContact O-N 3.13Å; F79-N81 VanDerWaalsContact CB-OD1 3.31Å; F79-N81 WeakPolarHBondContact CB-OD1 3.22Å; F79-N81 PolarHBondContact O-N 3.28Å; F79-N81 VanDerWaalsContact O-N 3.14Å; F79-V417 HydrophobicContact CD2-CB 4.47Å; F79-V417 HydrophobicContact CD2-CG1 4.08Å; F79-V417 HydrophobicContact CE1-CG1 4.48Å; F79-V417 HydrophobicContact CE2-CB 4.3Å; F79-V417 HydrophobicContact CE2-CG1 3.48Å; F79-V417 VanDerWaalsContact CE2-CG1 3.48Å; F79-V417 HydrophobicContact CZ-CG1 3.7Å; F79-P418 HydrophobicContact CB-CG 4.14Å; F79-L421 HydrophobicContact CD1-CD1 4.17Å; F79-L421 HydrophobicContact CE1-CD1 4.16Å
80	G	95.5	Very high	96.4	Very high	54 Å²	54	43.3 Å²	43.3	56%	0.557	27%	0.27	S	S	*	.	S	Bend	trans	71.7	-4.2	179.3	0	0	0	0	0	116.1	T77 L82	T77-G80 PolarHBondContact O-N 2.96Å; T77-G80 VanDerWaalsContact O-N 3.07Å; G80-L82 VanDerWaalsContact C-N 3.31Å
81	N	97.4	Very high	96.5	Very high	55 Å²	55	42.6 Å²	42.6	29%	0.294	27%	0.266	S	S	.	.	S	Bend	trans	-73.9	-19.3	176.4	63.4	-47.1	0	0	0	113.5	F79 P83 T416 P418	F79-N81 VanDerWaalsContact CB-OD1 3.31Å; F79-N81 WeakPolarHBondContact CB-OD1 3.22Å; F79-N81 PolarHBondContact O-N 3.28Å; F79-N81 VanDerWaalsContact O-N 3.14Å; N81-P83 VanDerWaalsContact O-CD 3.27Å; N81-P83 WeakPolarHBondContact O-CD 3.45Å; N81-T416 PolarHBondContact ND2-O 3.34Å; N81-T416 PolarHBondContact OD1-O 2.78Å; N81-P418 HydrophobicContact CB-CG 4.19Å
82	L	97.8	Very high	96.6	Very high	11 Å²	11	43.9 Å²	43.9	6%	0.058	27%	0.272	C	S	.	.	S	Bend	trans	-117	70.8	176.5	-66.8	175.6	0	0	0	110.5	P76 G80 L278 C340 T416	P76-L82 HydrophobicContact CB-CD1 4.26Å; G80-L82 VanDerWaalsContact C-N 3.31Å; L82-L278 HydrophobicContact CB-CD1 3.94Å; L82-L278 HydrophobicContact CB-CD2 4.38Å; L82-C340 HydrophobicContact CD2-CB 4.25Å; L82-T416 HydrophobicContact CD1-CG2 3.98Å
83	P	98.1	Very high	96.8	Very high	89 Å²	89	48.6 Å²	48.6	58%	0.578	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-74.6	153.1	173.5	33.3	-35.3	0	0	0	111	N81 F333	N81-P83 VanDerWaalsContact O-CD 3.27Å; N81-P83 WeakPolarHBondContact O-CD 3.45Å; P83-F333 WeakPolarHBondContact O-CE2 3.28Å
84	T	98.6	Very high	97.2	Very high	23 Å²	23	49.2 Å²	49.2	14%	0.141	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-65.5	155.7	167.5	-175.2	0	0	0	0	111.6	V88 L89 W277 V279	T84-V88 WeakPolarHBondContact OG1-CB 3.37Å; T84-V88 WeakPolarHBondContact OG1-CG1 3.47Å; T84-L89 HydrophobicContact CG2-CD1 4.42Å; T84-L89 HydrophobicContact CG2-CD2 3.61Å; T84-L89 HydrophobicContact CG2-CG 3.86Å; T84-W277 WeakPolarHBondContact CB-O 3.42Å; T84-W277 PolarHBondContact OG1-O 2.64Å; T84-W277 VanDerWaalsContact OG1-O 3.11Å; T84-V279 HydrophobicContact CG2-CG1 3.91Å
85	D	98.6	Very high	97.6	Very high	37 Å²	37	48.2 Å²	48.2	20%	0.198	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-65	150.6	178.3	-168.9	-97.8	0	0	0	113.6	A87 V88 L89 T329 P330 F333	D85-A87 VanDerWaalsContact C-N 3.28Å; D85-A87 PolarHBondContact O-N 2.99Å; D85-A87 WeakPolarHBondContact OD1-CB 3.5Å; D85-A87 PolarHBondContact OD1-N 3.15Å; D85-V88 HydrophobicContact CB-CG2 4.14Å; D85-V88 WeakPolarHBondContact O-CB 3.49Å; D85-V88 PolarHBondContact O-N 2.93Å; D85-V88 VanDerWaalsContact O-N 3.11Å; D85-L89 PolarHBondContact O-N 3.03Å; D85-T329 HydrophobicContact CB-CG2 4.22Å; D85-P330 VanDerWaalsContact OD1-CD 3.29Å; D85-P330 WeakPolarHBondContact OD1-CD 3.35Å; D85-F333 HydrophobicContact CB-CB 4.09Å; D85-F333 HydrophobicContact CB-CD1 4.27Å; D85-F333 HydrophobicContact CB-CD2 3.67Å; D85-F333 HydrophobicContact CB-CE2 4.13Å; D85-F333 HydrophobicContact CB-CG 3.74Å
86	A	98.5	Very high	97.7	Very high	72 Å²	72	49.3 Å²	49.3	60%	0.595	29%	0.289	S	S	*	.	H	α-helix	trans	-61.3	-32.8	177.9	0	0	0	0	0	113.2	V88 L89 Q90	A86-V88 VanDerWaalsContact C-N 3.3Å; A86-V88 PolarHBondContact O-N 3.43Å; A86-L89 PolarHBondContact O-N 3.39Å; A86-Q90 WeakPolarHBondContact O-CB 3.46Å; A86-Q90 PolarHBondContact O-N 3.43Å
87	A	98.6	Very high	97.9	Very high	30 Å²	30	55 Å²	55	25%	0.248	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-35.6	175.6	0	0	0	0	0	111.9	D85 Q90 A91	D85-A87 VanDerWaalsContact C-N 3.28Å; D85-A87 PolarHBondContact O-N 2.99Å; D85-A87 WeakPolarHBondContact OD1-CB 3.5Å; D85-A87 PolarHBondContact OD1-N 3.15Å; A87-Q90 PolarHBondContact O-N 2.69Å; A87-A91 WeakPolarHBondContact O-CB 3.39Å; A87-A91 PolarHBondContact O-N 2.95Å
88	V	98.8	Very high	98.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.4	-43.5	175.8	178.5	0	0	0	0	110.5	T84 D85 A86 M92 W282 I325 T329	T84-V88 WeakPolarHBondContact OG1-CB 3.37Å; T84-V88 WeakPolarHBondContact OG1-CG1 3.47Å; D85-V88 HydrophobicContact CB-CG2 4.14Å; D85-V88 WeakPolarHBondContact O-CB 3.49Å; D85-V88 PolarHBondContact O-N 2.93Å; D85-V88 VanDerWaalsContact O-N 3.11Å; A86-V88 VanDerWaalsContact C-N 3.3Å; A86-V88 PolarHBondContact O-N 3.43Å; V88-M92 PolarHBondContact O-N 3.41Å; V88-W282 HydrophobicContact CG1-CH2 3.6Å; V88-W282 HydrophobicContact CG1-CZ3 3.52Å; V88-I325 HydrophobicContact CG1-CD1 4.22Å; V88-I325 HydrophobicContact CG1-CG1 4.14Å; V88-I325 HydrophobicContact CG1-CG2 4.39Å; V88-I325 HydrophobicContact CG2-CG2 4.33Å; V88-T329 HydrophobicContact CG2-CG2 4.14Å; V88-T329 VanDerWaalsContact CG2-OG1 3.23Å; V88-T329 WeakPolarHBondContact CG2-OG1 3.44Å
89	L	98.7	Very high	98.2	Very high	76 Å²	76	56.8 Å²	56.8	40%	0.398	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-40.5	174.6	-62.8	178.2	0	0	0	111.9	T84 D85 A86 M92 K93 W282	T84-L89 HydrophobicContact CG2-CD1 4.42Å; T84-L89 HydrophobicContact CG2-CD2 3.61Å; T84-L89 HydrophobicContact CG2-CG 3.86Å; D85-L89 PolarHBondContact O-N 3.03Å; A86-L89 PolarHBondContact O-N 3.39Å; L89-M92 PolarHBondContact O-N 3.4Å; L89-K93 WeakPolarHBondContact O-CG 3.43Å; L89-K93 PolarHBondContact O-N 2.92Å; L89-K93 VanDerWaalsContact O-N 3.1Å; L89-W282 HydrophobicContact CD2-CH2 4.25Å; L89-W282 HydrophobicContact CD2-CZ2 4.06Å
90	Q	98.8	Very high	98.4	Very high	86 Å²	86	61.7 Å²	61.7	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-42.4	179.4	-169.7	58	45.5	0	0	111.4	A86 A87 M92 K93 D94	A86-Q90 WeakPolarHBondContact O-CB 3.46Å; A86-Q90 PolarHBondContact O-N 3.43Å; A87-Q90 PolarHBondContact O-N 2.69Å; Q90-M92 PolarHBondContact O-N 2.85Å; Q90-K93 WeakPolarHBondContact O-CB 3.48Å; Q90-K93 PolarHBondContact O-N 3.02Å; Q90-D94 PolarHBondContact NE2-OD1 2.88Å; Q90-D94 VanDerWaalsContact O-CG 3.23Å; Q90-D94 PolarHBondContact O-N 3.07Å
91	A	98.9	Very high	98.5	Very high	5 Å²	5	59.7 Å²	59.7	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-57.3	-38.8	175.5	0	0	0	0	0	112.5	A87 A95 A321 I325	A87-A91 WeakPolarHBondContact O-CB 3.39Å; A87-A91 PolarHBondContact O-N 2.95Å; A91-A95 WeakPolarHBondContact O-CB 3.43Å; A91-A95 PolarHBondContact O-N 3.27Å; A91-A321 HydrophobicContact CB-CB 3.97Å; A91-A321 WeakPolarHBondContact O-CB 3.46Å; A91-I325 HydrophobicContact CB-CG1 3.77Å
92	M	98.8	Very high	98.5	Very high	27 Å²	27	61.3 Å²	61.3	13%	0.133	33%	0.325	C	S	.	.	H	α-helix	trans	-65.7	-44.9	173.8	-75	-61.5	-66.6	0	0	112.4	V88 L89 Q90 A95 I96 W282 V317 V318 A321	V88-M92 PolarHBondContact O-N 3.41Å; L89-M92 PolarHBondContact O-N 3.4Å; Q90-M92 PolarHBondContact O-N 2.85Å; M92-A95 PolarHBondContact O-N 2.94Å; M92-I96 VanDerWaalsContact O-CG1 3.29Å; M92-I96 WeakPolarHBondContact O-CG1 3.27Å; M92-I96 PolarHBondContact O-N 2.96Å; M92-W282 HydrophobicContact CB-CH2 4.36Å; M92-W282 HydrophobicContact CG-CE3 4.12Å; M92-W282 HydrophobicContact CG-CH2 3.32Å; M92-W282 HydrophobicContact CG-CZ2 4.09Å; M92-W282 HydrophobicContact CG-CZ3 3.34Å; M92-W282 HydrophobicContact SD-CE3 4.18Å; M92-W282 HydrophobicContact SD-CH2 4.42Å; M92-W282 HydrophobicContact SD-CZ3 3.93Å; M92-V317 HydrophobicContact CE-CB 4.44Å; M92-V317 HydrophobicContact CE-CG1 3.68Å; M92-V318 HydrophobicContact CE-CB 4.47Å; M92-V318 HydrophobicContact CE-CG2 3.66Å; M92-V318 HydrophobicContact SD-CB 4.22Å; M92-V318 HydrophobicContact SD-CG1 4.35Å; M92-V318 HydrophobicContact SD-CG2 3.96Å; M92-A321 HydrophobicContact CG-CB 4.21Å; M92-A321 HydrophobicContact SD-CB 3.57Å; M92-A321 VanDerWaalsContact SD-CB 3.57Å
93	K	98.9	Very high	98.5	Very high	112 Å²	112	63 Å²	63	49%	0.487	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-47.7	176.1	-69.2	172.6	-177.8	175.8	0	110.9	L89 Q90 A95 I96 D97	L89-K93 WeakPolarHBondContact O-CG 3.43Å; L89-K93 PolarHBondContact O-N 2.92Å; L89-K93 VanDerWaalsContact O-N 3.1Å; Q90-K93 WeakPolarHBondContact O-CB 3.48Å; Q90-K93 PolarHBondContact O-N 3.02Å; K93-A95 VanDerWaalsContact C-N 3.3Å; K93-A95 PolarHBondContact O-N 3Å; K93-I96 PolarHBondContact O-N 2.84Å; K93-I96 VanDerWaalsContact O-N 3.11Å; K93-D97 WeakPolarHBondContact O-CB 3.49Å; K93-D97 VanDerWaalsContact O-CG 3.29Å; K93-D97 PolarHBondContact O-N 2.95Å
94	D	98.8	Very high	98.5	Very high	83 Å²	83	68.9 Å²	68.9	44%	0.444	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-40.3	179.1	-63.6	-15.4	0	0	0	111.7	Q90 S98	Q90-D94 PolarHBondContact NE2-OD1 2.88Å; Q90-D94 VanDerWaalsContact O-CG 3.23Å; Q90-D94 PolarHBondContact O-N 3.07Å; D94-S98 VanDerWaalsContact O-CB 3.29Å; D94-S98 WeakPolarHBondContact O-CB 3.41Å; D94-S98 PolarHBondContact O-N 2.99Å
95	A	98.7	Very high	98.5	Very high	4 Å²	4	68.7 Å²	68.7	3%	0.033	36%	0.358	C	S	.	.	H	α-helix	trans	-62.3	-44.7	175.5	0	0	0	0	0	111.8	A91 M92 K93 S98 F101 V317 A321	A91-A95 WeakPolarHBondContact O-CB 3.43Å; A91-A95 PolarHBondContact O-N 3.27Å; M92-A95 PolarHBondContact O-N 2.94Å; K93-A95 VanDerWaalsContact C-N 3.3Å; K93-A95 PolarHBondContact O-N 3Å; A95-S98 PolarHBondContact O-OG 3.12Å; A95-F101 HydrophobicContact CB-CD2 4.04Å; A95-V317 HydrophobicContact CB-CG1 4.25Å; A95-A321 HydrophobicContact CB-CB 4.14Å
96	I	98.8	Very high	98.5	Very high	78 Å²	78	70.4 Å²	70.4	40%	0.4	37%	0.371	S	S	.	.	H	α-helix	trans	-64.3	-53.5	176.9	-67.1	166	0	0	0	110.4	M92 K93 S98 Q99 V317	M92-I96 VanDerWaalsContact O-CG1 3.29Å; M92-I96 WeakPolarHBondContact O-CG1 3.27Å; M92-I96 PolarHBondContact O-N 2.96Å; K93-I96 PolarHBondContact O-N 2.84Å; K93-I96 VanDerWaalsContact O-N 3.11Å; I96-S98 PolarHBondContact O-N 2.76Å; I96-Q99 PolarHBondContact O-N 2.89Å; I96-Q99 PolarHBondContact O-NE2 2.93Å; I96-V317 HydrophobicContact CD1-CG1 4.18Å; I96-V317 HydrophobicContact CG1-CG1 3.45Å; I96-V317 VanDerWaalsContact CG1-CG1 3.45Å
97	D	98.8	Very high	98.5	Very high	119 Å²	119	67.8 Å²	67.8	64%	0.636	35%	0.348	S	S	*	.	H	α-helix	trans	-61.6	-30.6	-176.3	-69.7	-19	0	0	0	111.7	K93 Q99	K93-D97 WeakPolarHBondContact O-CB 3.49Å; K93-D97 VanDerWaalsContact O-CG 3.29Å; K93-D97 PolarHBondContact O-N 2.95Å; D97-Q99 PolarHBondContact O-N 2.93Å
98	S	98.5	Very high	98.5	Very high	41 Å²	41	67.3 Å²	67.3	29%	0.287	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.5	175.8	81.2	0	0	0	0	114.3	D94 A95 I96 R100 F101	D94-S98 VanDerWaalsContact O-CB 3.29Å; D94-S98 WeakPolarHBondContact O-CB 3.41Å; D94-S98 PolarHBondContact O-N 2.99Å; A95-S98 PolarHBondContact O-OG 3.12Å; I96-S98 PolarHBondContact O-N 2.76Å; S98-R100 WeakPolarHBondContact O-CG 3.42Å; S98-R100 PolarHBondContact O-N 3.04Å; S98-R100 PolarHBondContact OG-N 3.08Å; S98-F101 WeakPolarHBondContact OG-CE2 3.42Å
99	Q	98.3	Very high	98.5	Very high	123 Å²	123	67.3 Å²	67.3	58%	0.575	34%	0.342	S	S	*	.			trans	57	9	-174.6	-57.9	-67.8	-60.7	0	0	115.2	I96 D97 N102	I96-Q99 PolarHBondContact O-N 2.89Å; I96-Q99 PolarHBondContact O-NE2 2.93Å; D97-Q99 PolarHBondContact O-N 2.93Å; Q99-N102 PolarHBondContact OE1-ND2 3.44Å
100	R	98.2	Very high	98.5	Very high	171 Å²	171	65.8 Å²	65.8	65%	0.645	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.8	-177.1	-67.2	-173.6	-62.1	151.8	-3.1	114.2	S98	S98-R100 WeakPolarHBondContact O-CG 3.42Å; S98-R100 PolarHBondContact O-N 3.04Å; S98-R100 PolarHBondContact OG-N 3.08Å
101	F	98.3	Very high	98.5	Very high	12 Å²	12	67 Å²	67	5%	0.053	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	20.6	-172.5	-53.4	-64.6	0	0	0	113.7	A95 S98 Y110 R112 T316	A95-F101 HydrophobicContact CB-CD2 4.04Å; S98-F101 WeakPolarHBondContact OG-CE2 3.42Å; F101-Y110 HydrophobicContact CD1-CD2 4.36Å; F101-Y110 AromaticContact CD1-CE2 3.86Å; F101-Y110 HydrophobicContact CD1-CE2 3.86Å; F101-R112 VanDerWaalsContact CE1-NE 3.33Å; F101-R112 VanDerWaalsContact CZ-NH1 3.31Å; F101-T316 WeakPolarHBondContact O-CB 3.31Å; F101-T316 PolarHBondContact O-OG1 2.68Å
102	N	98.1	Very high	98.5	Very high	89 Å²	89	70.5 Å²	70.5	48%	0.476	35%	0.352	S	S	.	.	S	Bend	trans	-85.4	-21.7	-179.8	-63.5	-13.3	0	0	0	113.1	Q99	Q99-N102 PolarHBondContact OE1-ND2 3.44Å
103	G	97.8	Very high	98.5	Very high	45 Å²	45	69.3 Å²	69.3	46%	0.464	35%	0.346	S	S	.	.	S	Bend	trans	-84.6	173.5	-178.6	0	0	0	0	0	113.5	Y110 T316	G103-Y110 PolarHBondContact O-OH 3.31Å; G103-T316 WeakPolarHBondContact O-CG2 3.17Å
104	Y	98.1	Very high	98.5	Very high	213 Å²	213	65.7 Å²	65.7	84%	0.835	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-62.9	142.8	174.3	-68.7	-67.9	0	0	0	112.1
105	A	98.1	Very high	98.5	Very high	20 Å²	20	64.5 Å²	64.5	17%	0.165	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-101.9	165.3	169.3	0	0	0	0	0	110.4	Y110 T316	A105-Y110 HydrophobicContact CB-CD1 3.89Å; A105-Y110 HydrophobicContact CB-CD2 4.05Å; A105-Y110 HydrophobicContact CB-CE1 3.61Å; A105-Y110 HydrophobicContact CB-CE2 3.82Å; A105-Y110 HydrophobicContact CB-CG 4.09Å; A105-T316 HydrophobicContact CB-CG2 3.67Å
106	P	98.6	Very high	98.5	Very high	72 Å²	72	64.5 Å²	64.5	47%	0.468	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-51.6	145.2	159.7	-23.3	34.4	0	0	0	110.2	V108 G109	P106-V108 HydrophobicContact CB-CG2 4.29Å; P106-V108 PolarHBondContact O-N 2.96Å; P106-V108 VanDerWaalsContact O-N 3.14Å; P106-G109 WeakPolarHBondContact O-CA 3.21Å; P106-G109 PolarHBondContact O-N 3.22Å
107	S	98.6	Very high	98.5	Very high	17 Å²	17	60.8 Å²	60.8	12%	0.119	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-28.7	-175.6	61.9	0	0	0	0	113.9	G109 S308 Q309 G313	S107-G109 VanDerWaalsContact C-N 3.28Å; S107-S308 WeakPolarHBondContact CB-OG 3.47Å; S107-S308 PolarHBondContact OG-OG 3.37Å; S107-Q309 VanDerWaalsContact OG-CG 3.28Å; S107-Q309 WeakPolarHBondContact OG-CG 3.28Å; S107-G313 WeakPolarHBondContact O-CA 3.47Å
108	V	98.7	Very high	98.5	Very high	21 Å²	21	55.1 Å²	55.1	13%	0.127	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.8	174	-63.1	0	0	0	0	113.8	P106 R114 I134 L135 V305	P106-V108 HydrophobicContact CB-CG2 4.29Å; P106-V108 PolarHBondContact O-N 2.96Å; P106-V108 VanDerWaalsContact O-N 3.14Å; V108-R114 WeakPolarHBondContact O-CD 3.5Å; V108-I134 HydrophobicContact CB-CG1 4.48Å; V108-I134 HydrophobicContact CB-CG2 4.39Å; V108-I134 HydrophobicContact CG1-CG1 4.27Å; V108-I134 HydrophobicContact CG1-CG2 4.32Å; V108-L135 PolarHBondContact O-N 2.75Å; V108-V305 HydrophobicContact CG1-CB 4.4Å; V108-V305 HydrophobicContact CG1-CG1 4.45Å; V108-V305 HydrophobicContact CG1-CG2 3.96Å
109	G	98.8	Very high	98.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.285	C	S	.	.			trans	102.8	160.9	-176.8	0	0	0	0	0	114.8	P106 S107 R114	P106-G109 WeakPolarHBondContact O-CA 3.21Å; P106-G109 PolarHBondContact O-N 3.22Å; S107-G109 VanDerWaalsContact C-N 3.28Å; G109-R114 PolarHBondContact O-NE 3.28Å
110	Y	98.8	Very high	98.5	Very high	43 Å²	43	54.3 Å²	54.3	17%	0.169	27%	0.266	C	S	.	.			trans	-58.3	140.5	176.7	-70.2	-59.7	0	0	0	111.4	F101 G103 A105 R112 S113 R114 T316 Q319	F101-Y110 HydrophobicContact CD1-CD2 4.36Å; F101-Y110 AromaticContact CD1-CE2 3.86Å; F101-Y110 HydrophobicContact CD1-CE2 3.86Å; G103-Y110 PolarHBondContact O-OH 3.31Å; A105-Y110 HydrophobicContact CB-CD1 3.89Å; A105-Y110 HydrophobicContact CB-CD2 4.05Å; A105-Y110 HydrophobicContact CB-CE1 3.61Å; A105-Y110 HydrophobicContact CB-CE2 3.82Å; A105-Y110 HydrophobicContact CB-CG 4.09Å; Y110-R112 VanDerWaalsContact C-N 3.31Å; Y110-R112 PolarHBondContact O-N 2.91Å; Y110-S113 PolarHBondContact O-N 3.02Å; Y110-S113 VanDerWaalsContact O-N 3.09Å; Y110-R114 PolarHBondContact O-N 2.81Å; Y110-T316 HydrophobicContact CE2-CG2 4.05Å; Y110-Q319 HydrophobicContact CD2-CB 4.01Å
111	L	98.8	Very high	98.5	Very high	111 Å²	111	47.9 Å²	47.9	58%	0.581	24%	0.242	S	C	*	.	H	α-helix	trans	-53.3	-47.7	178.5	178.3	63.3	0	0	0	112.1	S113 R114 Q115 A130	L111-S113 VanDerWaalsContact C-N 3.3Å; L111-S113 PolarHBondContact O-N 2.88Å; L111-R114 PolarHBondContact O-N 3.49Å; L111-Q115 WeakPolarHBondContact O-CB 3.5Å; L111-Q115 PolarHBondContact O-N 3.48Å; L111-A130 HydrophobicContact CD1-CB 3.75Å
112	R	98.4	Very high	98.4	Very high	80 Å²	80	49.1 Å²	49.1	30%	0.302	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-37.7	179.6	74.7	-173.5	-158.6	126.9	21.7	113	F101 Y110 Q115 A116 G320	F101-R112 VanDerWaalsContact CE1-NE 3.33Å; F101-R112 VanDerWaalsContact CZ-NH1 3.31Å; Y110-R112 VanDerWaalsContact C-N 3.31Å; Y110-R112 PolarHBondContact O-N 2.91Å; R112-Q115 PolarHBondContact O-N 2.95Å; R112-A116 PolarHBondContact O-N 2.9Å; R112-G320 VanDerWaalsContact NH2-C 3.35Å; R112-G320 VanDerWaalsContact NH2-CA 3.26Å; R112-G320 PolarHBondContact NH2-O 2.86Å
113	S	98.8	Very high	98.3	Very high	1 Å²	1	50 Å²	50	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-74.2	-39.3	-178.1	-54.8	0	0	0	0	110.3	Y110 L111 A116 V117 Q319	Y110-S113 PolarHBondContact O-N 3.02Å; Y110-S113 VanDerWaalsContact O-N 3.09Å; L111-S113 VanDerWaalsContact C-N 3.3Å; L111-S113 PolarHBondContact O-N 2.88Å; S113-A116 PolarHBondContact O-N 3.16Å; S113-V117 WeakPolarHBondContact O-CG2 3.37Å; S113-V117 PolarHBondContact O-N 3.4Å; S113-Q319 PolarHBondContact OG-O 3.08Å
114	R	98.9	Very high	98.2	Very high	37 Å²	37	53.4 Å²	53.4	14%	0.14	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-44.2	170.2	-73	-172.5	-69.3	121.1	-1.7	112	V108 G109 Y110 L111 A116 V117 A118 A130 I133 L135	V108-R114 WeakPolarHBondContact O-CD 3.5Å; G109-R114 PolarHBondContact O-NE 3.28Å; Y110-R114 PolarHBondContact O-N 2.81Å; L111-R114 PolarHBondContact O-N 3.49Å; R114-A116 VanDerWaalsContact C-N 3.32Å; R114-A116 PolarHBondContact O-N 3.45Å; R114-V117 PolarHBondContact O-N 2.89Å; R114-A118 PolarHBondContact O-N 3.15Å; R114-A130 HydrophobicContact CB-CB 4Å; R114-A130 VanDerWaalsContact NH1-C 3.26Å; R114-A130 PolarHBondContact NH1-O 3.34Å; R114-I133 HydrophobicContact CB-CB 3.97Å; R114-I133 HydrophobicContact CB-CG2 4.21Å; R114-I133 WeakPolarHBondContact CD-O 3.36Å; R114-I133 HydrophobicContact CG-CB 4.06Å; R114-I133 HydrophobicContact CG-CG2 4.05Å; R114-L135 HydrophobicContact CG-CD1 4.29Å; R114-L135 HydrophobicContact CG-CD2 4.41Å; R114-L135 HydrophobicContact CG-CG 3.93Å
115	Q	98.9	Very high	98.1	Very high	57 Å²	57	48.7 Å²	48.7	27%	0.266	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-39.8	176.3	-168.1	68.8	52.5	0	0	111.9	L111 R112 V117 A118 N119 A130	L111-Q115 WeakPolarHBondContact O-CB 3.5Å; L111-Q115 PolarHBondContact O-N 3.48Å; R112-Q115 PolarHBondContact O-N 2.95Å; Q115-V117 VanDerWaalsContact C-N 3.33Å; Q115-V117 PolarHBondContact O-N 2.99Å; Q115-A118 PolarHBondContact O-N 2.93Å; Q115-N119 PolarHBondContact NE2-OD1 2.71Å; Q115-N119 WeakPolarHBondContact O-CB 3.43Å; Q115-N119 PolarHBondContact O-N 3.37Å; Q115-N119 PolarHBondContact O-OD1 3.15Å; Q115-A130 HydrophobicContact CB-CB 4.24Å
116	A	98.8	Very high	98	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-60.4	-42.6	176.3	0	0	0	0	0	112.1	R112 S113 R114 F120 E323 L326	R112-A116 PolarHBondContact O-N 2.9Å; S113-A116 PolarHBondContact O-N 3.16Å; R114-A116 VanDerWaalsContact C-N 3.32Å; R114-A116 PolarHBondContact O-N 3.45Å; A116-F120 WeakPolarHBondContact O-CB 3.33Å; A116-F120 PolarHBondContact O-N 3.41Å; A116-F120 VanDerWaalsContact O-N 3.08Å; A116-E323 HydrophobicContact CB-CB 3.82Å; A116-E323 HydrophobicContact CB-CG 4.08Å; A116-L326 HydrophobicContact CB-CD1 4.33Å
117	V	98.8	Very high	97.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-46	174.6	177.1	0	0	0	0	111.1	S113 R114 Q115 N119 F120 Y121 I133 L135 W286 L288 L322 L326	S113-V117 WeakPolarHBondContact O-CG2 3.37Å; S113-V117 PolarHBondContact O-N 3.4Å; R114-V117 PolarHBondContact O-N 2.89Å; Q115-V117 VanDerWaalsContact C-N 3.33Å; Q115-V117 PolarHBondContact O-N 2.99Å; V117-N119 PolarHBondContact O-N 2.92Å; V117-F120 PolarHBondContact O-N 3.39Å; V117-Y121 HydrophobicContact CG1-CD2 3.8Å; V117-Y121 HydrophobicContact CG1-CE2 4.19Å; V117-Y121 WeakPolarHBondContact O-CD2 3.4Å; V117-Y121 PolarHBondContact O-N 2.7Å; V117-I133 HydrophobicContact CB-CG2 4.01Å; V117-I133 HydrophobicContact CG1-CD1 4.16Å; V117-I133 HydrophobicContact CG1-CG2 3.91Å; V117-L135 HydrophobicContact CG2-CD2 4.02Å; V117-W286 HydrophobicContact CG1-CB 4.36Å; V117-W286 HydrophobicContact CG1-CD2 3.96Å; V117-W286 HydrophobicContact CG1-CG 3.85Å; V117-W286 HydrophobicContact CG2-CD2 4.27Å; V117-W286 HydrophobicContact CG2-CE3 4.01Å; V117-W286 HydrophobicContact CG2-CZ3 4.42Å; V117-L288 HydrophobicContact CG1-CD2 3.67Å; V117-L322 HydrophobicContact CG2-CD2 3.56Å; V117-L322 HydrophobicContact CG2-CG 4.25Å; V117-L326 HydrophobicContact CG2-CD1 4Å
118	A	98.8	Very high	97.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-50.4	176.7	0	0	0	0	0	111	R114 Q115 F120 Y121 S122 L128 I133	R114-A118 PolarHBondContact O-N 3.15Å; Q115-A118 PolarHBondContact O-N 2.93Å; A118-F120 VanDerWaalsContact C-N 3.28Å; A118-F120 PolarHBondContact O-N 3.39Å; A118-Y121 PolarHBondContact O-N 3.31Å; A118-S122 WeakPolarHBondContact O-CA 3.23Å; A118-S122 WeakPolarHBondContact O-CB 3.44Å; A118-S122 PolarHBondContact O-N 2.87Å; A118-L128 HydrophobicContact CB-CB 4.24Å; A118-I133 HydrophobicContact CB-CD1 4.15Å; A118-I133 HydrophobicContact CB-CG1 3.87Å
119	N	98.6	Very high	97.9	Very high	105 Å²	105	51.4 Å²	51.4	56%	0.561	26%	0.256	S	S	*	.	H	α-helix	trans	-60.4	-37.3	178.5	-67.7	-5.4	0	0	0	112.6	Q115 V117	Q115-N119 PolarHBondContact NE2-OD1 2.71Å; Q115-N119 WeakPolarHBondContact O-CB 3.43Å; Q115-N119 PolarHBondContact O-N 3.37Å; Q115-N119 PolarHBondContact O-OD1 3.15Å; V117-N119 PolarHBondContact O-N 2.92Å
120	F	98.2	Very high	97.9	Very high	42 Å²	42	51.7 Å²	51.7	18%	0.184	26%	0.258	C	S	.	.	H	α-helix	trans	-70.3	-38.6	-179	-169.1	-90	0	0	0	112.4	A116 V117 A118 R123 W277 L326	A116-F120 WeakPolarHBondContact O-CB 3.33Å; A116-F120 PolarHBondContact O-N 3.41Å; A116-F120 VanDerWaalsContact O-N 3.08Å; V117-F120 PolarHBondContact O-N 3.39Å; A118-F120 VanDerWaalsContact C-N 3.28Å; A118-F120 PolarHBondContact O-N 3.39Å; F120-R123 PolarHBondContact O-NH1 3.14Å; F120-W277 HydrophobicContact CE1-CH2 4.11Å; F120-W277 HydrophobicContact CZ-CH2 4.09Å; F120-W277 HydrophobicContact CZ-CZ2 4.12Å; F120-L326 HydrophobicContact CB-CD1 4.2Å; F120-L326 HydrophobicContact CD1-CD2 4.28Å; F120-L326 HydrophobicContact CD2-CB 3.77Å; F120-L326 HydrophobicContact CD2-CD2 4.23Å; F120-L326 HydrophobicContact CD2-CG 4.44Å; F120-L326 HydrophobicContact CE1-CD2 4.43Å; F120-L326 HydrophobicContact CE2-CB 4.19Å; F120-L326 HydrophobicContact CE2-CD2 4.38Å; F120-L326 VanDerWaalsContact CE2-O 3.29Å; F120-L326 WeakPolarHBondContact CE2-O 3.38Å; F120-L326 HydrophobicContact CG-CB 4.3Å; F120-L326 HydrophobicContact CG-CD1 4.45Å; F120-L326 HydrophobicContact CG-CD2 4.17Å; F120-L326 HydrophobicContact CZ-CD2 4.47Å
121	Y	97.8	Very high	97.9	Very high	36 Å²	36	56.7 Å²	56.7	14%	0.141	28%	0.283	C	S	.	.	H	α-helix	trans	-101.8	-14.3	-175	-70.4	-73.1	0	0	0	115.1	V117 A118 R123 W286 L288	V117-Y121 HydrophobicContact CG1-CD2 3.8Å; V117-Y121 HydrophobicContact CG1-CE2 4.19Å; V117-Y121 WeakPolarHBondContact O-CD2 3.4Å; V117-Y121 PolarHBondContact O-N 2.7Å; A118-Y121 PolarHBondContact O-N 3.31Å; Y121-R123 PolarHBondContact O-N 3.06Å; Y121-R123 PolarHBondContact O-NH1 3.17Å; Y121-W286 AromaticContact CE2-CE2 3.71Å; Y121-W286 AromaticContact CE2-CZ2 3.58Å; Y121-W286 HydrophobicContact CE2-CZ2 3.58Å; Y121-W286 AromaticContact CE2-NE1 3.64Å; Y121-W286 AromaticContact CZ-CZ2 3.86Å; Y121-W286 WeakPolarHBondContact OH-CZ2 3.11Å; Y121-L288 HydrophobicContact CD1-CD1 4.32Å; Y121-L288 HydrophobicContact CD2-CD1 4.23Å; Y121-L288 HydrophobicContact CD2-CD2 4.41Å; Y121-L288 HydrophobicContact CG-CD1 3.87Å
122	S	97.4	Very high	97.9	Very high	38 Å²	38	52.2 Å²	52.2	27%	0.266	26%	0.26	S	S	.	.			trans	-61	135.8	178.4	-172.3	0	0	0	0	110.5	A118 L128	A118-S122 WeakPolarHBondContact O-CA 3.23Å; A118-S122 WeakPolarHBondContact O-CB 3.44Å; A118-S122 PolarHBondContact O-N 2.87Å; S122-L128 PolarHBondContact OG-N 2.95Å; S122-L128 VanDerWaalsContact OG-N 3.13Å
123	R	95.4	Very high	97.9	Very high	107 Å²	107	48.5 Å²	48.5	40%	0.404	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-132.3	154.9	174.9	-59.7	-64	179.8	-92.1	-1.4	108.6	F120 Y121 E125 A126 P127	F120-R123 PolarHBondContact O-NH1 3.14Å; Y121-R123 PolarHBondContact O-N 3.06Å; Y121-R123 PolarHBondContact O-NH1 3.17Å; R123-E125 PolarHBondContact O-N 3.46Å; R123-E125 VanDerWaalsContact O-N 3.16Å; R123-A126 PolarHBondContact N-O 3.42Å; R123-A126 CarbonylContact O-C 3.54Å; R123-A126 PolarHBondContact O-N 2.98Å; R123-P127 WeakPolarHBondContact O-CA 3.46Å
124	P	95.2	Very high	97.9	Very high	117 Å²	117	48.7 Å²	48.7	76%	0.76	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-36.5	177.7	-26.5	35.2	0	0	0	113.7
125	E	95.3	Very high	97.9	Very high	114 Å²	114	47 Å²	47	53%	0.533	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-25.2	-178.7	-54.6	72.7	-155.6	0	0	112.1	R123 S260 R292	R123-E125 PolarHBondContact O-N 3.46Å; R123-E125 VanDerWaalsContact O-N 3.16Å; E125-S260 WeakPolarHBondContact CB-O 3.16Å; E125-R292 VanDerWaalsContact O-CZ 3.28Å; E125-R292 PolarHBondContact O-NH1 3.04Å; E125-R292 PolarHBondContact O-NH2 3.2Å
126	A	96.3	Very high	97.9	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.025	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-137.3	71.1	-178.5	0	0	0	0	0	110	R123	R123-A126 PolarHBondContact N-O 3.42Å; R123-A126 CarbonylContact O-C 3.54Å; R123-A126 PolarHBondContact O-N 2.98Å
127	P	97	Very high	97.9	Very high	80 Å²	80	46.1 Å²	46.1	52%	0.519	24%	0.24	S	C	.	.			trans	-66.1	143.9	-178.7	28	-34.8	0	0	0	110.1	R123	R123-P127 WeakPolarHBondContact O-CA 3.46Å
128	L	98.5	Very high	97.9	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.24	C	C	.	.			trans	-131.7	136.9	175.2	-70.5	168.8	0	0	0	109.5	A118 S122 D132 I133 L288	A118-L128 HydrophobicContact CB-CB 4.24Å; S122-L128 PolarHBondContact OG-N 2.95Å; S122-L128 VanDerWaalsContact OG-N 3.13Å; L128-D132 HydrophobicContact CD2-CB 3.55Å; L128-I133 HydrophobicContact CD1-CD1 4.31Å; L128-I133 HydrophobicContact CD2-CD1 4.47Å; L128-L288 HydrophobicContact CD1-CB 4.11Å; L128-L288 HydrophobicContact CD1-CD1 4.12Å; L128-L288 HydrophobicContact CD1-CD2 4.26Å; L128-L288 HydrophobicContact CD1-CG 4.4Å; L128-L288 HydrophobicContact CD2-CB 4.33Å
129	E	98.6	Very high	97.9	Very high	103 Å²	103	46.6 Å²	46.6	48%	0.481	24%	0.244	S	C	.	.			trans	-113.2	169.2	167	-66.1	-59.8	157	0	0	110.1	E131 D132	E129-E131 HydrophobicContact CB-CG 4.07Å; E129-E131 PolarHBondContact O-N 3.22Å; E129-D132 PolarHBondContact N-OD2 3.36Å; E129-D132 WeakPolarHBondContact O-CB 3.44Å; E129-D132 PolarHBondContact O-N 3.41Å
130	A	98.7	Very high	97.9	Very high	5 Å²	5	43.7 Å²	43.7	4%	0.041	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-56.5	-29	-179.1	0	0	0	0	0	113.5	L111 R114 Q115 D132 I133	L111-A130 HydrophobicContact CD1-CB 3.75Å; R114-A130 HydrophobicContact CB-CB 4Å; R114-A130 VanDerWaalsContact NH1-C 3.26Å; R114-A130 PolarHBondContact NH1-O 3.34Å; Q115-A130 HydrophobicContact CB-CB 4.24Å; A130-D132 PolarHBondContact O-N 3.25Å; A130-I133 PolarHBondContact O-N 2.97Å
131	E	98.3	Very high	97.9	Very high	148 Å²	148	42.4 Å²	42.4	69%	0.692	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-70.2	-15.8	176.7	60.9	-173.2	-134.9	0	0	114.7	E129 I133 R301	E129-E131 HydrophobicContact CB-CG 4.07Å; E129-E131 PolarHBondContact O-N 3.22Å; E131-I133 VanDerWaalsContact C-N 3.27Å; E131-R301 PolarHBondContact O-NH1 2.81Å
132	D	98.8	Very high	98	Very high	17 Å²	17	40.7 Å²	40.7	9%	0.091	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-87.1	0.4	173.1	-56.5	-51.2	0	0	0	112.5	L128 E129 A130 I289 R301	L128-D132 HydrophobicContact CD2-CB 3.55Å; E129-D132 PolarHBondContact N-OD2 3.36Å; E129-D132 WeakPolarHBondContact O-CB 3.44Å; E129-D132 PolarHBondContact O-N 3.41Å; A130-D132 PolarHBondContact O-N 3.25Å; D132-I289 HydrophobicContact CB-CB 4.37Å; D132-I289 WeakPolarHBondContact O-CG1 3.38Å; D132-I289 PolarHBondContact O-N 3.44Å; D132-R301 IonicContact OD1-CZ 3.89Å; D132-R301 IonicContact OD1-NH1 2.71Å; D132-R301 PolarHBondContact OD1-NH1 2.9Å; D132-R301 IonicContact OD1-NH2 3.16Å; D132-R301 PolarHBondContact OD1-NH2 2.78Å
133	I	98.9	Very high	98.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134	-173.7	-45.7	-60.3	0	0	0	110.8	R114 V117 A118 L128 A130 E131 L135 W286 I287 L288	R114-I133 HydrophobicContact CB-CB 3.97Å; R114-I133 HydrophobicContact CB-CG2 4.21Å; R114-I133 WeakPolarHBondContact CD-O 3.36Å; R114-I133 HydrophobicContact CG-CB 4.06Å; R114-I133 HydrophobicContact CG-CG2 4.05Å; V117-I133 HydrophobicContact CB-CG2 4.01Å; V117-I133 HydrophobicContact CG1-CD1 4.16Å; V117-I133 HydrophobicContact CG1-CG2 3.91Å; A118-I133 HydrophobicContact CB-CD1 4.15Å; A118-I133 HydrophobicContact CB-CG1 3.87Å; L128-I133 HydrophobicContact CD1-CD1 4.31Å; L128-I133 HydrophobicContact CD2-CD1 4.47Å; A130-I133 PolarHBondContact O-N 2.97Å; E131-I133 VanDerWaalsContact C-N 3.27Å; I133-L135 HydrophobicContact CG2-CD2 3.92Å; I133-W286 HydrophobicContact CG2-CB 4.34Å; I133-I287 WeakPolarHBondContact CA-O 3.43Å; I133-L288 HydrophobicContact CD1-CD2 3.41Å; I133-L288 VanDerWaalsContact CD1-CD2 3.41Å
134	I	98.9	Very high	98.2	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	119.7	168.1	-60.8	179.8	0	0	0	108.2	V108 T136 W286 I287 I289 L304	V108-I134 HydrophobicContact CB-CG1 4.48Å; V108-I134 HydrophobicContact CB-CG2 4.39Å; V108-I134 HydrophobicContact CG1-CG1 4.27Å; V108-I134 HydrophobicContact CG1-CG2 4.32Å; I134-T136 HydrophobicContact CG2-CG2 4.2Å; I134-W286 CarbonylContact O-C 3.53Å; I134-W286 WeakPolarHBondContact O-CA 3.5Å; I134-I287 HydrophobicContact CB-CB 4.36Å; I134-I287 HydrophobicContact CB-CD1 4.48Å; I134-I287 PolarHBondContact N-O 2.84Å; I134-I287 VanDerWaalsContact N-O 3.1Å; I134-I287 PolarHBondContact O-N 3.31Å; I134-I289 HydrophobicContact CD1-CD1 4.27Å; I134-L304 HydrophobicContact CD1-CB 3.28Å; I134-L304 HydrophobicContact CD1-CD1 3.92Å; I134-L304 HydrophobicContact CD1-CG 4.13Å
135	L	98.9	Very high	98.4	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	136.6	176	-55	-174.3	0	0	0	110.4	V108 R114 V117 I133 M284 W286 Q319 L322	V108-L135 PolarHBondContact O-N 2.75Å; R114-L135 HydrophobicContact CG-CD1 4.29Å; R114-L135 HydrophobicContact CG-CD2 4.41Å; R114-L135 HydrophobicContact CG-CG 3.93Å; V117-L135 HydrophobicContact CG2-CD2 4.02Å; I133-L135 HydrophobicContact CG2-CD2 3.92Å; L135-M284 HydrophobicContact CB-SD 4.47Å; L135-W286 HydrophobicContact CD2-CB 4.12Å; L135-Q319 HydrophobicContact CD1-CB 4.4Å; L135-Q319 HydrophobicContact CD1-CG 3.83Å; L135-L322 HydrophobicContact CD1-CD2 4.17Å; L135-L322 HydrophobicContact CD2-CD2 4.13Å
136	T	98.9	Very high	98.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	160.7	-169.7	67.4	0	0	0	0	112.1	I134 G138 A142 L145 G285 W286 I287 A314	I134-T136 HydrophobicContact CG2-CG2 4.2Å; T136-G138 PolarHBondContact O-N 3.03Å; T136-G138 PolarHBondContact OG1-O 2.79Å; T136-A142 HydrophobicContact CG2-CB 4.06Å; T136-L145 HydrophobicContact CG2-CD1 3.93Å; T136-G285 PolarHBondContact N-O 3.09Å; T136-G285 PolarHBondContact O-N 3.13Å; T136-G285 PolarHBondContact OG1-O 2.92Å; T136-W286 PolarHBondContact OG1-N 3.25Å; T136-I287 HydrophobicContact CG2-CD1 4.38Å; T136-I287 HydrophobicContact CG2-CG1 4.23Å; T136-A314 WeakPolarHBondContact O-CB 3.31Å
137	S	98.8	Very high	98.7	Very high	42 Å²	42	24.7 Å²	24.7	29%	0.294	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	65.9	175.4	-168.9	0	0	0	0	111.5	R283	S137-R283 CarbonylContact C-O 3.29Å; S137-R283 VanDerWaalsContact CA-O 3.31Å; S137-R283 WeakPolarHBondContact CA-O 3.32Å; S137-R283 PolarHBondContact O-NH2 2.91Å
138	G	98.7	Very high	98.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	76.4	169.7	-169.7	0	0	0	0	0	113.3	T136 S140 Q141 A142 R283	T136-G138 PolarHBondContact O-N 3.03Å; T136-G138 PolarHBondContact OG1-O 2.79Å; G138-S140 PolarHBondContact O-N 3.09Å; G138-Q141 PolarHBondContact O-N 2.93Å; G138-Q141 VanDerWaalsContact O-N 3.12Å; G138-A142 PolarHBondContact O-N 3.49Å; G138-R283 PolarHBondContact N-O 3.16Å
139	C	98.8	Very high	98.8	Very high	10 Å²	10	23.3 Å²	23.3	7%	0.068	13%	0.126	C	C	.	.	H	α-helix	trans	-59.3	-30.1	177.7	-165	0	0	0	0	112.1	Q141 A142 I143 I244	C139-Q141 VanDerWaalsContact C-N 3.26Å; C139-Q141 PolarHBondContact O-N 2.77Å; C139-A142 WeakPolarHBondContact O-CA 3.46Å; C139-A142 VanDerWaalsContact O-CB 3.31Å; C139-A142 WeakPolarHBondContact O-CB 3.34Å; C139-A142 PolarHBondContact O-N 3.26Å; C139-I143 WeakPolarHBondContact O-CG1 3.48Å; C139-I143 PolarHBondContact O-N 2.98Å; C139-I244 HydrophobicContact CB-CB 4.46Å; C139-I244 HydrophobicContact CB-CD1 3.88Å; C139-I244 HydrophobicContact CB-CG1 4.18Å
140	S	98.7	Very high	98.8	Very high	45 Å²	45	19.7 Å²	19.7	32%	0.315	11%	0.11	S	C	.	.	H	α-helix	trans	-55.4	-40.5	175.7	-46.6	0	0	0	0	113	G138 E144 R283	G138-S140 PolarHBondContact O-N 3.09Å; S140-E144 PolarHBondContact O-N 3.37Å; S140-E144 VanDerWaalsContact O-N 3.11Å; S140-R283 PolarHBondContact OG-NH2 3.36Å
141	Q	98.9	Very high	98.8	Very high	15 Å²	15	20 Å²	20	7%	0.07	11%	0.112	C	C	.	.	H	α-helix	trans	-79	-29.1	176.8	-162.5	-141.6	-5.8	0	0	111.7	G138 C139 I143 E144 L145 I311	G138-Q141 PolarHBondContact O-N 2.93Å; G138-Q141 VanDerWaalsContact O-N 3.12Å; C139-Q141 VanDerWaalsContact C-N 3.26Å; C139-Q141 PolarHBondContact O-N 2.77Å; Q141-I143 VanDerWaalsContact C-N 3.34Å; Q141-E144 WeakPolarHBondContact CG-OE2 3.27Å; Q141-E144 PolarHBondContact O-N 2.96Å; Q141-L145 HydrophobicContact CG-CD1 4.46Å; Q141-L145 HydrophobicContact CG-CG 4.32Å; Q141-L145 WeakPolarHBondContact O-CB 3.44Å; Q141-L145 VanDerWaalsContact O-CG 3.25Å; Q141-L145 WeakPolarHBondContact O-CG 3.37Å; Q141-L145 PolarHBondContact O-N 3.29Å; Q141-I311 HydrophobicContact CG-CD1 4.09Å
142	A	98.9	Very high	98.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.4	-47.7	171.7	0	0	0	0	0	110.8	T136 G138 C139 L145 S146 C270 I287	T136-A142 HydrophobicContact CG2-CB 4.06Å; G138-A142 PolarHBondContact O-N 3.49Å; C139-A142 WeakPolarHBondContact O-CA 3.46Å; C139-A142 VanDerWaalsContact O-CB 3.31Å; C139-A142 WeakPolarHBondContact O-CB 3.34Å; C139-A142 PolarHBondContact O-N 3.26Å; A142-L145 PolarHBondContact O-N 2.94Å; A142-S146 WeakPolarHBondContact O-CB 3.32Å; A142-S146 PolarHBondContact O-N 2.91Å; A142-S146 PolarHBondContact O-OG 2.87Å; A142-C270 HydrophobicContact CB-CB 4Å; A142-I287 HydrophobicContact CB-CD1 4.5Å; A142-I287 HydrophobicContact CB-CG1 3.64Å
143	I	98.9	Very high	98.8	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-45.8	175	-64.4	157.2	0	0	0	111	C139 Q141 L145 S146 I147 L166 Y167 L170 L240 C270	C139-I143 WeakPolarHBondContact O-CG1 3.48Å; C139-I143 PolarHBondContact O-N 2.98Å; Q141-I143 VanDerWaalsContact C-N 3.34Å; I143-L145 PolarHBondContact O-N 3.37Å; I143-S146 PolarHBondContact O-N 2.91Å; I143-I147 HydrophobicContact CG2-CD1 3.82Å; I143-I147 HydrophobicContact CG2-CG1 4.45Å; I143-I147 WeakPolarHBondContact O-CG1 3.37Å; I143-I147 PolarHBondContact O-N 3.44Å; I143-L166 HydrophobicContact CD1-CD2 4.22Å; I143-Y167 HydrophobicContact CD1-CE1 3.86Å; I143-Y167 HydrophobicContact CG1-CE1 4.35Å; I143-Y167 HydrophobicContact CG2-CD1 3.83Å; I143-Y167 HydrophobicContact CG2-CE1 4.14Å; I143-L170 HydrophobicContact CB-CD1 4.32Å; I143-L170 HydrophobicContact CG2-CD1 3.75Å; I143-L240 HydrophobicContact CG2-CD2 4.35Å; I143-C270 HydrophobicContact CG1-CB 4.32Å
144	E	98.8	Very high	98.7	Very high	39 Å²	39	24 Å²	24	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-57.9	-48.2	178	-178.4	-113.4	170.7	0	0	112.5	S140 Q141 S148 L170 M174	S140-E144 PolarHBondContact O-N 3.37Å; S140-E144 VanDerWaalsContact O-N 3.11Å; Q141-E144 WeakPolarHBondContact CG-OE2 3.27Å; Q141-E144 PolarHBondContact O-N 2.96Å; E144-S148 WeakPolarHBondContact O-CB 3.44Å; E144-S148 PolarHBondContact O-N 3.32Å; E144-S148 PolarHBondContact O-OG 3.5Å; E144-L170 HydrophobicContact CB-CD1 3.98Å; E144-L170 HydrophobicContact CB-CD2 4.07Å; E144-L170 HydrophobicContact CG-CD2 4.04Å; E144-M174 HydrophobicContact CG-CE 3.66Å
145	L	98.9	Very high	98.7	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-65.6	-40.2	178.3	-68.1	178.1	0	0	0	111.8	T136 Q141 A142 I143 S148 V149 I287 L304 L307	T136-L145 HydrophobicContact CG2-CD1 3.93Å; Q141-L145 HydrophobicContact CG-CD1 4.46Å; Q141-L145 HydrophobicContact CG-CG 4.32Å; Q141-L145 WeakPolarHBondContact O-CB 3.44Å; Q141-L145 VanDerWaalsContact O-CG 3.25Å; Q141-L145 WeakPolarHBondContact O-CG 3.37Å; Q141-L145 PolarHBondContact O-N 3.29Å; A142-L145 PolarHBondContact O-N 2.94Å; I143-L145 PolarHBondContact O-N 3.37Å; L145-S148 PolarHBondContact O-N 3.18Å; L145-V149 WeakPolarHBondContact O-CB 3.14Å; L145-V149 PolarHBondContact O-N 2.93Å; L145-I287 HydrophobicContact CB-CD1 3.92Å; L145-I287 HydrophobicContact CD1-CD1 4.3Å; L145-L304 HydrophobicContact CB-CD2 4.03Å; L145-L307 HydrophobicContact CD2-CB 3.52Å
146	S	98.9	Very high	98.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-44.7	177.3	-65.9	0	0	0	0	112.3	A142 I143 V149 L150	A142-S146 WeakPolarHBondContact O-CB 3.32Å; A142-S146 PolarHBondContact O-N 2.91Å; A142-S146 PolarHBondContact O-OG 2.87Å; I143-S146 PolarHBondContact O-N 2.91Å; S146-V149 WeakPolarHBondContact O-CG1 3.32Å; S146-L150 WeakPolarHBondContact O-CB 3.41Å; S146-L150 WeakPolarHBondContact O-CD1 3.49Å; S146-L150 VanDerWaalsContact O-CG 3.27Å; S146-L150 WeakPolarHBondContact O-CG 3.31Å; S146-L150 PolarHBondContact O-N 2.9Å
147	I	98.8	Very high	98.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-45.9	174	-65.6	170.9	0	0	0	109.9	I143 V149 L150 C151 I157 L170 M174 I208 L240	I143-I147 HydrophobicContact CG2-CD1 3.82Å; I143-I147 HydrophobicContact CG2-CG1 4.45Å; I143-I147 WeakPolarHBondContact O-CG1 3.37Å; I143-I147 PolarHBondContact O-N 3.44Å; I147-V149 VanDerWaalsContact C-N 3.28Å; I147-V149 PolarHBondContact O-N 3.41Å; I147-L150 PolarHBondContact O-N 2.79Å; I147-C151 HydrophobicContact CG2-CB 4.49Å; I147-C151 WeakPolarHBondContact O-CB 3.34Å; I147-C151 PolarHBondContact O-N 2.99Å; I147-C151 PolarHBondContact O-SG 2.64Å; I147-I157 HydrophobicContact CD1-CD1 4.33Å; I147-L170 HydrophobicContact CD1-CB 4.16Å; I147-L170 HydrophobicContact CD1-CD1 4.46Å; I147-M174 HydrophobicContact CG2-SD 4.03Å; I147-I208 HydrophobicContact CD1-CD1 4.22Å; I147-L240 HydrophobicContact CG1-CD2 3.88Å
148	S	98.6	Very high	98.7	Very high	28 Å²	28	23.3 Å²	23.3	20%	0.196	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-28.6	-176.9	-61.8	0	0	0	0	114	E144 L145 M174	E144-S148 WeakPolarHBondContact O-CB 3.44Å; E144-S148 PolarHBondContact O-N 3.32Å; E144-S148 PolarHBondContact O-OG 3.5Å; L145-S148 PolarHBondContact O-N 3.18Å; S148-M174 VanDerWaalsContact OG-CE 3.24Å; S148-M174 WeakPolarHBondContact OG-CE 3.4Å; S148-M174 PolarHBondContact OG-SD 3.05Å
149	V	98.8	Very high	98.7	Very high	25 Å²	25	23.5 Å²	23.5	15%	0.152	15%	0.146	C	C	.	.	H	α-helix	trans	-84.9	-27.1	178	78.4	0	0	0	0	112.5	L145 S146 I147 L268 I300 L304 L307	L145-V149 WeakPolarHBondContact O-CB 3.14Å; L145-V149 PolarHBondContact O-N 2.93Å; S146-V149 WeakPolarHBondContact O-CG1 3.32Å; I147-V149 VanDerWaalsContact C-N 3.28Å; I147-V149 PolarHBondContact O-N 3.41Å; V149-L268 HydrophobicContact CG1-CD1 4.26Å; V149-I300 HydrophobicContact CG1-CG2 4.08Å; V149-I300 HydrophobicContact CG2-CD1 4.04Å; V149-I300 HydrophobicContact CG2-CG2 4.2Å; V149-L304 HydrophobicContact CB-CD2 3.91Å; V149-L304 HydrophobicContact CB-CG 4.13Å; V149-L304 HydrophobicContact CG1-CD1 4.49Å; V149-L304 HydrophobicContact CG1-CD2 3.59Å; V149-L304 HydrophobicContact CG1-CG 3.86Å; V149-L304 HydrophobicContact CG2-CD2 4.44Å; V149-L304 HydrophobicContact CG2-CG 4.12Å; V149-L307 HydrophobicContact CB-CD1 3.89Å; V149-L307 HydrophobicContact CG2-CD1 4.37Å
150	L	98.8	Very high	98.7	Very high	26 Å²	26	23.3 Å²	23.3	14%	0.136	15%	0.145	C	C	.	.	H	α-helix	trans	-91.4	-23.3	-176.9	-67.5	173.2	0	0	0	113.2	S146 I147 S205 C206 P238 L268 F296 I300	S146-L150 WeakPolarHBondContact O-CB 3.41Å; S146-L150 WeakPolarHBondContact O-CD1 3.49Å; S146-L150 VanDerWaalsContact O-CG 3.27Å; S146-L150 WeakPolarHBondContact O-CG 3.31Å; S146-L150 PolarHBondContact O-N 2.9Å; I147-L150 PolarHBondContact O-N 2.79Å; L150-S205 WeakPolarHBondContact O-CB 3.45Å; L150-C206 HydrophobicContact CD1-CB 3.87Å; L150-P238 HydrophobicContact CD2-CG 4.4Å; L150-L268 HydrophobicContact CD1-CD1 4Å; L150-L268 HydrophobicContact CG-CD1 4.35Å; L150-F296 HydrophobicContact CD2-CE1 4.01Å; L150-I300 HydrophobicContact CD2-CD1 4.07Å
151	C	98.6	Very high	98.6	Very high	13 Å²	13	25.1 Å²	25.1	9%	0.088	15%	0.145	C	C	.	.			trans	-123	146.9	-168.5	-51	0	0	0	0	113.2	I147 D155 I157 V176	I147-C151 HydrophobicContact CG2-CB 4.49Å; I147-C151 WeakPolarHBondContact O-CB 3.34Å; I147-C151 PolarHBondContact O-N 2.99Å; I147-C151 PolarHBondContact O-SG 2.64Å; C151-D155 WeakPolarHBondContact CA-OD2 3.29Å; C151-D155 HydrophobicContact CB-CB 4.4Å; C151-I157 VanDerWaalsContact SG-CG2 3.51Å; C151-V176 HydrophobicContact CB-CG1 4.23Å; C151-V176 HydrophobicContact CB-CG2 3.62Å
152	N	98.3	Very high	98.6	Very high	111 Å²	111	24.4 Å²	24.4	59%	0.594	14%	0.141	S	C	*	.			trans	-109.3	161.7	163.9	-66.4	-69.3	0	0	0	110.8	G154 D155	N152-G154 PolarHBondContact O-N 2.9Å; N152-D155 PolarHBondContact N-OD2 2.96Å; N152-D155 WeakPolarHBondContact O-CB 3.49Å; N152-D155 PolarHBondContact O-N 2.97Å; N152-D155 VanDerWaalsContact O-N 3.12Å
153	P	98.1	Very high	98.5	Very high	102 Å²	102	24.6 Å²	24.6	66%	0.662	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	128.1	168.6	-22	31.8	0	0	0	111.2	M174 G175	P153-M174 WeakPolarHBondContact CG-O 3.4Å; P153-G175 WeakPolarHBondContact CA-O 3.4Å
154	G	97.4	Very high	98.5	Very high	36 Å²	36	27.2 Å²	27.2	37%	0.371	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.1	-12.6	-176.6	0	0	0	0	0	115.4	N152 G175 R203	N152-G154 PolarHBondContact O-N 2.9Å; G154-G175 PolarHBondContact N-O 3.1Å; G154-R203 PolarHBondContact O-NH1 2.9Å; G154-R203 VanDerWaalsContact O-NH1 3.1Å
155	D	98.6	Very high	98.3	Very high	33 Å²	33	25.6 Å²	25.6	18%	0.176	15%	0.148	C	C	.	.			trans	-72.6	166.7	168.5	-65.4	-6.4	0	0	0	110.7	C151 N152 V176 E177 S205	C151-D155 WeakPolarHBondContact CA-OD2 3.29Å; C151-D155 HydrophobicContact CB-CB 4.4Å; N152-D155 PolarHBondContact N-OD2 2.96Å; N152-D155 WeakPolarHBondContact O-CB 3.49Å; N152-D155 PolarHBondContact O-N 2.97Å; N152-D155 VanDerWaalsContact O-N 3.12Å; D155-V176 WeakPolarHBondContact O-CG1 3.41Å; D155-E177 PolarHBondContact O-N 3.28Å; D155-S205 WeakPolarHBondContact CB-OG 3.35Å; D155-S205 VanDerWaalsContact CG-OG 3.28Å; D155-S205 PolarHBondContact OD2-OG 3.31Å
156	N	98.8	Very high	98.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	156	169.5	68.7	90.1	0	0	0	113.3	E177 K179 D201 R203 T204 S205	N156-E177 CarbonylContact C-O 3.6Å; N156-E177 WeakPolarHBondContact CA-O 3.47Å; N156-E177 HydrophobicContact CB-CB 3.83Å; N156-E177 HydrophobicContact CB-CG 4.19Å; N156-K179 HydrophobicContact CB-CD 4.4Å; N156-K179 HydrophobicContact CB-CG 4.41Å; N156-K179 WeakPolarHBondContact OD1-CD 3.38Å; N156-K179 WeakPolarHBondContact OD1-CE 3.27Å; N156-K179 PolarHBondContact OD1-NZ 3.02Å; N156-D201 PolarHBondContact ND2-OD1 3.39Å; N156-D201 PolarHBondContact ND2-OD2 3.47Å; N156-R203 PolarHBondContact N-O 3.38Å; N156-R203 VanDerWaalsContact ND2-C 3.26Å; N156-R203 WeakPolarHBondContact ND2-CB 3.5Å; N156-R203 PolarHBondContact ND2-O 3.43Å; N156-T204 PolarHBondContact ND2-N 3.03Å; N156-T204 CarbonylContact O-C 3.5Å; N156-T204 WeakPolarHBondContact O-CA 3.41Å; N156-T204 WeakPolarHBondContact OD1-CA 3.43Å; N156-T204 PolarHBondContact OD1-OG1 3.1Å; N156-S205 PolarHBondContact O-N 3.27Å
157	I	98.8	Very high	98.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.1	172.6	60.3	165.2	0	0	0	110.6	I147 C151 V159 A171 V176 E177 V178 K179 C206 I208	I147-I157 HydrophobicContact CD1-CD1 4.33Å; C151-I157 VanDerWaalsContact SG-CG2 3.51Å; I157-V159 HydrophobicContact CD1-CG2 3.74Å; I157-V159 HydrophobicContact CG1-CG2 3.97Å; I157-A171 HydrophobicContact CD1-CB 3.57Å; I157-A171 HydrophobicContact CG1-CB 4.15Å; I157-V176 HydrophobicContact CG1-CG1 4.2Å; I157-V176 HydrophobicContact CG2-CG1 3.92Å; I157-E177 PolarHBondContact N-O 3.37Å; I157-V178 HydrophobicContact CG1-CG2 4.3Å; I157-K179 PolarHBondContact O-N 2.88Å; I157-C206 WeakPolarHBondContact CA-O 3.21Å; I157-C206 WeakPolarHBondContact CG2-SG 3.5Å; I157-I208 HydrophobicContact CD1-CD1 3.8Å
158	L	98.9	Very high	98.2	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	126.8	175.1	-51	179	0	0	0	109.7	K179 Y181 L196 L199 V200 T204 C206 L207 I208	L158-K179 CarbonylContact C-O 3.57Å; L158-K179 WeakPolarHBondContact CA-O 3.32Å; L158-K179 HydrophobicContact CD2-CB 3.82Å; L158-K179 HydrophobicContact CD2-CD 4.16Å; L158-Y181 HydrophobicContact CB-CD1 3.99Å; L158-Y181 HydrophobicContact CB-CE1 4.35Å; L158-L196 HydrophobicContact CB-CD1 4.28Å; L158-L196 HydrophobicContact CD1-CD1 3.58Å; L158-L199 HydrophobicContact CD2-CB 3.93Å; L158-V200 HydrophobicContact CD1-CG2 3.54Å; L158-T204 HydrophobicContact CD1-CG2 4.08Å; L158-T204 HydrophobicContact CD2-CG2 4.23Å; L158-T204 HydrophobicContact CG-CG2 3.84Å; L158-C206 PolarHBondContact N-O 2.84Å; L158-L207 HydrophobicContact CB-CD1 3.83Å; L158-L207 HydrophobicContact CD1-CD1 4.33Å; L158-I208 WeakPolarHBondContact O-CB 3.33Å; L158-I208 PolarHBondContact O-N 2.83Å
159	V	98.8	Very high	98.1	Very high	4 Å²	4	29 Å²	29	2%	0.024	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.6	-174.2	177.5	0	0	0	0	109.8	I157 Y167 V178 K179 L180 Y181 I208	I157-V159 HydrophobicContact CD1-CG2 3.74Å; I157-V159 HydrophobicContact CG1-CG2 3.97Å; V159-Y167 HydrophobicContact CG1-CD2 3.84Å; V159-Y167 HydrophobicContact CG1-CG 4.31Å; V159-V178 HydrophobicContact CB-CG1 3.87Å; V159-V178 HydrophobicContact CG2-CG1 3.73Å; V159-K179 PolarHBondContact N-O 2.68Å; V159-L180 HydrophobicContact CB-CD2 4.09Å; V159-L180 HydrophobicContact CG1-CD2 4.19Å; V159-L180 VanDerWaalsContact O-CA 3.29Å; V159-L180 WeakPolarHBondContact O-CA 3.36Å; V159-Y181 VanDerWaalsContact C-CD1 3.47Å; V159-Y181 WeakPolarHBondContact O-CD1 3.32Å; V159-Y181 PolarHBondContact O-N 3.4Å; V159-I208 HydrophobicContact CG2-CD1 4.18Å
160	P	98.7	Very high	98.1	Very high	6 Å²	6	29 Å²	29	4%	0.039	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	147.5	179.5	23.4	-31.5	0	0	0	112.1	P162 G163 Y181 L183	P160-P162 CarbonylContact O-C 3.36Å; P160-G163 VanDerWaalsContact O-CA 3.25Å; P160-G163 WeakPolarHBondContact O-CA 3.43Å; P160-G163 PolarHBondContact O-N 3.08Å; P160-Y181 CarbonylContact C-O 3Å; P160-Y181 VanDerWaalsContact CA-CZ 3.5Å; P160-Y181 HydrophobicContact CB-CE1 4.28Å; P160-Y181 HydrophobicContact CB-CE2 3.69Å; P160-Y181 WeakPolarHBondContact CB-OH 3.27Å; P160-Y181 WeakPolarHBondContact CD-OH 3.45Å; P160-Y181 VanDerWaalsContact N-CE1 3.3Å; P160-L183 HydrophobicContact CB-CD1 4.15Å; P160-L183 HydrophobicContact CB-CD2 4.31Å; P160-L183 HydrophobicContact CB-CG 4.26Å
161	R	98.3	Very high	98.1	Very high	82 Å²	82	27.8 Å²	27.8	31%	0.309	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.7	170.4	163.4	175.8	171.5	146.6	8.5	108.9	L180 Y181 D182 L183 E406 Y407	R161-L180 HydrophobicContact CB-CB 3.94Å; R161-L180 HydrophobicContact CB-CD1 4.46Å; R161-L180 HydrophobicContact CB-CD2 4.43Å; R161-Y181 PolarHBondContact N-O 2.91Å; R161-D182 WeakPolarHBondContact CD-OD1 3.5Å; R161-D182 IonicContact NE-OD1 2.7Å; R161-L183 PolarHBondContact O-N 3.41Å; R161-E406 WeakPolarHBondContact CD-O 3.44Å; R161-E406 PolarHBondContact NE-O 3.22Å; R161-E406 PolarHBondContact NH1-O 2.99Å; R161-E406 PolarHBondContact NH2-O 2.93Å; R161-Y407 HydrophobicContact CG-CD2 3.65Å; R161-Y407 HydrophobicContact CG-CE2 4.39Å
162	P	98.4	Very high	98	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	S	Bend	cis	-66	146.2	-6.7	25.8	-30.6	0	0	0	112.5	P160 L183 W189 P215 M370 F405 Y407	P160-P162 CarbonylContact O-C 3.36Å; P162-L183 WeakPolarHBondContact O-CD1 3.33Å; P162-W189 HydrophobicContact CG-CE3 4.22Å; P162-W189 HydrophobicContact CG-CH2 4.28Å; P162-W189 HydrophobicContact CG-CZ3 3.85Å; P162-P215 HydrophobicContact CB-CG 3.73Å; P162-P215 HydrophobicContact CG-CG 4.25Å; P162-M370 HydrophobicContact CB-CE 4.21Å; P162-M370 HydrophobicContact CG-CE 4.03Å; P162-F405 WeakPolarHBondContact CA-O 3.27Å; P162-F405 HydrophobicContact CB-CB 3.94Å; P162-Y407 HydrophobicContact CB-CG 4.07Å; P162-Y407 HydrophobicContact CG-CD1 4.26Å; P162-Y407 HydrophobicContact CG-CD2 4.42Å; P162-Y407 HydrophobicContact CG-CG 4.04Å
163	G	97.1	Very high	98	Very high	5 Å²	5	25 Å²	25	5%	0.052	14%	0.141	C	C	.	.			trans	-151.7	157.6	-179.2	0	0	0	0	0	113.6	P160 S165 F405	P160-G163 VanDerWaalsContact O-CA 3.25Å; P160-G163 WeakPolarHBondContact O-CA 3.43Å; P160-G163 PolarHBondContact O-N 3.08Å; G163-S165 PolarHBondContact O-N 2.81Å; G163-F405 WeakPolarHBondContact O-CD1 3.21Å
164	F	97.5	Very high	97.9	Very high	56 Å²	56	22 Å²	22	25%	0.246	12%	0.118	C	C	.	.			trans	-60.1	125.9	-178.5	-177.5	-130.6	0	0	0	111.9	L166 Y167 N214	F164-L166 HydrophobicContact CD1-CB 3.61Å; F164-L166 HydrophobicContact CE1-CB 3.27Å; F164-L166 HydrophobicContact CE1-CD2 3.79Å; F164-L166 HydrophobicContact CE1-CG 4.16Å; F164-L166 HydrophobicContact CG-CB 4.45Å; F164-L166 HydrophobicContact CZ-CB 3.88Å; F164-L166 PolarHBondContact O-N 2.93Å; F164-Y167 HydrophobicContact CB-CD2 4.36Å; F164-Y167 HydrophobicContact CB-CE2 3.78Å; F164-Y167 WeakPolarHBondContact O-CD2 3.43Å; F164-Y167 PolarHBondContact O-N 2.92Å; F164-N214 WeakPolarHBondContact CD2-ND2 3.18Å; F164-N214 PolarHBondContact N-O 2.95Å
165	S	95.4	Very high	97.9	Very high	5 Å²	5	21.9 Å²	21.9	4%	0.035	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.3	-167.8	71.8	0	0	0	0	115.3	N49 I51 G163 Y167 K168 T169	N49-S165 PolarHBondContact OD1-OG 3.43Å; I51-S165 VanDerWaalsContact CD1-OG 3.3Å; I51-S165 WeakPolarHBondContact CD1-OG 3.38Å; G163-S165 PolarHBondContact O-N 2.81Å; S165-Y167 VanDerWaalsContact C-N 3.32Å; S165-Y167 PolarHBondContact O-N 3.27Å; S165-K168 PolarHBondContact O-N 3.1Å; S165-T169 PolarHBondContact O-N 3.15Å; S165-T169 PolarHBondContact O-OG1 2.92Å
166	L	97.9	Very high	97.9	Very high	28 Å²	28	20.6 Å²	20.6	15%	0.147	11%	0.111	C	C	.	.	H	α-helix	trans	-63.7	-36.9	-179.5	-177.9	63.7	0	0	0	112.2	I143 F164 K168 T169 L170	I143-L166 HydrophobicContact CD1-CD2 4.22Å; F164-L166 HydrophobicContact CD1-CB 3.61Å; F164-L166 HydrophobicContact CE1-CB 3.27Å; F164-L166 HydrophobicContact CE1-CD2 3.79Å; F164-L166 HydrophobicContact CE1-CG 4.16Å; F164-L166 HydrophobicContact CG-CB 4.45Å; F164-L166 HydrophobicContact CZ-CB 3.88Å; F164-L166 PolarHBondContact O-N 2.93Å; L166-K168 PolarHBondContact O-N 2.81Å; L166-T169 PolarHBondContact O-N 2.84Å; L166-L170 HydrophobicContact CD1-CD1 3.91Å; L166-L170 HydrophobicContact CD1-CD2 4.29Å; L166-L170 HydrophobicContact CD1-CG 3.81Å; L166-L170 HydrophobicContact CD2-CD1 4.21Å; L166-L170 HydrophobicContact CG-CD1 3.7Å; L166-L170 HydrophobicContact CG-CG 4.07Å; L166-L170 WeakPolarHBondContact O-CB 3.31Å; L166-L170 WeakPolarHBondContact O-CG 3.37Å; L166-L170 PolarHBondContact O-N 3.05Å
167	Y	98.3	Very high	97.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57	-51.4	179.7	-50.4	-47.1	0	0	0	110.9	I143 V159 F164 S165 L170 A171 I208 T210 D242	I143-Y167 HydrophobicContact CD1-CE1 3.86Å; I143-Y167 HydrophobicContact CG1-CE1 4.35Å; I143-Y167 HydrophobicContact CG2-CD1 3.83Å; I143-Y167 HydrophobicContact CG2-CE1 4.14Å; V159-Y167 HydrophobicContact CG1-CD2 3.84Å; V159-Y167 HydrophobicContact CG1-CG 4.31Å; F164-Y167 HydrophobicContact CB-CD2 4.36Å; F164-Y167 HydrophobicContact CB-CE2 3.78Å; F164-Y167 WeakPolarHBondContact O-CD2 3.43Å; F164-Y167 PolarHBondContact O-N 2.92Å; S165-Y167 VanDerWaalsContact C-N 3.32Å; S165-Y167 PolarHBondContact O-N 3.27Å; Y167-L170 PolarHBondContact O-N 3.3Å; Y167-A171 WeakPolarHBondContact O-CB 3.36Å; Y167-A171 PolarHBondContact O-N 2.64Å; Y167-I208 HydrophobicContact CD1-CD1 3.88Å; Y167-I208 HydrophobicContact CD1-CG2 4.07Å; Y167-I208 HydrophobicContact CD2-CG2 4.16Å; Y167-I208 HydrophobicContact CE1-CG2 3.98Å; Y167-I208 HydrophobicContact CE2-CG2 4.03Å; Y167-I208 HydrophobicContact CG-CD1 3.94Å; Y167-I208 HydrophobicContact CG-CG2 4.18Å; Y167-T210 WeakPolarHBondContact CE2-OG1 3.14Å; Y167-T210 WeakPolarHBondContact OH-CG2 3.3Å; Y167-T210 PolarHBondContact OH-OG1 2.97Å; Y167-D242 HydrophobicContact CE1-CB 4.38Å; Y167-D242 WeakPolarHBondContact OH-CB 3.31Å; Y167-D242 PolarHBondContact OH-OD2 3.41Å
168	K	97.4	Very high	97.9	Very high	61 Å²	61	26 Å²	26	27%	0.265	14%	0.138	S	C	.	.	H	α-helix	trans	-62.7	-44.2	177.2	-175.9	174	-179.2	179.1	0	111.8	P50 S165 L166 L170 V172 V178 E406	P50-K168 HydrophobicContact CG-CD 4.38Å; S165-K168 PolarHBondContact O-N 3.1Å; L166-K168 PolarHBondContact O-N 2.81Å; K168-L170 VanDerWaalsContact C-N 3.33Å; K168-L170 PolarHBondContact O-N 3.35Å; K168-V172 HydrophobicContact CG-CG2 4.12Å; K168-V172 WeakPolarHBondContact O-CB 3.45Å; K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 3.24Å; K168-V178 HydrophobicContact CB-CG2 4.4Å; K168-V178 HydrophobicContact CG-CG2 4.25Å; K168-E406 HydrophobicContact CD-CG 4.46Å; K168-E406 IonicContact NZ-OE1 3.88Å; K168-E406 PolarHBondContact NZ-OE1 3.18Å; K168-E406 IonicContact NZ-OE2 3.7Å; K168-E406 PolarHBondContact NZ-OE2 2.68Å
169	T	97.8	Very high	97.9	Very high	14 Å²	14	27.1 Å²	27.1	9%	0.086	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-46	179.1	-56	0	0	0	0	111.6	T47 L48 S165 L166 S173	T47-T169 HydrophobicContact CG2-CG2 4.15Å; L48-T169 WeakPolarHBondContact O-CG2 3.37Å; L48-T169 PolarHBondContact O-OG1 3.43Å; S165-T169 PolarHBondContact O-N 3.15Å; S165-T169 PolarHBondContact O-OG1 2.92Å; L166-T169 PolarHBondContact O-N 2.84Å; T169-S173 WeakPolarHBondContact O-CB 3.35Å; T169-S173 PolarHBondContact O-N 3.14Å; T169-S173 PolarHBondContact O-OG 3.22Å
170	L	98.3	Very high	97.9	Very high	25 Å²	25	28.8 Å²	28.8	13%	0.131	15%	0.151	C	C	.	.	H	α-helix	trans	-70.3	-52.9	-179.4	-68.7	172.5	0	0	0	111.3	I143 E144 I147 L166 Y167 K168 V172 S173 M174	I143-L170 HydrophobicContact CB-CD1 4.32Å; I143-L170 HydrophobicContact CG2-CD1 3.75Å; E144-L170 HydrophobicContact CB-CD1 3.98Å; E144-L170 HydrophobicContact CB-CD2 4.07Å; E144-L170 HydrophobicContact CG-CD2 4.04Å; I147-L170 HydrophobicContact CD1-CB 4.16Å; I147-L170 HydrophobicContact CD1-CD1 4.46Å; L166-L170 HydrophobicContact CD1-CD1 3.91Å; L166-L170 HydrophobicContact CD1-CD2 4.29Å; L166-L170 HydrophobicContact CD1-CG 3.81Å; L166-L170 HydrophobicContact CD2-CD1 4.21Å; L166-L170 HydrophobicContact CG-CD1 3.7Å; L166-L170 HydrophobicContact CG-CG 4.07Å; L166-L170 WeakPolarHBondContact O-CB 3.31Å; L166-L170 WeakPolarHBondContact O-CG 3.37Å; L166-L170 PolarHBondContact O-N 3.05Å; Y167-L170 PolarHBondContact O-N 3.3Å; K168-L170 VanDerWaalsContact C-N 3.33Å; K168-L170 PolarHBondContact O-N 3.35Å; L170-V172 PolarHBondContact O-N 2.84Å; L170-S173 PolarHBondContact O-N 3.19Å; L170-S173 PolarHBondContact O-OG 3.13Å; L170-M174 HydrophobicContact CB-CE 4.43Å; L170-M174 WeakPolarHBondContact O-CG 3.28Å; L170-M174 PolarHBondContact O-N 2.91Å
171	A	98.1	Very high	97.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.7	-52.3	-176.8	0	0	0	0	0	112.3	I157 Y167 S173 M174 G175 V176 V178	I157-A171 HydrophobicContact CD1-CB 3.57Å; I157-A171 HydrophobicContact CG1-CB 4.15Å; Y167-A171 WeakPolarHBondContact O-CB 3.36Å; Y167-A171 PolarHBondContact O-N 2.64Å; A171-S173 VanDerWaalsContact C-N 3.28Å; A171-S173 PolarHBondContact O-N 2.8Å; A171-M174 CarbonylContact O-C 3.5Å; A171-M174 WeakPolarHBondContact O-CA 3.28Å; A171-M174 PolarHBondContact O-N 3.15Å; A171-G175 PolarHBondContact O-N 3.3Å; A171-V176 CarbonylContact C-O 3.59Å; A171-V176 HydrophobicContact CB-CB 3.99Å; A171-V176 HydrophobicContact CB-CG1 4.17Å; A171-V176 WeakPolarHBondContact O-CB 3.42Å; A171-V176 PolarHBondContact O-N 3.24Å; A171-V178 HydrophobicContact CB-CG2 3.66Å
172	V	97.1	Very high	97.9	Very high	56 Å²	56	26.9 Å²	26.9	34%	0.339	15%	0.147	S	C	.	.	H	α-helix	trans	-62.1	-37	-179	173.7	0	0	0	0	111.5	K168 L170 M174 G175 V178	K168-V172 HydrophobicContact CG-CG2 4.12Å; K168-V172 WeakPolarHBondContact O-CB 3.45Å; K168-V172 WeakPolarHBondContact O-CG2 3.46Å; K168-V172 PolarHBondContact O-N 3.24Å; L170-V172 PolarHBondContact O-N 2.84Å; V172-M174 PolarHBondContact O-N 3.13Å; V172-G175 PolarHBondContact O-N 3.26Å; V172-G175 VanDerWaalsContact O-N 3.09Å; V172-V178 HydrophobicContact CG2-CG2 4.15Å
173	S	97.5	Very high	97.9	Very high	9 Å²	9	27 Å²	27	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-27.6	176.6	77.2	0	0	0	0	113.3	M43 T47 T169 L170 A171	M43-S173 WeakPolarHBondContact CG-O 3.41Å; T47-S173 VanDerWaalsContact OG1-CB 3.27Å; T47-S173 WeakPolarHBondContact OG1-CB 3.4Å; T169-S173 WeakPolarHBondContact O-CB 3.35Å; T169-S173 PolarHBondContact O-N 3.14Å; T169-S173 PolarHBondContact O-OG 3.22Å; L170-S173 PolarHBondContact O-N 3.19Å; L170-S173 PolarHBondContact O-OG 3.13Å; A171-S173 VanDerWaalsContact C-N 3.28Å; A171-S173 PolarHBondContact O-N 2.8Å
174	M	97	Very high	98	Very high	38 Å²	38	28.2 Å²	28.2	19%	0.187	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	0.5	178.5	-62.2	171.9	-169	0	0	112.9	E144 I147 S148 P153 L170 A171 V172 V176	E144-M174 HydrophobicContact CG-CE 3.66Å; I147-M174 HydrophobicContact CG2-SD 4.03Å; S148-M174 VanDerWaalsContact OG-CE 3.24Å; S148-M174 WeakPolarHBondContact OG-CE 3.4Å; S148-M174 PolarHBondContact OG-SD 3.05Å; P153-M174 WeakPolarHBondContact CG-O 3.4Å; L170-M174 HydrophobicContact CB-CE 4.43Å; L170-M174 WeakPolarHBondContact O-CG 3.28Å; L170-M174 PolarHBondContact O-N 2.91Å; A171-M174 CarbonylContact O-C 3.5Å; A171-M174 WeakPolarHBondContact O-CA 3.28Å; A171-M174 PolarHBondContact O-N 3.15Å; V172-M174 PolarHBondContact O-N 3.13Å; M174-V176 VanDerWaalsContact C-N 3.35Å; M174-V176 HydrophobicContact CB-CG2 4.17Å
175	G	97.7	Very high	98	Very high	35 Å²	35	26.8 Å²	26.8	36%	0.361	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	20.7	-175	0	0	0	0	0	113.8	P153 G154 A171 V172	P153-G175 WeakPolarHBondContact CA-O 3.4Å; G154-G175 PolarHBondContact N-O 3.1Å; A171-G175 PolarHBondContact O-N 3.3Å; V172-G175 PolarHBondContact O-N 3.26Å; V172-G175 VanDerWaalsContact O-N 3.09Å
176	V	98.4	Very high	98.1	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.03	18%	0.178	C	C	.	.			trans	-93.3	131.8	175	-179.3	0	0	0	0	109	C151 D155 I157 A171 M174	C151-V176 HydrophobicContact CB-CG1 4.23Å; C151-V176 HydrophobicContact CB-CG2 3.62Å; D155-V176 WeakPolarHBondContact O-CG1 3.41Å; I157-V176 HydrophobicContact CG1-CG1 4.2Å; I157-V176 HydrophobicContact CG2-CG1 3.92Å; A171-V176 CarbonylContact C-O 3.59Å; A171-V176 HydrophobicContact CB-CB 3.99Å; A171-V176 HydrophobicContact CB-CG1 4.17Å; A171-V176 WeakPolarHBondContact O-CB 3.42Å; A171-V176 PolarHBondContact O-N 3.24Å; M174-V176 VanDerWaalsContact C-N 3.35Å; M174-V176 HydrophobicContact CB-CG2 4.17Å
177	E	98.4	Very high	98.1	Very high	84 Å²	84	37.2 Å²	37.2	39%	0.393	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	143.9	176.7	-179.7	-174.9	167.4	0	0	110.8	D155 N156 I157 R203	D155-E177 PolarHBondContact O-N 3.28Å; N156-E177 CarbonylContact C-O 3.6Å; N156-E177 WeakPolarHBondContact CA-O 3.47Å; N156-E177 HydrophobicContact CB-CB 3.83Å; N156-E177 HydrophobicContact CB-CG 4.19Å; I157-E177 PolarHBondContact N-O 3.37Å; E177-R203 IonicContact OE2-NH2 3.29Å; E177-R203 PolarHBondContact OE2-NH2 2.77Å
178	V	98.4	Very high	98.1	Very high	29 Å²	29	40.9 Å²	40.9	18%	0.176	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.2	179.1	174.4	0	0	0	0	108.7	I157 V159 K168 A171 V172 L180	I157-V178 HydrophobicContact CG1-CG2 4.3Å; V159-V178 HydrophobicContact CB-CG1 3.87Å; V159-V178 HydrophobicContact CG2-CG1 3.73Å; K168-V178 HydrophobicContact CB-CG2 4.4Å; K168-V178 HydrophobicContact CG-CG2 4.25Å; A171-V178 HydrophobicContact CB-CG2 3.66Å; V172-V178 HydrophobicContact CG2-CG2 4.15Å; V178-L180 HydrophobicContact CG1-CD2 3.87Å; V178-L180 HydrophobicContact CG1-CG 4.44Å
179	K	98.7	Very high	98.1	Very high	28 Å²	28	38.1 Å²	38.1	12%	0.122	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.1	170.2	-64.5	-179.9	-179.4	170.3	0	109	N156 I157 L158 V159 L199 D201	N156-K179 HydrophobicContact CB-CD 4.4Å; N156-K179 HydrophobicContact CB-CG 4.41Å; N156-K179 WeakPolarHBondContact OD1-CD 3.38Å; N156-K179 WeakPolarHBondContact OD1-CE 3.27Å; N156-K179 PolarHBondContact OD1-NZ 3.02Å; I157-K179 PolarHBondContact O-N 2.88Å; L158-K179 CarbonylContact C-O 3.57Å; L158-K179 WeakPolarHBondContact CA-O 3.32Å; L158-K179 HydrophobicContact CD2-CB 3.82Å; L158-K179 HydrophobicContact CD2-CD 4.16Å; V159-K179 PolarHBondContact N-O 2.68Å; K179-L199 HydrophobicContact CD-CB 4.42Å; K179-L199 VanDerWaalsContact CD-O 3.3Å; K179-L199 WeakPolarHBondContact CD-O 3.37Å; K179-L199 PolarHBondContact NZ-O 3.47Å; K179-D201 IonicContact NZ-OD1 2.65Å; K179-D201 PolarHBondContact NZ-OD1 3.4Å; K179-D201 IonicContact NZ-OD2 3.25Å; K179-D201 PolarHBondContact NZ-OD2 2.9Å
180	L	98.7	Very high	98.2	Very high	38 Å²	38	40.3 Å²	40.3	20%	0.199	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.4	-175.2	-64.1	175.9	0	0	0	109.9	V159 R161 V178 L199 E406	V159-L180 HydrophobicContact CB-CD2 4.09Å; V159-L180 HydrophobicContact CG1-CD2 4.19Å; V159-L180 VanDerWaalsContact O-CA 3.29Å; V159-L180 WeakPolarHBondContact O-CA 3.36Å; R161-L180 HydrophobicContact CB-CB 3.94Å; R161-L180 HydrophobicContact CB-CD1 4.46Å; R161-L180 HydrophobicContact CB-CD2 4.43Å; V178-L180 HydrophobicContact CG1-CD2 3.87Å; V178-L180 HydrophobicContact CG1-CG 4.44Å; L180-L199 VanDerWaalsContact O-CD1 3.23Å; L180-L199 WeakPolarHBondContact O-CD1 3.25Å; L180-E406 HydrophobicContact CD1-CB 3.79Å; L180-E406 HydrophobicContact CD1-CG 4Å
181	Y	98.7	Very high	98.2	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	145.1	168.9	66.9	-98.9	0	0	0	109.8	L158 V159 P160 R161 L183 I191 L196 L207 I208	L158-Y181 HydrophobicContact CB-CD1 3.99Å; L158-Y181 HydrophobicContact CB-CE1 4.35Å; V159-Y181 VanDerWaalsContact C-CD1 3.47Å; V159-Y181 WeakPolarHBondContact O-CD1 3.32Å; V159-Y181 PolarHBondContact O-N 3.4Å; P160-Y181 CarbonylContact C-O 3Å; P160-Y181 VanDerWaalsContact CA-CZ 3.5Å; P160-Y181 HydrophobicContact CB-CE1 4.28Å; P160-Y181 HydrophobicContact CB-CE2 3.69Å; P160-Y181 WeakPolarHBondContact CB-OH 3.27Å; P160-Y181 WeakPolarHBondContact CD-OH 3.45Å; P160-Y181 VanDerWaalsContact N-CE1 3.3Å; R161-Y181 PolarHBondContact N-O 2.91Å; Y181-L183 HydrophobicContact CD2-CD2 4.3Å; Y181-L183 HydrophobicContact CE2-CD2 3.79Å; Y181-I191 HydrophobicContact CD2-CG2 3.57Å; Y181-I191 HydrophobicContact CE2-CB 4.28Å; Y181-I191 HydrophobicContact CE2-CD1 3.65Å; Y181-I191 HydrophobicContact CE2-CG1 3.8Å; Y181-I191 HydrophobicContact CE2-CG2 3.67Å; Y181-L196 HydrophobicContact CD1-CD1 3.64Å; Y181-L196 HydrophobicContact CD2-CD1 4.45Å; Y181-L196 HydrophobicContact CE1-CD1 4.22Å; Y181-L196 HydrophobicContact CG-CD1 3.75Å; Y181-L207 HydrophobicContact CD1-CD1 4.14Å; Y181-L207 HydrophobicContact CE1-CD1 3.53Å; Y181-I208 WeakPolarHBondContact CE1-O 3.45Å; Y181-I208 PolarHBondContact OH-O 2.7Å
182	D	98.4	Very high	98.2	Very high	46 Å²	46	41.5 Å²	41.5	25%	0.246	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	147.4	-173.9	-65.1	-41.3	0	0	0	112.6	R161 D192 H195	R161-D182 WeakPolarHBondContact CD-OD1 3.5Å; R161-D182 IonicContact NE-OD1 2.7Å; D182-D192 PolarHBondContact O-N 3.44Å; D182-H195 PolarHBondContact N-ND1 3.18Å; D182-H195 IonicContact OD2-CE1 3.48Å; D182-H195 PolarHBondContact OD2-CE1 3.3Å; D182-H195 IonicContact OD2-ND1 3.08Å; D182-H195 PolarHBondContact OD2-ND1 3.23Å
183	L	98.9	Very high	98.3	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	142.6	164.3	-56.1	-175.8	0	0	0	108.7	P160 R161 P162 Y181 P185 W189 E190 I191 F220	P160-L183 HydrophobicContact CB-CD1 4.15Å; P160-L183 HydrophobicContact CB-CD2 4.31Å; P160-L183 HydrophobicContact CB-CG 4.26Å; R161-L183 PolarHBondContact O-N 3.41Å; P162-L183 WeakPolarHBondContact O-CD1 3.33Å; Y181-L183 HydrophobicContact CD2-CD2 4.3Å; Y181-L183 HydrophobicContact CE2-CD2 3.79Å; L183-P185 VanDerWaalsContact O-CD 3.3Å; L183-P185 WeakPolarHBondContact O-CD 3.36Å; L183-W189 HydrophobicContact CB-CB 4.18Å; L183-W189 HydrophobicContact CB-CE3 3.84Å; L183-W189 HydrophobicContact CD1-CB 4.43Å; L183-E190 CarbonylContact C-O 3.59Å; L183-E190 WeakPolarHBondContact CA-O 3.49Å; L183-I191 HydrophobicContact CD2-CB 4.26Å; L183-I191 HydrophobicContact CD2-CG1 3.68Å; L183-F220 HydrophobicContact CD2-CZ 4.41Å
184	L	98.7	Very high	98.3	Very high	30 Å²	30	47.8 Å²	47.8	16%	0.157	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	103.6	-171.3	-62.2	177.2	0	0	0	111.3	E186 K187 W189 E190 D192	L184-E186 PolarHBondContact O-N 3.06Å; L184-K187 HydrophobicContact CB-CB 4.11Å; L184-K187 HydrophobicContact CB-CG 4.42Å; L184-K187 HydrophobicContact CD1-CD 3.91Å; L184-K187 CarbonylContact O-C 3.39Å; L184-K187 PolarHBondContact O-N 3.24Å; L184-W189 WeakPolarHBondContact O-CA 3.4Å; L184-W189 PolarHBondContact O-N 3.25Å; L184-E190 PolarHBondContact N-O 3.33Å; L184-D192 HydrophobicContact CD1-CB 4.14Å; L184-D192 HydrophobicContact CD2-CB 4.09Å; L184-D192 HydrophobicContact CG-CB 4.06Å
185	P	98.3	Very high	98.4	Very high	26 Å²	26	48.2 Å²	48.2	17%	0.169	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-54.7	-39.4	-177.7	-8.7	9.7	0	0	0	113.3	L183 K187 S188 W189 V361 Y407 F410	L183-P185 VanDerWaalsContact O-CD 3.3Å; L183-P185 WeakPolarHBondContact O-CD 3.36Å; P185-K187 PolarHBondContact O-N 2.99Å; P185-S188 PolarHBondContact O-N 2.69Å; P185-W189 HydrophobicContact CB-CD2 4.26Å; P185-W189 HydrophobicContact CB-CE3 4.11Å; P185-W189 HydrophobicContact CB-CH2 3.66Å; P185-W189 HydrophobicContact CB-CZ2 3.78Å; P185-W189 HydrophobicContact CB-CZ3 3.82Å; P185-W189 HydrophobicContact CG-CE3 4.04Å; P185-W189 HydrophobicContact CG-CH2 3.55Å; P185-W189 HydrophobicContact CG-CZ2 4.21Å; P185-W189 HydrophobicContact CG-CZ3 3.44Å; P185-W189 VanDerWaalsContact CG-CZ3 3.44Å; P185-V361 HydrophobicContact CB-CG2 4.11Å; P185-Y407 WeakPolarHBondContact CG-OH 3.42Å; P185-F410 HydrophobicContact CB-CZ 4.37Å; P185-F410 HydrophobicContact CG-CZ 4.2Å
186	E	97.7	Very high	98.4	Very high	140 Å²	140	46.6 Å²	46.6	65%	0.654	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-70.6	-12.7	-179.5	75	-71.6	173.9	0	0	113.9	L184	L184-E186 PolarHBondContact O-N 3.06Å
187	K	98	Very high	98.4	Very high	113 Å²	113	49.5 Å²	49.5	49%	0.491	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-116.9	41.9	173	-59.3	-172.2	-175.3	172	0	111.2	L184 P185 W189 E190	L184-K187 HydrophobicContact CB-CB 4.11Å; L184-K187 HydrophobicContact CB-CG 4.42Å; L184-K187 HydrophobicContact CD1-CD 3.91Å; L184-K187 CarbonylContact O-C 3.39Å; L184-K187 PolarHBondContact O-N 3.24Å; P185-K187 PolarHBondContact O-N 2.99Å; K187-W189 PolarHBondContact O-N 3.04Å; K187-W189 VanDerWaalsContact O-N 3.1Å; K187-E190 HydrophobicContact CB-CB 4.25Å; K187-E190 WeakPolarHBondContact O-CB 3.27Å; K187-E190 WeakPolarHBondContact O-CG 3.34Å; K187-E190 PolarHBondContact O-N 3.32Å
188	S	97.3	Very high	98.3	Very high	77 Å²	77	49.6 Å²	49.6	54%	0.538	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	33.9	177.7	-55.2	0	0	0	0	113.3	P185 E190 S218	P185-S188 PolarHBondContact O-N 2.69Å; S188-E190 VanDerWaalsContact C-N 3.29Å; S188-E190 PolarHBondContact O-N 3.37Å; S188-S218 WeakPolarHBondContact O-CB 3.24Å
189	W	98.7	Very high	98.3	Very high	2 Å²	2	50 Å²	50	1%	0.008	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	26.4	-176.2	-54.4	101.7	0	0	0	115.2	P162 L183 L184 P185 K187 C216 F220 V361 M370 Y407 F410	P162-W189 HydrophobicContact CG-CE3 4.22Å; P162-W189 HydrophobicContact CG-CH2 4.28Å; P162-W189 HydrophobicContact CG-CZ3 3.85Å; L183-W189 HydrophobicContact CB-CB 4.18Å; L183-W189 HydrophobicContact CB-CE3 3.84Å; L183-W189 HydrophobicContact CD1-CB 4.43Å; L184-W189 WeakPolarHBondContact O-CA 3.4Å; L184-W189 PolarHBondContact O-N 3.25Å; P185-W189 HydrophobicContact CB-CD2 4.26Å; P185-W189 HydrophobicContact CB-CE3 4.11Å; P185-W189 HydrophobicContact CB-CH2 3.66Å; P185-W189 HydrophobicContact CB-CZ2 3.78Å; P185-W189 HydrophobicContact CB-CZ3 3.82Å; P185-W189 HydrophobicContact CG-CE3 4.04Å; P185-W189 HydrophobicContact CG-CH2 3.55Å; P185-W189 HydrophobicContact CG-CZ2 4.21Å; P185-W189 HydrophobicContact CG-CZ3 3.44Å; P185-W189 VanDerWaalsContact CG-CZ3 3.44Å; K187-W189 PolarHBondContact O-N 3.04Å; K187-W189 VanDerWaalsContact O-N 3.1Å; W189-C216 HydrophobicContact CB-CB 3.95Å; W189-C216 HydrophobicContact CD2-CB 4.11Å; W189-C216 HydrophobicContact CG-CB 3.61Å; W189-F220 VanDerWaalsContact O-CE1 3.31Å; W189-F220 WeakPolarHBondContact O-CE1 3.35Å; W189-V361 HydrophobicContact CZ2-CB 4.47Å; W189-V361 HydrophobicContact CZ2-CG2 3.95Å; W189-V361 VanDerWaalsContact NE1-CB 3.34Å; W189-V361 VanDerWaalsContact NE1-CG1 3.31Å; W189-M370 HydrophobicContact CZ2-CB 3.69Å; W189-M370 HydrophobicContact CZ2-CG 4.31Å; W189-Y407 HydrophobicContact CH2-CD1 4.22Å; W189-Y407 AromaticContact CH2-CE1 3.64Å; W189-Y407 HydrophobicContact CH2-CE1 3.64Å; W189-Y407 HydrophobicContact CZ3-CD1 4.38Å; W189-Y407 AromaticContact CZ3-CE1 3.73Å; W189-Y407 HydrophobicContact CZ3-CE1 3.73Å; W189-Y407 AromaticContact CZ3-CZ 3.83Å; W189-F410 AromaticContact CH2-CD1 4Å; W189-F410 HydrophobicContact CH2-CD1 4Å; W189-F410 AromaticContact CH2-CE1 3.59Å; W189-F410 HydrophobicContact CH2-CE1 3.59Å; W189-F410 AromaticContact CH2-CZ 3.94Å; W189-F410 HydrophobicContact CH2-CZ 3.94Å; W189-F410 HydrophobicContact CZ2-CD1 4.07Å; W189-F410 AromaticContact CZ2-CE1 3.61Å; W189-F410 HydrophobicContact CZ2-CE1 3.61Å; W189-F410 HydrophobicContact CZ2-CZ 4.33Å
190	E	98.7	Very high	98.3	Very high	61 Å²	61	50.3 Å²	50.3	29%	0.285	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	148.8	166.7	-79.2	-176.6	168.9	0	0	111.2	L183 L184 K187 S188 D192 H224	L183-E190 CarbonylContact C-O 3.59Å; L183-E190 WeakPolarHBondContact CA-O 3.49Å; L184-E190 PolarHBondContact N-O 3.33Å; K187-E190 HydrophobicContact CB-CB 4.25Å; K187-E190 WeakPolarHBondContact O-CB 3.27Å; K187-E190 WeakPolarHBondContact O-CG 3.34Å; K187-E190 PolarHBondContact O-N 3.32Å; S188-E190 VanDerWaalsContact C-N 3.29Å; S188-E190 PolarHBondContact O-N 3.37Å; E190-D192 PolarHBondContact O-N 3.37Å; E190-H224 HydrophobicContact CG-CB 4.46Å; E190-H224 IonicContact OE1-CG 2.91Å
191	I	98.8	Very high	98.2	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.026	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.2	175.5	-54.9	-171.6	0	0	0	109.5	Y181 L183 L193 L196 F220 H224 I228	Y181-I191 HydrophobicContact CD2-CG2 3.57Å; Y181-I191 HydrophobicContact CE2-CB 4.28Å; Y181-I191 HydrophobicContact CE2-CD1 3.65Å; Y181-I191 HydrophobicContact CE2-CG1 3.8Å; Y181-I191 HydrophobicContact CE2-CG2 3.67Å; L183-I191 HydrophobicContact CD2-CB 4.26Å; L183-I191 HydrophobicContact CD2-CG1 3.68Å; I191-L193 HydrophobicContact CB-CD2 4.21Å; I191-L193 HydrophobicContact CG2-CD2 4.11Å; I191-L193 PolarHBondContact O-N 2.69Å; I191-L196 HydrophobicContact CG2-CB 4.18Å; I191-L196 HydrophobicContact CG2-CD2 4.1Å; I191-F220 HydrophobicContact CD1-CE2 4.01Å; I191-F220 HydrophobicContact CD1-CZ 4.21Å; I191-F220 HydrophobicContact CG1-CE1 4.45Å; I191-F220 HydrophobicContact CG1-CE2 3.98Å; I191-F220 HydrophobicContact CG1-CZ 3.69Å; I191-H224 PolarHBondContact N-NE2 3.44Å; I191-H224 PolarHBondContact O-CE1 3.47Å; I191-I228 HydrophobicContact CD1-CD1 3.51Å; I191-I228 HydrophobicContact CD1-CG1 3.94Å; I191-I228 HydrophobicContact CG1-CD1 4.13Å
192	D	98.6	Very high	98.1	Very high	45 Å²	45	59.1 Å²	59.1	24%	0.241	30%	0.304	C	S	.	.			trans	-70.1	95.6	163	-174.2	-22.1	0	0	0	109.1	D182 L184 E190 Q194 H195 L196	D182-D192 PolarHBondContact O-N 3.44Å; L184-D192 HydrophobicContact CD1-CB 4.14Å; L184-D192 HydrophobicContact CD2-CB 4.09Å; L184-D192 HydrophobicContact CG-CB 4.06Å; E190-D192 PolarHBondContact O-N 3.37Å; D192-Q194 VanDerWaalsContact C-N 3.26Å; D192-Q194 PolarHBondContact O-N 3.43Å; D192-Q194 PolarHBondContact OD1-N 2.92Å; D192-H195 HydrophobicContact CB-CB 3.89Å; D192-H195 VanDerWaalsContact CG-CB 3.49Å; D192-H195 PolarHBondContact O-N 3.48Å; D192-H195 PolarHBondContact OD1-N 3.05Å; D192-L196 VanDerWaalsContact O-CB 3.32Å; D192-L196 WeakPolarHBondContact O-CB 3.49Å; D192-L196 PolarHBondContact O-N 3.37Å
193	L	98.5	Very high	98.1	Very high	35 Å²	35	62 Å²	62	18%	0.183	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-30.5	-177.2	-61.9	177.7	0	0	0	112.6	I191 L196 E197 N227 I228 V231	I191-L193 HydrophobicContact CB-CD2 4.21Å; I191-L193 HydrophobicContact CG2-CD2 4.11Å; I191-L193 PolarHBondContact O-N 2.69Å; L193-L196 HydrophobicContact CD2-CD2 4.26Å; L193-E197 WeakPolarHBondContact O-CB 3.4Å; L193-E197 WeakPolarHBondContact O-CG 3.38Å; L193-E197 PolarHBondContact O-N 3.34Å; L193-N227 HydrophobicContact CD1-CB 3.52Å; L193-I228 HydrophobicContact CD2-CG1 3.82Å; L193-V231 HydrophobicContact CB-CG2 4.39Å; L193-V231 HydrophobicContact CD2-CG2 4.33Å
194	Q	98.1	Very high	98.1	Very high	161 Å²	161	62.6 Å²	62.6	75%	0.752	32%	0.315	S	S	*	.	H	α-helix	trans	-72.2	-44.2	178.3	-176.3	178.2	2.3	0	0	110.4	D192 E197 S198	D192-Q194 VanDerWaalsContact C-N 3.26Å; D192-Q194 PolarHBondContact O-N 3.43Å; D192-Q194 PolarHBondContact OD1-N 2.92Å; Q194-E197 PolarHBondContact O-N 2.86Å; Q194-S198 PolarHBondContact O-N 3.29Å; Q194-S198 VanDerWaalsContact O-N 3.14Å
195	H	98.3	Very high	98.1	Very high	47 Å²	47	62.2 Å²	62.2	22%	0.218	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-46.1	173.5	-177	-157.4	0	0	0	110.5	D182 D192 E197 S198 L199	D182-H195 PolarHBondContact N-ND1 3.18Å; D182-H195 IonicContact OD2-CE1 3.48Å; D182-H195 PolarHBondContact OD2-CE1 3.3Å; D182-H195 IonicContact OD2-ND1 3.08Å; D182-H195 PolarHBondContact OD2-ND1 3.23Å; D192-H195 HydrophobicContact CB-CB 3.89Å; D192-H195 VanDerWaalsContact CG-CB 3.49Å; D192-H195 PolarHBondContact O-N 3.48Å; D192-H195 PolarHBondContact OD1-N 3.05Å; H195-E197 PolarHBondContact O-N 3.22Å; H195-S198 PolarHBondContact O-N 2.9Å; H195-S198 VanDerWaalsContact O-N 3.07Å; H195-S198 PolarHBondContact O-OG 2.92Å; H195-L199 WeakPolarHBondContact O-CG 3.47Å; H195-L199 PolarHBondContact O-N 3.33Å
196	L	98.2	Very high	98.1	Very high	2 Å²	2	61 Å²	61	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-53	-50.9	175.8	176.6	69.2	0	0	0	112.1	L158 Y181 I191 D192 L193 S198 L199 V200 L207 V231	L158-L196 HydrophobicContact CB-CD1 4.28Å; L158-L196 HydrophobicContact CD1-CD1 3.58Å; Y181-L196 HydrophobicContact CD1-CD1 3.64Å; Y181-L196 HydrophobicContact CD2-CD1 4.45Å; Y181-L196 HydrophobicContact CE1-CD1 4.22Å; Y181-L196 HydrophobicContact CG-CD1 3.75Å; I191-L196 HydrophobicContact CG2-CB 4.18Å; I191-L196 HydrophobicContact CG2-CD2 4.1Å; D192-L196 VanDerWaalsContact O-CB 3.32Å; D192-L196 WeakPolarHBondContact O-CB 3.49Å; D192-L196 PolarHBondContact O-N 3.37Å; L193-L196 HydrophobicContact CD2-CD2 4.26Å; L196-S198 VanDerWaalsContact C-N 3.26Å; L196-S198 PolarHBondContact O-N 2.68Å; L196-L199 PolarHBondContact O-N 3.11Å; L196-V200 WeakPolarHBondContact O-CG2 3.45Å; L196-L207 HydrophobicContact CD1-CD1 3.69Å; L196-L207 HydrophobicContact CD1-CD2 4.48Å; L196-L207 HydrophobicContact CD2-CD2 4.03Å; L196-V231 HydrophobicContact CD2-CG1 4.04Å
197	E	97.8	Very high	98.1	Very high	65 Å²	65	54.5 Å²	54.5	30%	0.304	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-37	178.3	-80.5	-170.7	-141.2	0	0	112.5	L193 Q194 H195 L199 V231 K234 L235	L193-E197 WeakPolarHBondContact O-CB 3.4Å; L193-E197 WeakPolarHBondContact O-CG 3.38Å; L193-E197 PolarHBondContact O-N 3.34Å; Q194-E197 PolarHBondContact O-N 2.86Å; H195-E197 PolarHBondContact O-N 3.22Å; E197-L199 VanDerWaalsContact C-N 3.27Å; E197-L199 PolarHBondContact O-N 2.66Å; E197-V231 HydrophobicContact CG-CB 4.41Å; E197-V231 HydrophobicContact CG-CG1 3.5Å; E197-V231 HydrophobicContact CG-CG2 4.1Å; E197-V231 WeakPolarHBondContact OE1-CG2 3.28Å; E197-K234 IonicContact OE1-NZ 3.93Å; E197-K234 IonicContact OE2-NZ 2.68Å; E197-K234 PolarHBondContact OE2-NZ 2.92Å; E197-L235 HydrophobicContact CG-CD1 4.31Å
198	S	97.9	Very high	98.2	Very high	86 Å²	86	49.1 Å²	49.1	60%	0.601	25%	0.254	S	S	*	.	H	α-helix	trans	-70.5	-19.3	-176.8	77.4	0	0	0	0	114.7	Q194 H195 L196	Q194-S198 PolarHBondContact O-N 3.29Å; Q194-S198 VanDerWaalsContact O-N 3.14Å; H195-S198 PolarHBondContact O-N 2.9Å; H195-S198 VanDerWaalsContact O-N 3.07Å; H195-S198 PolarHBondContact O-OG 2.92Å; L196-S198 VanDerWaalsContact C-N 3.26Å; L196-S198 PolarHBondContact O-N 2.68Å
199	L	98.1	Very high	98.3	Very high	38 Å²	38	45.6 Å²	45.6	20%	0.199	23%	0.229	C	C	.	.	H	α-helix	trans	-87	-17.7	-175.7	-67.6	170.7	0	0	0	113.5	L158 K179 L180 H195 L196 E197	L158-L199 HydrophobicContact CD2-CB 3.93Å; K179-L199 HydrophobicContact CD-CB 4.42Å; K179-L199 VanDerWaalsContact CD-O 3.3Å; K179-L199 WeakPolarHBondContact CD-O 3.37Å; K179-L199 PolarHBondContact NZ-O 3.47Å; L180-L199 VanDerWaalsContact O-CD1 3.23Å; L180-L199 WeakPolarHBondContact O-CD1 3.25Å; H195-L199 WeakPolarHBondContact O-CG 3.47Å; H195-L199 PolarHBondContact O-N 3.33Å; L196-L199 PolarHBondContact O-N 3.11Å; E197-L199 VanDerWaalsContact C-N 3.27Å; E197-L199 PolarHBondContact O-N 2.66Å
200	V	97.3	Very high	98.3	Very high	35 Å²	35	45.8 Å²	45.8	21%	0.212	23%	0.23	C	C	.	.			trans	-74.4	132.8	-171.7	-176.9	0	0	0	0	110.4	L158 L196 T204 L235 V237	L158-V200 HydrophobicContact CD1-CG2 3.54Å; L196-V200 WeakPolarHBondContact O-CG2 3.45Å; V200-T204 HydrophobicContact CG1-CG2 4.21Å; V200-L235 HydrophobicContact CB-CD1 4.04Å; V200-L235 HydrophobicContact CG1-CB 4.36Å; V200-L235 HydrophobicContact CG1-CD1 4.21Å; V200-L235 HydrophobicContact CG1-CD2 4.43Å; V200-L235 HydrophobicContact CG2-CD1 3.51Å; V200-V237 HydrophobicContact CG1-CG2 4.05Å
201	D	97.5	Very high	98.2	Very high	46 Å²	46	43 Å²	43	25%	0.246	22%	0.218	C	C	.	.			trans	-133.4	-179.7	172.8	68.4	16.9	0	0	0	111	N156 K179 R203 T204	N156-D201 PolarHBondContact ND2-OD1 3.39Å; N156-D201 PolarHBondContact ND2-OD2 3.47Å; K179-D201 IonicContact NZ-OD1 2.65Å; K179-D201 PolarHBondContact NZ-OD1 3.4Å; K179-D201 IonicContact NZ-OD2 3.25Å; K179-D201 PolarHBondContact NZ-OD2 2.9Å; D201-R203 PolarHBondContact O-N 2.76Å; D201-R203 WeakPolarHBondContact OD1-CA 3.21Å; D201-R203 WeakPolarHBondContact OD1-CB 3.37Å; D201-R203 PolarHBondContact OD1-N 3.39Å; D201-R203 IonicContact OD2-NH2 3.96Å; D201-T204 PolarHBondContact N-OG1 2.74Å; D201-T204 WeakPolarHBondContact O-CB 3.05Å; D201-T204 PolarHBondContact O-N 3.14Å; D201-T204 VanDerWaalsContact O-N 3.08Å; D201-T204 PolarHBondContact O-OG1 3.47Å; D201-T204 PolarHBondContact OD1-N 3.15Å; D201-T204 VanDerWaalsContact OD1-N 3.15Å; D201-T204 PolarHBondContact OD1-OG1 3.07Å
202	E	96.8	Very high	98.2	Very high	179 Å²	179	42.8 Å²	42.8	84%	0.836	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.7	-179.5	67.8	-84.5	180	0	0	114.9
203	R	98	Very high	98.2	Very high	106 Å²	106	40.8 Å²	40.8	40%	0.4	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	1.4	178.2	-58.7	-175.2	-63.3	151.4	5.4	112.4	G154 N156 E177 D201 S205	G154-R203 PolarHBondContact O-NH1 2.9Å; G154-R203 VanDerWaalsContact O-NH1 3.1Å; N156-R203 PolarHBondContact N-O 3.38Å; N156-R203 VanDerWaalsContact ND2-C 3.26Å; N156-R203 WeakPolarHBondContact ND2-CB 3.5Å; N156-R203 PolarHBondContact ND2-O 3.43Å; E177-R203 IonicContact OE2-NH2 3.29Å; E177-R203 PolarHBondContact OE2-NH2 2.77Å; D201-R203 PolarHBondContact O-N 2.76Å; D201-R203 WeakPolarHBondContact OD1-CA 3.21Å; D201-R203 WeakPolarHBondContact OD1-CB 3.37Å; D201-R203 PolarHBondContact OD1-N 3.39Å; D201-R203 IonicContact OD2-NH2 3.96Å; R203-S205 PolarHBondContact O-N 2.95Å
204	T	98.7	Very high	98.2	Very high	15 Å²	15	39.6 Å²	39.6	9%	0.092	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	106.5	178	-61.8	0	0	0	0	110.1	N156 L158 V200 D201 V237	N156-T204 PolarHBondContact ND2-N 3.03Å; N156-T204 CarbonylContact O-C 3.5Å; N156-T204 WeakPolarHBondContact O-CA 3.41Å; N156-T204 WeakPolarHBondContact OD1-CA 3.43Å; N156-T204 PolarHBondContact OD1-OG1 3.1Å; L158-T204 HydrophobicContact CD1-CG2 4.08Å; L158-T204 HydrophobicContact CD2-CG2 4.23Å; L158-T204 HydrophobicContact CG-CG2 3.84Å; V200-T204 HydrophobicContact CG1-CG2 4.21Å; D201-T204 PolarHBondContact N-OG1 2.74Å; D201-T204 WeakPolarHBondContact O-CB 3.05Å; D201-T204 PolarHBondContact O-N 3.14Å; D201-T204 VanDerWaalsContact O-N 3.08Å; D201-T204 PolarHBondContact O-OG1 3.47Å; D201-T204 PolarHBondContact OD1-N 3.15Å; D201-T204 VanDerWaalsContact OD1-N 3.15Å; D201-T204 PolarHBondContact OD1-OG1 3.07Å; T204-V237 HydrophobicContact CG2-CG1 4.12Å; T204-V237 HydrophobicContact CG2-CG2 4.18Å
205	S	98.6	Very high	98.3	Very high	23 Å²	23	31.9 Å²	31.9	16%	0.161	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-28.6	-174.4	-64.5	0	0	0	0	113.7	L150 D155 N156 R203 P238	L150-S205 WeakPolarHBondContact O-CB 3.45Å; D155-S205 WeakPolarHBondContact CB-OG 3.35Å; D155-S205 VanDerWaalsContact CG-OG 3.28Å; D155-S205 PolarHBondContact OD2-OG 3.31Å; N156-S205 PolarHBondContact O-N 3.27Å; R203-S205 PolarHBondContact O-N 2.95Å; S205-P238 WeakPolarHBondContact O-CD 3.37Å; S205-P238 WeakPolarHBondContact O-CG 3.33Å
206	C	98.5	Very high	98.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	157.6	172.3	73.1	0	0	0	0	114	L150 I157 L158 P238	L150-C206 HydrophobicContact CD1-CB 3.87Å; I157-C206 WeakPolarHBondContact CA-O 3.21Å; I157-C206 WeakPolarHBondContact CG2-SG 3.5Å; L158-C206 PolarHBondContact N-O 2.84Å; C206-P238 WeakPolarHBondContact CA-O 3.47Å; C206-P238 HydrophobicContact CB-CG 4.3Å
207	L	98.9	Very high	98.3	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.7	167.8	167	56.9	0	0	0	109.4	L158 Y181 L196 V209 I228 V237 P238 I239 L240	L158-L207 HydrophobicContact CB-CD1 3.83Å; L158-L207 HydrophobicContact CD1-CD1 4.33Å; Y181-L207 HydrophobicContact CD1-CD1 4.14Å; Y181-L207 HydrophobicContact CE1-CD1 3.53Å; L196-L207 HydrophobicContact CD1-CD1 3.69Å; L196-L207 HydrophobicContact CD1-CD2 4.48Å; L196-L207 HydrophobicContact CD2-CD2 4.03Å; L207-V209 HydrophobicContact CD1-CG2 4.38Å; L207-V209 HydrophobicContact CD2-CG2 4.16Å; L207-V209 HydrophobicContact CG-CG2 3.92Å; L207-I228 HydrophobicContact CD2-CG2 4.13Å; L207-V237 HydrophobicContact CB-CG1 4.16Å; L207-P238 PolarHBondContact N-O 2.84Å; L207-I239 HydrophobicContact CB-CG1 4.37Å; L207-I239 HydrophobicContact CD2-CG1 4.26Å; L207-I239 HydrophobicContact CG-CG1 4.46Å; L207-I239 WeakPolarHBondContact O-CA 3.25Å; L207-L240 PolarHBondContact O-N 2.8Å
208	I	98.9	Very high	98.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.4	170.4	-57.9	-168.1	0	0	0	109.6	I147 I157 L158 V159 Y167 Y181 L240	I147-I208 HydrophobicContact CD1-CD1 4.22Å; I157-I208 HydrophobicContact CD1-CD1 3.8Å; L158-I208 WeakPolarHBondContact O-CB 3.33Å; L158-I208 PolarHBondContact O-N 2.83Å; V159-I208 HydrophobicContact CG2-CD1 4.18Å; Y167-I208 HydrophobicContact CD1-CD1 3.88Å; Y167-I208 HydrophobicContact CD1-CG2 4.07Å; Y167-I208 HydrophobicContact CD2-CG2 4.16Å; Y167-I208 HydrophobicContact CE1-CG2 3.98Å; Y167-I208 HydrophobicContact CE2-CG2 4.03Å; Y167-I208 HydrophobicContact CG-CD1 3.94Å; Y167-I208 HydrophobicContact CG-CG2 4.18Å; Y181-I208 WeakPolarHBondContact CE1-O 3.45Å; Y181-I208 PolarHBondContact OH-O 2.7Å; I208-L240 WeakPolarHBondContact CA-O 3.35Å; I208-L240 HydrophobicContact CD1-CD2 3.96Å; I208-L240 HydrophobicContact CG1-CB 4.25Å; I208-L240 HydrophobicContact CG1-CD2 4.08Å; I208-L240 HydrophobicContact CG1-CG 4.37Å
209	V	98.9	Very high	98.4	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.012	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.5	171.6	-178.2	0	0	0	0	108.3	L207 F220 I228 I239 L240 A241 D242 L258	L207-V209 HydrophobicContact CD1-CG2 4.38Å; L207-V209 HydrophobicContact CD2-CG2 4.16Å; L207-V209 HydrophobicContact CG-CG2 3.92Å; V209-F220 HydrophobicContact CG1-CD2 4.43Å; V209-F220 HydrophobicContact CG1-CE2 4.08Å; V209-I228 HydrophobicContact CG2-CG2 4.05Å; V209-I239 HydrophobicContact CB-CG2 4.25Å; V209-I239 HydrophobicContact CG2-CG2 3.87Å; V209-L240 PolarHBondContact N-O 3.13Å; V209-A241 CarbonylContact O-C 3.54Å; V209-A241 WeakPolarHBondContact O-CA 3.43Å; V209-D242 PolarHBondContact O-N 3.33Å; V209-L258 HydrophobicContact CB-CD1 4.12Å; V209-L258 HydrophobicContact CG1-CD1 3.91Å; V209-L258 HydrophobicContact CG2-CD1 4.13Å
210	T	98.4	Very high	98.4	Very high	6 Å²	6	22.1 Å²	22.1	4%	0.037	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	111.8	175	-51	0	0	0	0	109	Y167 D242	Y167-T210 WeakPolarHBondContact CE2-OG1 3.14Å; Y167-T210 WeakPolarHBondContact OH-CG2 3.3Å; Y167-T210 PolarHBondContact OH-OG1 2.97Å; T210-D242 WeakPolarHBondContact CA-O 3.47Å; T210-D242 HydrophobicContact CG2-CB 4.19Å
211	N	98.5	Very high	98.3	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.021	12%	0.115	C	C	.	.	S	Bend	trans	-148.3	119.9	-177.7	-175.6	52.8	0	0	0	110.4	V219 F220 D242 S255	N211-V219 WeakPolarHBondContact OD1-CA 3.23Å; N211-F220 HydrophobicContact CB-CD2 3.88Å; N211-F220 HydrophobicContact CB-CE2 4.3Å; N211-F220 PolarHBondContact OD1-N 3.46Å; N211-D242 PolarHBondContact N-O 2.99Å; N211-D242 VanDerWaalsContact N-O 3.15Å; N211-S255 PolarHBondContact ND2-OG 3.39Å
212	P	98.6	Very high	98.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	S	Bend	cis	-63.3	153.8	-6.7	-25	37	0	0	0	114.7	S218 V219 Y245 V249 A366	P212-S218 CarbonylContact C-O 3.4Å; P212-S218 VanDerWaalsContact CA-O 3.27Å; P212-S218 WeakPolarHBondContact CA-O 3.4Å; P212-V219 HydrophobicContact CB-CG2 3.97Å; P212-V219 HydrophobicContact CG-CG2 3.97Å; P212-Y245 VanDerWaalsContact CD-C 3.45Å; P212-Y245 WeakPolarHBondContact CD-O 3.46Å; P212-Y245 WeakPolarHBondContact CG-O 3.47Å; P212-V249 HydrophobicContact CG-CG1 3.95Å; P212-A366 HydrophobicContact CB-CB 4.12Å
213	S	98.7	Very high	98.3	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.021	12%	0.119	C	C	.	.			trans	-86.4	138.9	-167.9	178.4	0	0	0	0	115.1	C216 G217 S218 A366	S213-C216 WeakPolarHBondContact OG-CB 3.05Å; S213-C216 PolarHBondContact OG-N 3.04Å; S213-C216 PolarHBondContact OG-SG 3.29Å; S213-G217 WeakPolarHBondContact O-CA 3.42Å; S213-G217 PolarHBondContact O-N 3.3Å; S213-S218 VanDerWaalsContact CB-OG 3.23Å; S213-S218 WeakPolarHBondContact CB-OG 3.35Å; S213-S218 PolarHBondContact N-O 3.32Å; S213-A366 WeakPolarHBondContact O-CB 3.14Å
214	N	98.4	Very high	98.3	Very high	9 Å²	9	19 Å²	19	5%	0.048	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	117.6	153.7	172.2	20.2	0	0	0	107.3	F164 Y245 Y368 R412	F164-N214 WeakPolarHBondContact CD2-ND2 3.18Å; F164-N214 PolarHBondContact N-O 2.95Å; N214-Y245 HydrophobicContact CB-CE2 3.95Å; N214-Y368 HydrophobicContact CB-CD2 3.64Å; N214-Y368 HydrophobicContact CB-CE2 3.5Å; N214-Y368 WeakPolarHBondContact OD1-CD2 3.27Å; N214-Y368 WeakPolarHBondContact OD1-CE2 3.38Å; N214-R412 PolarHBondContact OD1-NH1 3.3Å
215	P	98.4	Very high	98.3	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99.3	-3.9	22.9	38.7	-39	0	0	0	116.7	P162 G217 Y368 M370 F405 R412	P162-P215 HydrophobicContact CB-CG 3.73Å; P162-P215 HydrophobicContact CG-CG 4.25Å; P215-G217 PolarHBondContact O-N 2.76Å; P215-Y368 WeakPolarHBondContact O-CB 3.41Å; P215-M370 HydrophobicContact CB-CG 4.23Å; P215-M370 HydrophobicContact CB-SD 3.7Å; P215-M370 HydrophobicContact CG-CE 4.28Å; P215-M370 HydrophobicContact CG-CG 4.26Å; P215-M370 HydrophobicContact CG-SD 3.76Å; P215-M370 WeakPolarHBondContact O-CG 3.29Å; P215-F405 HydrophobicContact CB-CD1 4.47Å; P215-F405 HydrophobicContact CB-CD2 3.9Å; P215-F405 HydrophobicContact CB-CE1 4.38Å; P215-F405 HydrophobicContact CB-CE2 3.83Å; P215-F405 HydrophobicContact CB-CG 4.25Å; P215-F405 HydrophobicContact CB-CZ 4.07Å; P215-F405 HydrophobicContact CG-CB 4.19Å; P215-F405 HydrophobicContact CG-CD1 4.26Å; P215-F405 HydrophobicContact CG-CD2 3.83Å; P215-F405 HydrophobicContact CG-CE2 4.28Å; P215-F405 HydrophobicContact CG-CG 3.83Å; P215-R412 HydrophobicContact CB-CB 4.32Å; P215-R412 HydrophobicContact CB-CG 3.8Å
216	C	98.8	Very high	98.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-25.4	-163.6	-48.8	0	0	0	0	115.3	W189 S213 S218	W189-C216 HydrophobicContact CB-CB 3.95Å; W189-C216 HydrophobicContact CD2-CB 4.11Å; W189-C216 HydrophobicContact CG-CB 3.61Å; S213-C216 WeakPolarHBondContact OG-CB 3.05Å; S213-C216 PolarHBondContact OG-N 3.04Å; S213-C216 PolarHBondContact OG-SG 3.29Å; C216-S218 PolarHBondContact O-N 3.44Å
217	G	98.6	Very high	98.3	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.			trans	66.7	10.3	-168.8	0	0	0	0	0	114.2	S213 P215 P363 S364 G365 Y368	S213-G217 WeakPolarHBondContact O-CA 3.42Å; S213-G217 PolarHBondContact O-N 3.3Å; P215-G217 PolarHBondContact O-N 2.76Å; G217-P363 WeakPolarHBondContact O-CA 3.48Å; G217-P363 WeakPolarHBondContact O-CB 3.47Å; G217-S364 PolarHBondContact O-N 2.89Å; G217-G365 WeakPolarHBondContact CA-O 3.41Å; G217-G365 PolarHBondContact O-N 3.18Å; G217-Y368 WeakPolarHBondContact CA-O 3.45Å
218	S	98.6	Very high	98.3	Very high	5 Å²	5	23.4 Å²	23.4	4%	0.035	12%	0.12	C	C	.	.			trans	-70	151.2	177	54.8	0	0	0	0	112	S188 P212 S213 C216	S188-S218 WeakPolarHBondContact O-CB 3.24Å; P212-S218 CarbonylContact C-O 3.4Å; P212-S218 VanDerWaalsContact CA-O 3.27Å; P212-S218 WeakPolarHBondContact CA-O 3.4Å; S213-S218 VanDerWaalsContact CB-OG 3.23Å; S213-S218 WeakPolarHBondContact CB-OG 3.35Å; S213-S218 PolarHBondContact N-O 3.32Å; C216-S218 PolarHBondContact O-N 3.44Å
219	V	98.6	Very high	98.3	Very high	23 Å²	23	23.7 Å²	23.7	14%	0.139	12%	0.122	C	C	.	.			trans	-128.1	116.1	171.7	-179.3	0	0	0	0	107.1	N211 P212 V249 N254 S364	N211-V219 WeakPolarHBondContact OD1-CA 3.23Å; P212-V219 HydrophobicContact CB-CG2 3.97Å; P212-V219 HydrophobicContact CG-CG2 3.97Å; V219-V249 HydrophobicContact CG1-CG1 3.97Å; V219-V249 HydrophobicContact CG2-CB 4.42Å; V219-V249 HydrophobicContact CG2-CG1 3.77Å; V219-N254 WeakPolarHBondContact CG1-O 3.15Å; V219-S364 VanDerWaalsContact CG2-C 3.44Å; V219-S364 WeakPolarHBondContact CG2-O 3.11Å
220	F	98.1	Very high	98.2	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.018	15%	0.146	C	C	.	.			trans	-69.8	137.5	-179.7	-62.9	-31.8	0	0	0	111.6	L183 W189 I191 V209 N211 H224 L225 I228	L183-F220 HydrophobicContact CD2-CZ 4.41Å; W189-F220 VanDerWaalsContact O-CE1 3.31Å; W189-F220 WeakPolarHBondContact O-CE1 3.35Å; I191-F220 HydrophobicContact CD1-CE2 4.01Å; I191-F220 HydrophobicContact CD1-CZ 4.21Å; I191-F220 HydrophobicContact CG1-CE1 4.45Å; I191-F220 HydrophobicContact CG1-CE2 3.98Å; I191-F220 HydrophobicContact CG1-CZ 3.69Å; V209-F220 HydrophobicContact CG1-CD2 4.43Å; V209-F220 HydrophobicContact CG1-CE2 4.08Å; N211-F220 HydrophobicContact CB-CD2 3.88Å; N211-F220 HydrophobicContact CB-CE2 4.3Å; N211-F220 PolarHBondContact OD1-N 3.46Å; F220-H224 AromaticContact CD1-CD2 3.73Å; F220-H224 AromaticContact CG-CD2 3.73Å; F220-L225 HydrophobicContact CB-CD2 3.86Å; F220-L225 HydrophobicContact CB-CG 3.85Å; F220-L225 HydrophobicContact CD2-CD2 3.95Å; F220-L225 HydrophobicContact CG-CD2 4.42Å; F220-I228 HydrophobicContact CD2-CD1 3.99Å; F220-I228 HydrophobicContact CE2-CD1 4.18Å
221	S	96.8	Very high	98.2	Very high	47 Å²	47	27.8 Å²	27.8	33%	0.329	15%	0.147	S	C	.	.			trans	-62.6	154.2	170.9	70.3	0	0	0	0	110.4	E223 H224 L225	S221-E223 PolarHBondContact O-N 3.44Å; S221-H224 PolarHBondContact O-N 2.85Å; S221-H224 VanDerWaalsContact O-N 3.17Å; S221-H224 VanDerWaalsContact OG-CB 3.31Å; S221-H224 WeakPolarHBondContact OG-CB 3.41Å; S221-H224 PolarHBondContact OG-N 3.42Å; S221-L225 WeakPolarHBondContact O-CG 3.45Å; S221-L225 PolarHBondContact O-N 2.9Å
222	Q	96.5	Very high	98.2	Very high	103 Å²	103	27.8 Å²	27.8	48%	0.481	15%	0.147	S	C	.	.	H	α-helix	trans	-56.2	-39.4	173.7	178.9	175.3	-13.5	0	0	111.9	L225 Q226 P256 L261	Q222-L225 PolarHBondContact O-N 3.04Å; Q222-Q226 PolarHBondContact O-N 3.26Å; Q222-P256 HydrophobicContact CB-CG 4.47Å; Q222-L261 HydrophobicContact CG-CD1 3.89Å; Q222-L261 HydrophobicContact CG-CD2 3.91Å
223	E	97.2	Very high	98.2	Very high	145 Å²	145	29.7 Å²	29.7	68%	0.678	16%	0.16	S	C	*	.	H	α-helix	trans	-60.6	-48.1	176.3	-177.6	177.6	177.4	0	0	111.2	S221 L225 Q226 N227	S221-E223 PolarHBondContact O-N 3.44Å; E223-L225 PolarHBondContact O-N 2.84Å; E223-Q226 WeakPolarHBondContact O-CB 3.38Å; E223-Q226 PolarHBondContact O-N 3.44Å; E223-Q226 VanDerWaalsContact O-N 3.14Å; E223-N227 VanDerWaalsContact O-CG 3.31Å; E223-N227 PolarHBondContact O-N 2.72Å; E223-N227 PolarHBondContact O-ND2 3.33Å
224	H	98.1	Very high	98.1	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.028	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-41	178.5	-169.6	59.9	0	0	0	112.4	E190 I191 F220 S221 Q226 N227 I228	E190-H224 HydrophobicContact CG-CB 4.46Å; E190-H224 IonicContact OE1-CG 2.91Å; I191-H224 PolarHBondContact N-NE2 3.44Å; I191-H224 PolarHBondContact O-CE1 3.47Å; F220-H224 AromaticContact CD1-CD2 3.73Å; F220-H224 AromaticContact CG-CD2 3.73Å; S221-H224 PolarHBondContact O-N 2.85Å; S221-H224 VanDerWaalsContact O-N 3.17Å; S221-H224 VanDerWaalsContact OG-CB 3.31Å; S221-H224 WeakPolarHBondContact OG-CB 3.41Å; S221-H224 PolarHBondContact OG-N 3.42Å; H224-Q226 VanDerWaalsContact C-N 3.29Å; H224-Q226 PolarHBondContact O-N 3.22Å; H224-N227 WeakPolarHBondContact O-CB 3.49Å; H224-N227 PolarHBondContact O-N 2.9Å; H224-N227 VanDerWaalsContact O-N 3.15Å; H224-I228 VanDerWaalsContact O-CG1 3.32Å; H224-I228 WeakPolarHBondContact O-CG1 2.84Å; H224-I228 PolarHBondContact O-N 3.19Å
225	L	98.4	Very high	97.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-39.2	172.9	-68.8	171	0	0	0	112.2	F220 S221 Q222 E223 I228 L229 P256 L258 L261	F220-L225 HydrophobicContact CB-CD2 3.86Å; F220-L225 HydrophobicContact CB-CG 3.85Å; F220-L225 HydrophobicContact CD2-CD2 3.95Å; F220-L225 HydrophobicContact CG-CD2 4.42Å; S221-L225 WeakPolarHBondContact O-CG 3.45Å; S221-L225 PolarHBondContact O-N 2.9Å; Q222-L225 PolarHBondContact O-N 3.04Å; E223-L225 PolarHBondContact O-N 2.84Å; L225-I228 HydrophobicContact CD2-CD1 4.38Å; L225-I228 PolarHBondContact O-N 3.16Å; L225-L229 WeakPolarHBondContact O-CG 3.06Å; L225-L229 PolarHBondContact O-N 3.34Å; L225-P256 HydrophobicContact CD1-CG 3.83Å; L225-L258 HydrophobicContact CD2-CD1 4.12Å; L225-L261 HydrophobicContact CB-CD1 3.64Å; L225-L261 HydrophobicContact CD1-CD1 3.91Å; L225-L261 HydrophobicContact CG-CD1 4.44Å
226	Q	98.2	Very high	97.9	Very high	68 Å²	68	43.9 Å²	43.9	32%	0.318	24%	0.237	S	C	.	.	H	α-helix	trans	-67.7	-36.1	175.9	-151.9	71.8	57.2	0	0	112	Q222 E223 H224 L229 T230 L261	Q222-Q226 PolarHBondContact O-N 3.26Å; E223-Q226 WeakPolarHBondContact O-CB 3.38Å; E223-Q226 PolarHBondContact O-N 3.44Å; E223-Q226 VanDerWaalsContact O-N 3.14Å; H224-Q226 VanDerWaalsContact C-N 3.29Å; H224-Q226 PolarHBondContact O-N 3.22Å; Q226-L229 PolarHBondContact O-N 2.79Å; Q226-T230 PolarHBondContact O-N 3.26Å; Q226-T230 PolarHBondContact O-OG1 2.96Å; Q226-L261 PolarHBondContact NE2-O 3.44Å
227	N	98.4	Very high	97.9	Very high	66 Å²	66	44.3 Å²	44.3	35%	0.353	24%	0.239	S	C	.	.	H	α-helix	trans	-66.7	-42.4	174.7	-66.3	-26.3	0	0	0	111.3	L193 E223 H224 L229 T230 V231	L193-N227 HydrophobicContact CD1-CB 3.52Å; E223-N227 VanDerWaalsContact O-CG 3.31Å; E223-N227 PolarHBondContact O-N 2.72Å; E223-N227 PolarHBondContact O-ND2 3.33Å; H224-N227 WeakPolarHBondContact O-CB 3.49Å; H224-N227 PolarHBondContact O-N 2.9Å; H224-N227 VanDerWaalsContact O-N 3.15Å; N227-L229 VanDerWaalsContact C-N 3.33Å; N227-L229 PolarHBondContact O-N 3.16Å; N227-T230 WeakPolarHBondContact O-CB 3.43Å; N227-T230 PolarHBondContact O-N 3.33Å; N227-T230 VanDerWaalsContact O-N 3.15Å; N227-V231 WeakPolarHBondContact O-CG2 3.46Å; N227-V231 PolarHBondContact O-N 2.92Å
228	I	98.6	Very high	97.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-46.5	173	-65.7	163.5	0	0	0	110.7	I191 L193 L207 V209 F220 H224 L225 T230 V231 A232 I239 L258	I191-I228 HydrophobicContact CD1-CD1 3.51Å; I191-I228 HydrophobicContact CD1-CG1 3.94Å; I191-I228 HydrophobicContact CG1-CD1 4.13Å; L193-I228 HydrophobicContact CD2-CG1 3.82Å; L207-I228 HydrophobicContact CD2-CG2 4.13Å; V209-I228 HydrophobicContact CG2-CG2 4.05Å; F220-I228 HydrophobicContact CD2-CD1 3.99Å; F220-I228 HydrophobicContact CE2-CD1 4.18Å; H224-I228 VanDerWaalsContact O-CG1 3.32Å; H224-I228 WeakPolarHBondContact O-CG1 2.84Å; H224-I228 PolarHBondContact O-N 3.19Å; L225-I228 HydrophobicContact CD2-CD1 4.38Å; L225-I228 PolarHBondContact O-N 3.16Å; I228-T230 VanDerWaalsContact C-N 3.3Å; I228-T230 PolarHBondContact O-N 3.17Å; I228-V231 PolarHBondContact O-N 3.22Å; I228-A232 WeakPolarHBondContact O-CB 3.49Å; I228-A232 PolarHBondContact O-N 3.24Å; I228-I239 HydrophobicContact CG2-CD1 4.34Å; I228-L258 HydrophobicContact CG2-CD1 4.5Å
229	L	98.6	Very high	97.9	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-37.9	176.6	-77	166.1	0	0	0	112.5	L225 Q226 N227 A232 S233 I239 L258 L261 V265	L225-L229 WeakPolarHBondContact O-CG 3.06Å; L225-L229 PolarHBondContact O-N 3.34Å; Q226-L229 PolarHBondContact O-N 2.79Å; N227-L229 VanDerWaalsContact C-N 3.33Å; N227-L229 PolarHBondContact O-N 3.16Å; L229-A232 PolarHBondContact O-N 2.79Å; L229-S233 WeakPolarHBondContact O-CB 3.4Å; L229-S233 PolarHBondContact O-N 2.81Å; L229-I239 HydrophobicContact CD2-CD1 4.04Å; L229-L258 HydrophobicContact CD2-CD2 3.65Å; L229-L258 HydrophobicContact CD2-CG 4.37Å; L229-L258 HydrophobicContact CG-CD2 4.21Å; L229-L258 HydrophobicContact CG-CG 4.4Å; L229-L261 VanDerWaalsContact CD1-C 3.49Å; L229-L261 HydrophobicContact CD1-CB 3.63Å; L229-V265 HydrophobicContact CD2-CB 3.93Å; L229-V265 HydrophobicContact CD2-CG1 4.44Å; L229-V265 HydrophobicContact CD2-CG2 4.15Å; L229-V265 WeakPolarHBondContact O-CG2 3.2Å
230	T	98.3	Very high	97.9	Very high	86 Å²	86	44.1 Å²	44.1	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-45	176.2	-60.1	0	0	0	0	110.9	Q226 N227 I228 S233 K234	Q226-T230 PolarHBondContact O-N 3.26Å; Q226-T230 PolarHBondContact O-OG1 2.96Å; N227-T230 WeakPolarHBondContact O-CB 3.43Å; N227-T230 PolarHBondContact O-N 3.33Å; N227-T230 VanDerWaalsContact O-N 3.15Å; I228-T230 VanDerWaalsContact C-N 3.3Å; I228-T230 PolarHBondContact O-N 3.17Å; T230-S233 PolarHBondContact O-N 3.17Å; T230-K234 WeakPolarHBondContact O-CB 3.49Å; T230-K234 PolarHBondContact O-N 3.08Å
231	V	97.9	Very high	97.9	Very high	8 Å²	8	44 Å²	44	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-50	174.9	171.6	0	0	0	0	111.2	L193 L196 E197 N227 I228 S233 K234 L235	L193-V231 HydrophobicContact CB-CG2 4.39Å; L193-V231 HydrophobicContact CD2-CG2 4.33Å; L196-V231 HydrophobicContact CD2-CG1 4.04Å; E197-V231 HydrophobicContact CG-CB 4.41Å; E197-V231 HydrophobicContact CG-CG1 3.5Å; E197-V231 HydrophobicContact CG-CG2 4.1Å; E197-V231 WeakPolarHBondContact OE1-CG2 3.28Å; N227-V231 WeakPolarHBondContact O-CG2 3.46Å; N227-V231 PolarHBondContact O-N 2.92Å; I228-V231 PolarHBondContact O-N 3.22Å; V231-S233 VanDerWaalsContact C-N 3.34Å; V231-S233 PolarHBondContact O-N 2.64Å; V231-K234 PolarHBondContact O-N 3.24Å; V231-L235 HydrophobicContact CG1-CD1 3.68Å; V231-L235 WeakPolarHBondContact O-CB 3.49Å; V231-L235 VanDerWaalsContact O-CG 3.31Å; V231-L235 WeakPolarHBondContact O-CG 2.99Å; V231-L235 PolarHBondContact O-N 3.1Å
232	A	98.3	Very high	98	Very high	3 Å²	3	42 Å²	42	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-38.9	-179.5	0	0	0	0	0	112.7	I228 L229 L235 C236 V237 I239 V265	I228-A232 WeakPolarHBondContact O-CB 3.49Å; I228-A232 PolarHBondContact O-N 3.24Å; L229-A232 PolarHBondContact O-N 2.79Å; A232-L235 PolarHBondContact O-N 2.97Å; A232-C236 PolarHBondContact O-N 3.4Å; A232-V237 PolarHBondContact O-N 3.08Å; A232-V237 VanDerWaalsContact O-N 3.08Å; A232-I239 HydrophobicContact CB-CD1 3.7Å; A232-I239 HydrophobicContact CB-CG1 3.99Å; A232-V265 HydrophobicContact CB-CG1 4.02Å; A232-V265 HydrophobicContact CB-CG2 4.17Å
233	S	97.9	Very high	98.1	Very high	40 Å²	40	38 Å²	38	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-49.4	174.4	-179.2	0	0	0	0	111.2	L229 T230 V231 L235 C236 E264	L229-S233 WeakPolarHBondContact O-CB 3.4Å; L229-S233 PolarHBondContact O-N 2.81Å; T230-S233 PolarHBondContact O-N 3.17Å; V231-S233 VanDerWaalsContact C-N 3.34Å; V231-S233 PolarHBondContact O-N 2.64Å; S233-L235 PolarHBondContact O-N 3.19Å; S233-L235 VanDerWaalsContact O-N 3.17Å; S233-C236 PolarHBondContact O-N 2.78Å; S233-E264 PolarHBondContact OG-OE2 2.9Å; S233-E264 VanDerWaalsContact OG-OE2 3.1Å
234	K	96.8	Very high	98.2	Very high	139 Å²	139	31.8 Å²	31.8	60%	0.604	18%	0.177	S	C	*	.	H	α-helix	trans	-54.2	-37.6	176.8	177.3	-173.7	172.2	-168.1	0	112.3	E197 T230 V231	E197-K234 IonicContact OE1-NZ 3.93Å; E197-K234 IonicContact OE2-NZ 2.68Å; E197-K234 PolarHBondContact OE2-NZ 2.92Å; T230-K234 WeakPolarHBondContact O-CB 3.49Å; T230-K234 PolarHBondContact O-N 3.08Å; V231-K234 PolarHBondContact O-N 3.24Å
235	L	95.8	Very high	98.2	Very high	54 Å²	54	31.7 Å²	31.7	28%	0.283	18%	0.176	S	C	.	.	H	α-helix	trans	-92.8	-5.1	-177.4	-61.7	173.3	0	0	0	113.7	E197 V200 V231 A232 S233 V237	E197-L235 HydrophobicContact CG-CD1 4.31Å; V200-L235 HydrophobicContact CB-CD1 4.04Å; V200-L235 HydrophobicContact CG1-CB 4.36Å; V200-L235 HydrophobicContact CG1-CD1 4.21Å; V200-L235 HydrophobicContact CG1-CD2 4.43Å; V200-L235 HydrophobicContact CG2-CD1 3.51Å; V231-L235 HydrophobicContact CG1-CD1 3.68Å; V231-L235 WeakPolarHBondContact O-CB 3.49Å; V231-L235 VanDerWaalsContact O-CG 3.31Å; V231-L235 WeakPolarHBondContact O-CG 2.99Å; V231-L235 PolarHBondContact O-N 3.1Å; A232-L235 PolarHBondContact O-N 2.97Å; S233-L235 PolarHBondContact O-N 3.19Å; S233-L235 VanDerWaalsContact O-N 3.17Å; L235-V237 HydrophobicContact CB-CG2 4.07Å; L235-V237 PolarHBondContact O-N 2.75Å
236	C	97.4	Very high	98	Very high	117 Å²	117	32.4 Å²	32.4	79%	0.791	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	35.8	-176.6	-62	0	0	0	0	113.5	A232 S233	A232-C236 PolarHBondContact O-N 3.4Å; S233-C236 PolarHBondContact O-N 2.78Å
237	V	98.3	Very high	97.8	Very high	9 Å²	9	32.3 Å²	32.3	6%	0.055	18%	0.183	C	C	.	.			trans	-105.3	127.9	-179.3	176.8	0	0	0	0	109.7	V200 T204 L207 A232 L235	V200-V237 HydrophobicContact CG1-CG2 4.05Å; T204-V237 HydrophobicContact CG2-CG1 4.12Å; T204-V237 HydrophobicContact CG2-CG2 4.18Å; L207-V237 HydrophobicContact CB-CG1 4.16Å; A232-V237 PolarHBondContact O-N 3.08Å; A232-V237 VanDerWaalsContact O-N 3.08Å; L235-V237 HydrophobicContact CB-CG2 4.07Å; L235-V237 PolarHBondContact O-N 2.75Å
238	P	98.7	Very high	97.8	Very high	23 Å²	23	29.3 Å²	29.3	15%	0.149	17%	0.167	C	C	.	.			trans	-71.5	156.7	176.2	31.9	-36.6	0	0	0	111.6	L150 S205 C206 L207 P266 F296	L150-P238 HydrophobicContact CD2-CG 4.4Å; S205-P238 WeakPolarHBondContact O-CD 3.37Å; S205-P238 WeakPolarHBondContact O-CG 3.33Å; C206-P238 WeakPolarHBondContact CA-O 3.47Å; C206-P238 HydrophobicContact CB-CG 4.3Å; L207-P238 PolarHBondContact N-O 2.84Å; P238-P266 HydrophobicContact CB-CG 4.03Å; P238-F296 HydrophobicContact CB-CE1 3.63Å; P238-F296 HydrophobicContact CB-CZ 3.95Å; P238-F296 HydrophobicContact CG-CE1 4.39Å
239	I	98.9	Very high	97.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.9	-179.7	-64	171.7	0	0	0	110.9	L207 V209 I228 L229 A232 A241 L258 V265 P266 V267 L268	L207-I239 HydrophobicContact CB-CG1 4.37Å; L207-I239 HydrophobicContact CD2-CG1 4.26Å; L207-I239 HydrophobicContact CG-CG1 4.46Å; L207-I239 WeakPolarHBondContact O-CA 3.25Å; V209-I239 HydrophobicContact CB-CG2 4.25Å; V209-I239 HydrophobicContact CG2-CG2 3.87Å; I228-I239 HydrophobicContact CG2-CD1 4.34Å; L229-I239 HydrophobicContact CD2-CD1 4.04Å; A232-I239 HydrophobicContact CB-CD1 3.7Å; A232-I239 HydrophobicContact CB-CG1 3.99Å; I239-A241 HydrophobicContact CG2-CB 4.26Å; I239-L258 HydrophobicContact CB-CD2 4.37Å; I239-L258 HydrophobicContact CD1-CD1 4.32Å; I239-L258 HydrophobicContact CD1-CD2 3.75Å; I239-L258 HydrophobicContact CG2-CD1 4.26Å; I239-L258 HydrophobicContact CG2-CD2 4.03Å; I239-V265 HydrophobicContact CD1-CG1 3.93Å; I239-V265 HydrophobicContact CG1-CG1 3.99Å; I239-P266 PolarHBondContact N-O 3.24Å; I239-P266 VanDerWaalsContact N-O 3.15Å; I239-V267 HydrophobicContact CB-CG1 4.42Å; I239-V267 HydrophobicContact CB-CG2 4.34Å; I239-V267 HydrophobicContact CG2-CG1 4.35Å; I239-V267 CarbonylContact O-C 3.6Å; I239-V267 WeakPolarHBondContact O-CA 3.3Å; I239-L268 PolarHBondContact O-N 2.84Å
240	L	98.9	Very high	97.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	106	160.9	170.8	55.4	0	0	0	108	I143 I147 L207 I208 V209 L268 C270	I143-L240 HydrophobicContact CG2-CD2 4.35Å; I147-L240 HydrophobicContact CG1-CD2 3.88Å; L207-L240 PolarHBondContact O-N 2.8Å; I208-L240 WeakPolarHBondContact CA-O 3.35Å; I208-L240 HydrophobicContact CD1-CD2 3.96Å; I208-L240 HydrophobicContact CG1-CB 4.25Å; I208-L240 HydrophobicContact CG1-CD2 4.08Å; I208-L240 HydrophobicContact CG1-CG 4.37Å; V209-L240 PolarHBondContact N-O 3.13Å; L240-L268 WeakPolarHBondContact CA-O 3.38Å; L240-L268 HydrophobicContact CD1-CB 4.26Å; L240-L268 WeakPolarHBondContact CD1-O 3.43Å; L240-C270 WeakPolarHBondContact CD1-SG 3.26Å
241	A	98.9	Very high	97.5	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.017	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	111.2	-179.3	0	0	0	0	0	110	V209 I239 E243 V267 L268 A269 C270	V209-A241 CarbonylContact O-C 3.54Å; V209-A241 WeakPolarHBondContact O-CA 3.43Å; I239-A241 HydrophobicContact CG2-CB 4.26Å; A241-E243 HydrophobicContact CB-CG 4.06Å; A241-E243 PolarHBondContact O-N 3.28Å; A241-V267 HydrophobicContact CB-CG1 3.87Å; A241-L268 PolarHBondContact N-O 2.84Å; A241-A269 HydrophobicContact CB-CB 4.38Å; A241-A269 CarbonylContact O-C 3.09Å; A241-A269 WeakPolarHBondContact O-CA 3.45Å; A241-C270 PolarHBondContact O-N 3.11Å
242	D	98.8	Very high	97.2	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.032	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	105.1	166.1	-172.3	-5.5	0	0	0	109	Y167 V209 T210 N211 I244	Y167-D242 HydrophobicContact CE1-CB 4.38Å; Y167-D242 WeakPolarHBondContact OH-CB 3.31Å; Y167-D242 PolarHBondContact OH-OD2 3.41Å; V209-D242 PolarHBondContact O-N 3.33Å; T210-D242 WeakPolarHBondContact CA-O 3.47Å; T210-D242 HydrophobicContact CG2-CB 4.19Å; N211-D242 PolarHBondContact N-O 2.99Å; N211-D242 VanDerWaalsContact N-O 3.15Å; D242-I244 VanDerWaalsContact OD1-CB 3.26Å; D242-I244 WeakPolarHBondContact OD1-CB 3.41Å; D242-I244 WeakPolarHBondContact OD1-CG2 3.43Å; D242-I244 PolarHBondContact OD1-N 3.27Å
243	E	98.6	Very high	96.8	Very high	18 Å²	18	37 Å²	37	8%	0.084	23%	0.234	C	C	.	.			trans	-113.4	27.1	-177.5	-65.1	-170.4	160.7	0	0	110.4	A241 Y245 S246 S257 L258 C270	A241-E243 HydrophobicContact CB-CG 4.06Å; A241-E243 PolarHBondContact O-N 3.28Å; E243-Y245 PolarHBondContact O-N 2.83Å; E243-Y245 VanDerWaalsContact O-N 3.11Å; E243-S246 WeakPolarHBondContact O-CB 3.42Å; E243-S246 PolarHBondContact O-N 3.19Å; E243-S257 VanDerWaalsContact OE1-CA 3.28Å; E243-S257 WeakPolarHBondContact OE1-CA 3.16Å; E243-S257 PolarHBondContact OE1-OG 3.45Å; E243-S257 WeakPolarHBondContact OE2-CB 3.38Å; E243-S257 PolarHBondContact OE2-OG 3.29Å; E243-L258 PolarHBondContact OE1-N 3.17Å; E243-C270 CarbonylContact C-O 3.57Å; E243-C270 PolarHBondContact N-O 2.97Å
244	I	98.7	Very high	96.3	Very high	14 Å²	14	39.5 Å²	39.5	7%	0.072	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.4	-179.6	-169	55.2	0	0	0	114	C139 D242 C270 A274 K275	C139-I244 HydrophobicContact CB-CB 4.46Å; C139-I244 HydrophobicContact CB-CD1 3.88Å; C139-I244 HydrophobicContact CB-CG1 4.18Å; D242-I244 VanDerWaalsContact OD1-CB 3.26Å; D242-I244 WeakPolarHBondContact OD1-CB 3.41Å; D242-I244 WeakPolarHBondContact OD1-CG2 3.43Å; D242-I244 PolarHBondContact OD1-N 3.27Å; I244-C270 PolarHBondContact N-O 3.32Å; I244-A274 HydrophobicContact CD1-CB 4.4Å; I244-K275 HydrophobicContact CG1-CB 4.37Å; I244-K275 HydrophobicContact CG1-CG 3.71Å
245	Y	98.6	Very high	96	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.016	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	8.4	174.8	-67.1	-73.7	0	0	0	113	P212 N214 E243 D247 M248 K275 A366 M367 Y368	P212-Y245 VanDerWaalsContact CD-C 3.45Å; P212-Y245 WeakPolarHBondContact CD-O 3.46Å; P212-Y245 WeakPolarHBondContact CG-O 3.47Å; N214-Y245 HydrophobicContact CB-CE2 3.95Å; E243-Y245 PolarHBondContact O-N 2.83Å; E243-Y245 VanDerWaalsContact O-N 3.11Å; Y245-D247 PolarHBondContact O-N 2.86Å; Y245-M248 HydrophobicContact CD1-SD 3.96Å; Y245-M248 WeakPolarHBondContact O-CA 3.36Å; Y245-M248 VanDerWaalsContact O-CB 3.23Å; Y245-M248 WeakPolarHBondContact O-CB 3.31Å; Y245-M248 PolarHBondContact O-N 2.81Å; Y245-K275 HydrophobicContact CD1-CB 3.99Å; Y245-K275 HydrophobicContact CD1-CG 4.21Å; Y245-K275 HydrophobicContact CE1-CB 3.74Å; Y245-K275 HydrophobicContact CE1-CD 3.83Å; Y245-K275 HydrophobicContact CE1-CG 3.61Å; Y245-K275 WeakPolarHBondContact OH-CD 3.37Å; Y245-K275 WeakPolarHBondContact OH-CE 3.34Å; Y245-K275 PolarHBondContact OH-NZ 3.13Å; Y245-A366 HydrophobicContact CD1-CB 3.73Å; Y245-A366 HydrophobicContact CD2-CB 4.06Å; Y245-A366 HydrophobicContact CE1-CB 4.2Å; Y245-A366 HydrophobicContact CG-CB 3.66Å; Y245-M367 HydrophobicContact CD1-CG 4.46Å; Y245-M367 HydrophobicContact CE1-CB 4.36Å; Y245-M367 HydrophobicContact CE1-CE 4.21Å; Y245-M367 HydrophobicContact CE1-CG 3.85Å; Y245-M367 HydrophobicContact CE1-SD 3.81Å; Y245-Y368 HydrophobicContact CE1-CE2 4.35Å; Y245-Y368 HydrophobicContact CE2-CE2 4.2Å; Y245-Y368 AromaticContact CZ-CE2 3.68Å; Y245-Y368 WeakPolarHBondContact OH-CE2 3.37Å; Y245-Y368 PolarHBondContact OH-OH 2.84Å
246	S	94.3	Very high	95.8	Very high	16 Å²	16	32.1 Å²	32.1	11%	0.112	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	141.6	177.4	-176	0	0	0	0	110.8	E243 M248	E243-S246 WeakPolarHBondContact O-CB 3.42Å; E243-S246 PolarHBondContact O-N 3.19Å; S246-M248 PolarHBondContact O-N 2.89Å; S246-M248 VanDerWaalsContact O-N 3.13Å
247	D	93.8	Very high	95.6	Very high	65 Å²	65	28 Å²	28	35%	0.348	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	9.8	-169.7	-55.6	-44.8	0	0	0	115.4	Y245 V249 R276	Y245-D247 PolarHBondContact O-N 2.86Å; D247-V249 VanDerWaalsContact C-N 3.35Å; D247-V249 PolarHBondContact O-N 2.99Å; D247-R276 VanDerWaalsContact CB-NH2 3.31Å; D247-R276 IonicContact OD2-CZ 3.26Å; D247-R276 IonicContact OD2-NH1 2.72Å; D247-R276 PolarHBondContact OD2-NH1 2.89Å; D247-R276 IonicContact OD2-NH2 3.79Å; D247-R276 PolarHBondContact OD2-NH2 3.48Å; D247-R276 VanDerWaalsContact OD2-NH2 3.13Å
248	M	98.1	Very high	95.5	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.015	18%	0.184	C	C	.	.			trans	-97.5	60.1	166.1	-55.7	-166.7	69.5	0	0	110.8	Y245 S246 K275 R276 T337 I338 L341 G365 A366 M367	Y245-M248 HydrophobicContact CD1-SD 3.96Å; Y245-M248 WeakPolarHBondContact O-CA 3.36Å; Y245-M248 VanDerWaalsContact O-CB 3.23Å; Y245-M248 WeakPolarHBondContact O-CB 3.31Å; Y245-M248 PolarHBondContact O-N 2.81Å; S246-M248 PolarHBondContact O-N 2.89Å; S246-M248 VanDerWaalsContact O-N 3.13Å; M248-K275 HydrophobicContact SD-CB 3.91Å; M248-R276 HydrophobicContact CG-CB 4Å; M248-R276 HydrophobicContact CG-CG 4.27Å; M248-R276 VanDerWaalsContact SD-CA 3.52Å; M248-R276 HydrophobicContact SD-CB 3.98Å; M248-R276 PolarHBondContact SD-N 3.22Å; M248-R276 VanDerWaalsContact SD-N 3.44Å; M248-T337 HydrophobicContact CE-CG2 4.14Å; M248-I338 VanDerWaalsContact CA-CD1 3.46Å; M248-I338 HydrophobicContact CB-CD1 3.9Å; M248-I338 HydrophobicContact CE-CD1 4.48Å; M248-L341 HydrophobicContact CE-CD1 3.69Å; M248-G365 CarbonylContact O-C 3.47Å; M248-G365 WeakPolarHBondContact O-CA 3.38Å; M248-A366 PolarHBondContact O-N 3.44Å; M248-M367 HydrophobicContact CE-CE 3.39Å; M248-M367 HydrophobicContact CE-CG 4.47Å; M248-M367 HydrophobicContact SD-CE 3.83Å
249	V	97.9	Very high	95.5	Very high	24 Å²	24	26.6 Å²	26.6	15%	0.145	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-115.7	148.8	-177.7	-60.1	0	0	0	0	111.1	P212 V219 D247 C253 I338 S364	P212-V249 HydrophobicContact CG-CG1 3.95Å; V219-V249 HydrophobicContact CG1-CG1 3.97Å; V219-V249 HydrophobicContact CG2-CB 4.42Å; V219-V249 HydrophobicContact CG2-CG1 3.77Å; D247-V249 VanDerWaalsContact C-N 3.35Å; D247-V249 PolarHBondContact O-N 2.99Å; V249-C253 HydrophobicContact CB-CB 4.37Å; V249-I338 VanDerWaalsContact O-CG2 3.28Å; V249-I338 WeakPolarHBondContact O-CG2 3.17Å; V249-S364 WeakPolarHBondContact CA-O 3.41Å
250	F	97.4	Very high	95.4	Very high	10 Å²	10	27.9 Å²	27.9	4%	0.044	19%	0.187	C	C	.	.			trans	-73	154	178	-59.7	-15.6	0	0	0	111.2	G252 C253 I338 L341 Q342 A345 P363 S364	F250-G252 PolarHBondContact O-N 3.24Å; F250-C253 WeakPolarHBondContact O-CB 3.45Å; F250-C253 PolarHBondContact O-N 3.35Å; F250-C253 VanDerWaalsContact O-N 3.09Å; F250-I338 HydrophobicContact CD1-CG2 4.26Å; F250-L341 HydrophobicContact CE1-CB 3.98Å; F250-Q342 HydrophobicContact CD1-CB 4.01Å; F250-Q342 HydrophobicContact CD2-CG 4.33Å; F250-Q342 HydrophobicContact CE1-CB 4.22Å; F250-Q342 HydrophobicContact CG-CB 4.19Å; F250-Q342 HydrophobicContact CG-CG 4.25Å; F250-A345 HydrophobicContact CE2-CB 3.57Å; F250-A345 HydrophobicContact CZ-CB 3.72Å; F250-P363 WeakPolarHBondContact CD2-O 3.26Å; F250-P363 HydrophobicContact CE2-CB 4.43Å; F250-P363 HydrophobicContact CE2-CG 4.08Å; F250-P363 VanDerWaalsContact CE2-O 3.22Å; F250-P363 WeakPolarHBondContact CE2-O 3.3Å; F250-P363 HydrophobicContact CZ-CG 4.42Å; F250-S364 PolarHBondContact N-O 3.12Å
251	P	94.2	Very high	95.3	Very high	90 Å²	90	29.1 Å²	29.1	58%	0.584	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	136.1	178.6	-26.5	35.7	0	0	0	112.6	C253	P251-C253 VanDerWaalsContact C-N 3.3Å
252	G	90.9	Very high	95.2	Very high	91 Å²	91	29.4 Å²	29.4	94%	0.938	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.2	-12.8	-177.6	0	0	0	0	0	114.6	F250	F250-G252 PolarHBondContact O-N 3.24Å
253	C	89.9	Confident	95	Very high	51 Å²	51	33.4 Å²	33.4	35%	0.345	22%	0.224	S	C	.	.			trans	-97.6	154.1	171.4	-58.5	0	0	0	0	110.7	V249 F250 P251	V249-C253 HydrophobicContact CB-CB 4.37Å; F250-C253 WeakPolarHBondContact O-CB 3.45Å; F250-C253 PolarHBondContact O-N 3.35Å; F250-C253 VanDerWaalsContact O-N 3.09Å; P251-C253 VanDerWaalsContact C-N 3.3Å
254	N	88.6	Confident	94.9	Very high	93 Å²	93	37.5 Å²	37.5	50%	0.497	24%	0.243	S	C	.	.			trans	-127.5	150	168.7	64.3	17.4	0	0	0	109.8	V219	V219-N254 WeakPolarHBondContact CG1-O 3.15Å
255	S	88.7	Confident	94.8	Very high	9 Å²	9	37.1 Å²	37.1	6%	0.063	24%	0.241	C	C	.	.			trans	-129.8	74.5	173.4	177.4	0	0	0	0	107.8	N211	N211-S255 PolarHBondContact ND2-OG 3.39Å
256	P	91.6	Very high	94.8	Very high	29 Å²	29	37.3 Å²	37.3	19%	0.188	24%	0.243	C	C	.	.			trans	-57.6	145.2	173.7	27.3	-33.7	0	0	0	109	Q222 L225 L258 L261	Q222-P256 HydrophobicContact CB-CG 4.47Å; L225-P256 HydrophobicContact CD1-CG 3.83Å; P256-L258 PolarHBondContact O-N 2.77Å; P256-L261 HydrophobicContact CB-CD1 4.38Å; P256-L261 HydrophobicContact CB-CG 4.49Å; P256-L261 HydrophobicContact CG-CD1 3.92Å
257	S	94.2	Very high	95.1	Very high	30 Å²	30	36.6 Å²	36.6	21%	0.21	24%	0.238	C	C	.	.			trans	-60.5	134.2	172.1	178.3	0	0	0	0	108.8	E243 A259 S260	E243-S257 VanDerWaalsContact OE1-CA 3.28Å; E243-S257 WeakPolarHBondContact OE1-CA 3.16Å; E243-S257 PolarHBondContact OE1-OG 3.45Å; E243-S257 WeakPolarHBondContact OE2-CB 3.38Å; E243-S257 PolarHBondContact OE2-OG 3.29Å; S257-A259 PolarHBondContact O-N 3.12Å; S257-A259 VanDerWaalsContact O-N 3.15Å; S257-S260 PolarHBondContact O-N 3.06Å; S257-S260 PolarHBondContact O-OG 2.84Å
258	L	96.9	Very high	95.3	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-56.1	-35.4	179.2	-174.3	149.5	0	0	0	110.5	V209 L225 I228 L229 I239 E243 P256 S260 L261 S262 V267	V209-L258 HydrophobicContact CB-CD1 4.12Å; V209-L258 HydrophobicContact CG1-CD1 3.91Å; V209-L258 HydrophobicContact CG2-CD1 4.13Å; L225-L258 HydrophobicContact CD2-CD1 4.12Å; I228-L258 HydrophobicContact CG2-CD1 4.5Å; L229-L258 HydrophobicContact CD2-CD2 3.65Å; L229-L258 HydrophobicContact CD2-CG 4.37Å; L229-L258 HydrophobicContact CG-CD2 4.21Å; L229-L258 HydrophobicContact CG-CG 4.4Å; I239-L258 HydrophobicContact CB-CD2 4.37Å; I239-L258 HydrophobicContact CD1-CD1 4.32Å; I239-L258 HydrophobicContact CD1-CD2 3.75Å; I239-L258 HydrophobicContact CG2-CD1 4.26Å; I239-L258 HydrophobicContact CG2-CD2 4.03Å; E243-L258 PolarHBondContact OE1-N 3.17Å; P256-L258 PolarHBondContact O-N 2.77Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.88Å; L258-L261 PolarHBondContact O-N 3Å; L258-S262 PolarHBondContact O-N 3.47Å; L258-V267 HydrophobicContact CD2-CG1 4.14Å; L258-V267 HydrophobicContact CD2-CG2 3.69Å
259	A	97.4	Very high	95.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-31	178.1	0	0	0	0	0	114.1	S257 L261 S262 V267 H290 R292	S257-A259 PolarHBondContact O-N 3.12Å; S257-A259 VanDerWaalsContact O-N 3.15Å; A259-L261 PolarHBondContact O-N 2.95Å; A259-S262 PolarHBondContact O-N 3.39Å; A259-V267 HydrophobicContact CB-CB 4.18Å; A259-V267 HydrophobicContact CB-CG1 4.36Å; A259-V267 HydrophobicContact CB-CG2 4.4Å; A259-H290 HydrophobicContact CB-CB 3.73Å; A259-H290 WeakPolarHBondContact CB-CD2 3.42Å; A259-R292 PolarHBondContact O-NH2 2.89Å
260	S	96.8	Very high	95.4	Very high	28 Å²	28	32.3 Å²	32.3	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-69	-20	176.4	65.5	0	0	0	0	113.7	E125 S257 L258	E125-S260 WeakPolarHBondContact CB-O 3.16Å; S257-S260 PolarHBondContact O-N 3.06Å; S257-S260 PolarHBondContact O-OG 2.84Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.88Å
261	L	97.6	Very high	95.5	Very high	26 Å²	26	32.1 Å²	32.1	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-95	-11.6	176.7	-59.8	177.8	0	0	0	112.4	Q222 L225 Q226 L229 P256 L258 A259	Q222-L261 HydrophobicContact CG-CD1 3.89Å; Q222-L261 HydrophobicContact CG-CD2 3.91Å; L225-L261 HydrophobicContact CB-CD1 3.64Å; L225-L261 HydrophobicContact CD1-CD1 3.91Å; L225-L261 HydrophobicContact CG-CD1 4.44Å; Q226-L261 PolarHBondContact NE2-O 3.44Å; L229-L261 VanDerWaalsContact CD1-C 3.49Å; L229-L261 HydrophobicContact CD1-CB 3.63Å; P256-L261 HydrophobicContact CB-CD1 4.38Å; P256-L261 HydrophobicContact CB-CG 4.49Å; P256-L261 HydrophobicContact CG-CD1 3.92Å; L258-L261 PolarHBondContact O-N 3Å; A259-L261 PolarHBondContact O-N 2.95Å
262	S	97.4	Very high	95.7	Very high	8 Å²	8	28 Å²	28	6%	0.056	19%	0.189	C	C	.	.			trans	-84.6	126.8	-178.3	-175.9	0	0	0	0	112	L258 A259 V265 R292	L258-S262 PolarHBondContact O-N 3.47Å; A259-S262 PolarHBondContact O-N 3.39Å; S262-V265 PolarHBondContact OG-N 2.8Å; S262-V265 VanDerWaalsContact OG-N 3.07Å; S262-V265 PolarHBondContact OG-O 3.18Å; S262-R292 PolarHBondContact O-NE 2.86Å; S262-R292 PolarHBondContact O-NH2 2.89Å
263	S	94.1	Very high	96	Very high	91 Å²	91	23.7 Å²	23.7	64%	0.636	15%	0.145	S	C	*	.	S	Bend	trans	-93.9	-33.6	168	52.1	0	0	0	0	113
264	E	95.3	Very high	96.5	Very high	103 Å²	103	21.9 Å²	21.9	48%	0.481	13%	0.133	S	C	.	.	S	Bend	trans	-127.6	-32.8	-168.4	-67.8	178.5	168.9	0	0	114.3	S233 P266 R292 I295	S233-E264 PolarHBondContact OG-OE2 2.9Å; S233-E264 VanDerWaalsContact OG-OE2 3.1Å; E264-P266 WeakPolarHBondContact O-CD 3.14Å; E264-R292 VanDerWaalsContact O-CB 3.27Å; E264-R292 WeakPolarHBondContact O-CB 3.46Å; E264-I295 WeakPolarHBondContact O-CD1 3.33Å
265	V	98.4	Very high	96.9	Very high	7 Å²	7	19 Å²	19	4%	0.042	12%	0.116	C	C	.	.	S	Bend	trans	-77.5	123.2	-175	-177.2	0	0	0	0	109.1	L229 A232 I239 S262 R292	L229-V265 HydrophobicContact CD2-CB 3.93Å; L229-V265 HydrophobicContact CD2-CG1 4.44Å; L229-V265 HydrophobicContact CD2-CG2 4.15Å; L229-V265 WeakPolarHBondContact O-CG2 3.2Å; A232-V265 HydrophobicContact CB-CG1 4.02Å; A232-V265 HydrophobicContact CB-CG2 4.17Å; I239-V265 HydrophobicContact CD1-CG1 3.93Å; I239-V265 HydrophobicContact CG1-CG1 3.99Å; S262-V265 PolarHBondContact OG-N 2.8Å; S262-V265 VanDerWaalsContact OG-N 3.07Å; S262-V265 PolarHBondContact OG-O 3.18Å; V265-R292 WeakPolarHBondContact O-CG 3.35Å
266	P	98.6	Very high	97.4	Very high	8 Å²	8	20 Å²	20	5%	0.052	12%	0.119	C	C	.	.			trans	-75.2	136.5	175.9	34.9	-37.5	0	0	0	110.1	P238 I239 E264 H290 I295 F296	P238-P266 HydrophobicContact CB-CG 4.03Å; I239-P266 PolarHBondContact N-O 3.24Å; I239-P266 VanDerWaalsContact N-O 3.15Å; E264-P266 WeakPolarHBondContact O-CD 3.14Å; P266-H290 WeakPolarHBondContact CA-O 3.26Å; P266-I295 HydrophobicContact CB-CB 4.29Å; P266-I295 HydrophobicContact CG-CB 3.96Å; P266-I295 HydrophobicContact CG-CD1 4.28Å; P266-I295 HydrophobicContact CG-CG2 3.79Å; P266-F296 HydrophobicContact CB-CD1 4.11Å; P266-F296 HydrophobicContact CB-CD2 3.83Å; P266-F296 HydrophobicContact CB-CE1 3.91Å; P266-F296 HydrophobicContact CB-CE2 3.62Å; P266-F296 HydrophobicContact CB-CG 4.08Å; P266-F296 HydrophobicContact CB-CZ 3.65Å; P266-F296 HydrophobicContact CG-CD1 4.31Å; P266-F296 HydrophobicContact CG-CE1 3.96Å; P266-F296 HydrophobicContact CG-CZ 4.06Å
267	V	98.9	Very high	97.7	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.3	-172.9	-173.4	0	0	0	0	110.7	I239 A241 L258 A259 A269 H290	I239-V267 HydrophobicContact CB-CG1 4.42Å; I239-V267 HydrophobicContact CB-CG2 4.34Å; I239-V267 HydrophobicContact CG2-CG1 4.35Å; I239-V267 CarbonylContact O-C 3.6Å; I239-V267 WeakPolarHBondContact O-CA 3.3Å; A241-V267 HydrophobicContact CB-CG1 3.87Å; L258-V267 HydrophobicContact CD2-CG1 4.14Å; L258-V267 HydrophobicContact CD2-CG2 3.69Å; A259-V267 HydrophobicContact CB-CB 4.18Å; A259-V267 HydrophobicContact CB-CG1 4.36Å; A259-V267 HydrophobicContact CB-CG2 4.4Å; V267-A269 HydrophobicContact CG1-CB 4.49Å; V267-H290 HydrophobicContact CB-CB 4.24Å; V267-H290 PolarHBondContact N-O 3.02Å; V267-H290 PolarHBondContact O-N 2.91Å
268	L	98.9	Very high	97.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	102.9	161.7	-63.4	-176.2	0	0	0	107.9	V149 L150 I239 L240 A241 I287 I289 F296 L304	V149-L268 HydrophobicContact CG1-CD1 4.26Å; L150-L268 HydrophobicContact CD1-CD1 4Å; L150-L268 HydrophobicContact CG-CD1 4.35Å; I239-L268 PolarHBondContact O-N 2.84Å; L240-L268 WeakPolarHBondContact CA-O 3.38Å; L240-L268 HydrophobicContact CD1-CB 4.26Å; L240-L268 WeakPolarHBondContact CD1-O 3.43Å; A241-L268 PolarHBondContact N-O 2.84Å; L268-I287 HydrophobicContact CB-CG2 4.29Å; L268-I287 HydrophobicContact CD2-CG2 4.13Å; L268-I289 HydrophobicContact CD2-CB 4.24Å; L268-I289 HydrophobicContact CD2-CG1 3.92Å; L268-I289 HydrophobicContact CD2-CG2 3.99Å; L268-F296 HydrophobicContact CD2-CD2 4.09Å; L268-F296 HydrophobicContact CD2-CE2 3.59Å; L268-F296 HydrophobicContact CD2-CZ 4.15Å; L268-F296 HydrophobicContact CG-CE2 3.75Å; L268-F296 HydrophobicContact CG-CZ 3.8Å; L268-L304 HydrophobicContact CD2-CD1 4.4Å
269	A	98.8	Very high	98	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.008	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	132.8	176.7	0	0	0	0	0	110.3	A241 V267 I287 L288	A241-A269 HydrophobicContact CB-CB 4.38Å; A241-A269 CarbonylContact O-C 3.09Å; A241-A269 WeakPolarHBondContact O-CA 3.45Å; V267-A269 HydrophobicContact CG1-CB 4.49Å; A269-I287 CarbonylContact O-C 3.58Å; A269-I287 WeakPolarHBondContact O-CA 3.23Å; A269-L288 HydrophobicContact CB-CB 4.22Å; A269-L288 HydrophobicContact CB-CD1 4.44Å; A269-L288 PolarHBondContact N-O 2.88Å; A269-L288 PolarHBondContact O-N 2.87Å
270	C	98.9	Very high	98.1	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.014	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.8	-176.4	-68.5	0	0	0	0	109.9	A142 I143 L240 A241 E243 I244 W286	A142-C270 HydrophobicContact CB-CB 4Å; I143-C270 HydrophobicContact CG1-CB 4.32Å; L240-C270 WeakPolarHBondContact CD1-SG 3.26Å; A241-C270 PolarHBondContact O-N 3.11Å; E243-C270 CarbonylContact C-O 3.57Å; E243-C270 PolarHBondContact N-O 2.97Å; I244-C270 PolarHBondContact N-O 3.32Å; C270-W286 WeakPolarHBondContact CA-O 3.39Å
271	G	98.7	Very high	98.2	Very high	5 Å²	5	20.3 Å²	20.3	5%	0.052	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	-172.2	-178.5	0	0	0	0	0	112.8	G285 W286	G271-G285 CarbonylContact O-C 3.55Å; G271-G285 WeakPolarHBondContact O-CA 3.39Å; G271-W286 PolarHBondContact N-O 3.4Å; G271-W286 VanDerWaalsContact N-O 3.07Å; G271-W286 PolarHBondContact O-N 2.91Å
272	G	98.6	Very high	98.2	Very high	5 Å²	5	22.4 Å²	22.4	5%	0.052	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.1	-179.5	178.7	0	0	0	0	0	115.6	A274 M284 W286	G272-A274 VanDerWaalsContact C-N 3.28Å; G272-A274 PolarHBondContact O-N 3.09Å; G272-M284 WeakPolarHBondContact CA-O 3.36Å; G272-W286 VanDerWaalsContact CA-CH2 3.48Å; G272-W286 VanDerWaalsContact CA-CZ2 3.45Å
273	L	98.8	Very high	98.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-78.7	-12	-178.7	-62.2	-179.5	0	0	0	113.6	K275 W277 V279 M284 W286 V318 L322 I325	L273-K275 VanDerWaalsContact C-N 3.29Å; L273-K275 PolarHBondContact O-N 3.35Å; L273-K275 VanDerWaalsContact O-N 3.14Å; L273-W277 HydrophobicContact CB-CB 4.32Å; L273-W277 HydrophobicContact CD2-CB 4.34Å; L273-W277 HydrophobicContact CD2-CD2 3.58Å; L273-W277 HydrophobicContact CD2-CE3 3.62Å; L273-W277 HydrophobicContact CD2-CG 3.92Å; L273-W277 HydrophobicContact CD2-CZ3 4.15Å; L273-W277 WeakPolarHBondContact O-CB 3.44Å; L273-W277 PolarHBondContact O-N 3.23Å; L273-V279 HydrophobicContact CB-CG2 3.74Å; L273-V279 WeakPolarHBondContact O-CG2 3.39Å; L273-M284 HydrophobicContact CD1-CB 3.97Å; L273-M284 HydrophobicContact CD1-CG 4.02Å; L273-M284 HydrophobicContact CG-CB 4.31Å; L273-M284 HydrophobicContact CG-CG 4.35Å; L273-M284 PolarHBondContact N-O 3.41Å; L273-W286 HydrophobicContact CD2-CH2 3.9Å; L273-W286 HydrophobicContact CD2-CZ3 4.19Å; L273-W286 HydrophobicContact CG-CH2 4.17Å; L273-W286 HydrophobicContact CG-CZ3 4.07Å; L273-V318 HydrophobicContact CD1-CG1 4.03Å; L273-L322 HydrophobicContact CD1-CD1 3.95Å; L273-L322 HydrophobicContact CD2-CD1 4.22Å; L273-L322 HydrophobicContact CG-CD1 4.28Å; L273-I325 HydrophobicContact CD1-CD1 4.04Å; L273-I325 HydrophobicContact CD1-CG2 4.29Å; L273-I325 HydrophobicContact CD2-CG2 3.73Å
274	A	98.6	Very high	98.5	Very high	12 Å²	12	22.1 Å²	22.1	10%	0.099	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-33.3	-163	0	0	0	0	0	114.8	I244 G272 P280	I244-A274 HydrophobicContact CD1-CB 4.4Å; G272-A274 VanDerWaalsContact C-N 3.28Å; G272-A274 PolarHBondContact O-N 3.09Å; A274-P280 HydrophobicContact CB-CB 4.18Å; A274-P280 WeakPolarHBondContact O-CD 3.4Å
275	K	98.5	Very high	98.7	Very high	32 Å²	32	17.2 Å²	17.2	14%	0.139	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-62.2	-171.3	-56	-62.1	-179.9	152.8	0	111	G74 I244 Y245 M248 L273 W277 L278 M367 Y368	G74-K275 PolarHBondContact O-NZ 3.49Å; I244-K275 HydrophobicContact CG1-CB 4.37Å; I244-K275 HydrophobicContact CG1-CG 3.71Å; Y245-K275 HydrophobicContact CD1-CB 3.99Å; Y245-K275 HydrophobicContact CD1-CG 4.21Å; Y245-K275 HydrophobicContact CE1-CB 3.74Å; Y245-K275 HydrophobicContact CE1-CD 3.83Å; Y245-K275 HydrophobicContact CE1-CG 3.61Å; Y245-K275 WeakPolarHBondContact OH-CD 3.37Å; Y245-K275 WeakPolarHBondContact OH-CE 3.34Å; Y245-K275 PolarHBondContact OH-NZ 3.13Å; M248-K275 HydrophobicContact SD-CB 3.91Å; L273-K275 VanDerWaalsContact C-N 3.29Å; L273-K275 PolarHBondContact O-N 3.35Å; L273-K275 VanDerWaalsContact O-N 3.14Å; K275-W277 VanDerWaalsContact C-N 3.26Å; K275-W277 PolarHBondContact O-N 3.3Å; K275-L278 WeakPolarHBondContact O-CD2 3.39Å; K275-L278 PolarHBondContact O-N 2.82Å; K275-M367 HydrophobicContact CB-CE 3.88Å; K275-M367 HydrophobicContact CD-CE 4.27Å; K275-M367 HydrophobicContact CD-SD 4.17Å; K275-Y368 PolarHBondContact NZ-OH 3.24Å
276	R	98.1	Very high	98.7	Very high	32 Å²	32	17 Å²	17	12%	0.121	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-28.4	-178.6	-176.9	177.5	178.8	-176.3	13.5	114.5	D247 M248 F333 Y334	D247-R276 VanDerWaalsContact CB-NH2 3.31Å; D247-R276 IonicContact OD2-CZ 3.26Å; D247-R276 IonicContact OD2-NH1 2.72Å; D247-R276 PolarHBondContact OD2-NH1 2.89Å; D247-R276 IonicContact OD2-NH2 3.79Å; D247-R276 PolarHBondContact OD2-NH2 3.48Å; D247-R276 VanDerWaalsContact OD2-NH2 3.13Å; M248-R276 HydrophobicContact CG-CB 4Å; M248-R276 HydrophobicContact CG-CG 4.27Å; M248-R276 VanDerWaalsContact SD-CA 3.52Å; M248-R276 HydrophobicContact SD-CB 3.98Å; M248-R276 PolarHBondContact SD-N 3.22Å; M248-R276 VanDerWaalsContact SD-N 3.44Å; R276-F333 WeakPolarHBondContact O-CE1 3.4Å; R276-Y334 HydrophobicContact CG-CD1 3.97Å; R276-Y334 HydrophobicContact CG-CE1 4.04Å
277	W	98.8	Very high	98.7	Very high	1 Å²	1	16.6 Å²	16.6	0%	0.004	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	7.5	174.6	-70.8	-96.4	0	0	0	113.5	T84 F120 L273 K275 V279 I325 L326 T329 Y334	T84-W277 WeakPolarHBondContact CB-O 3.42Å; T84-W277 PolarHBondContact OG1-O 2.64Å; T84-W277 VanDerWaalsContact OG1-O 3.11Å; F120-W277 HydrophobicContact CE1-CH2 4.11Å; F120-W277 HydrophobicContact CZ-CH2 4.09Å; F120-W277 HydrophobicContact CZ-CZ2 4.12Å; L273-W277 HydrophobicContact CB-CB 4.32Å; L273-W277 HydrophobicContact CD2-CB 4.34Å; L273-W277 HydrophobicContact CD2-CD2 3.58Å; L273-W277 HydrophobicContact CD2-CE3 3.62Å; L273-W277 HydrophobicContact CD2-CG 3.92Å; L273-W277 HydrophobicContact CD2-CZ3 4.15Å; L273-W277 WeakPolarHBondContact O-CB 3.44Å; L273-W277 PolarHBondContact O-N 3.23Å; K275-W277 VanDerWaalsContact C-N 3.26Å; K275-W277 PolarHBondContact O-N 3.3Å; W277-V279 VanDerWaalsContact C-N 3.27Å; W277-V279 HydrophobicContact CB-CG2 4.14Å; W277-V279 PolarHBondContact O-N 3.09Å; W277-I325 HydrophobicContact CG-CG2 4.18Å; W277-L326 HydrophobicContact CH2-CD2 3.76Å; W277-L326 HydrophobicContact CZ2-CD2 3.66Å; W277-T329 PolarHBondContact NE1-OG1 3.08Å; W277-Y334 HydrophobicContact CD2-CE1 4.48Å; W277-Y334 AromaticContact CE2-CE1 3.96Å; W277-Y334 HydrophobicContact CZ2-CE1 4.26Å; W277-Y334 WeakPolarHBondContact CZ2-OH 3.4Å; W277-Y334 AromaticContact NE1-CE1 3.87Å; W277-Y334 AromaticContact NE1-CZ 3.92Å; W277-Y334 PolarHBondContact NE1-OH 2.97Å; W277-Y334 VanDerWaalsContact NE1-OH 3.08Å
278	L	98.6	Very high	98.7	Very high	5 Å²	5	16.9 Å²	16.9	3%	0.026	10%	0.095	C	C	.	.	S	Bend	trans	55.7	36.2	172.9	-53	171.5	0	0	0	114.5	P76 T77 L82 K275 P280 F333 T337 M367	P76-L278 HydrophobicContact CB-CD2 3.81Å; P76-L278 HydrophobicContact CG-CD2 3.72Å; T77-L278 VanDerWaalsContact CG2-O 3.24Å; T77-L278 WeakPolarHBondContact CG2-O 3.49Å; L82-L278 HydrophobicContact CB-CD1 3.94Å; L82-L278 HydrophobicContact CB-CD2 4.38Å; K275-L278 WeakPolarHBondContact O-CD2 3.39Å; K275-L278 PolarHBondContact O-N 2.82Å; L278-P280 VanDerWaalsContact C-CD 3.44Å; L278-F333 HydrophobicContact CD1-CE2 3.79Å; L278-F333 HydrophobicContact CD1-CZ 3.76Å; L278-F333 HydrophobicContact CG-CZ 4.08Å; L278-T337 HydrophobicContact CD1-CG2 4.3Å; L278-T337 HydrophobicContact CD2-CG2 4.35Å; L278-M367 HydrophobicContact CD2-CE 4.15Å
279	V	98.7	Very high	98.7	Very high	8 Å²	8	17.1 Å²	17.1	5%	0.048	10%	0.096	C	C	.	.			trans	-128.8	53.8	179.6	-69.4	0	0	0	0	113.1	T84 L273 W277 G281 W282	T84-V279 HydrophobicContact CG2-CG1 3.91Å; L273-V279 HydrophobicContact CB-CG2 3.74Å; L273-V279 WeakPolarHBondContact O-CG2 3.39Å; W277-V279 VanDerWaalsContact C-N 3.27Å; W277-V279 HydrophobicContact CB-CG2 4.14Å; W277-V279 PolarHBondContact O-N 3.09Å; V279-G281 PolarHBondContact O-N 3.35Å; V279-G281 VanDerWaalsContact O-N 3.11Å; V279-W282 HydrophobicContact CB-CB 4.24Å; V279-W282 HydrophobicContact CB-CD2 3.55Å; V279-W282 HydrophobicContact CB-CE3 3.85Å; V279-W282 HydrophobicContact CB-CG 3.74Å; V279-W282 HydrophobicContact CB-CZ2 4.46Å; V279-W282 HydrophobicContact CB-CZ3 4.41Å; V279-W282 HydrophobicContact CG1-CD2 3.75Å; V279-W282 HydrophobicContact CG1-CE3 3.95Å; V279-W282 HydrophobicContact CG1-CG 4.36Å; V279-W282 HydrophobicContact CG1-CH2 3.92Å; V279-W282 HydrophobicContact CG1-CZ2 3.72Å; V279-W282 HydrophobicContact CG1-CZ3 4.03Å; V279-W282 HydrophobicContact CG2-CB 4.4Å; V279-W282 HydrophobicContact CG2-CD2 3.94Å; V279-W282 HydrophobicContact CG2-CE3 3.73Å; V279-W282 HydrophobicContact CG2-CG 4.26Å; V279-W282 HydrophobicContact CG2-CZ3 4.28Å; V279-W282 PolarHBondContact O-N 3.42Å
280	P	98.5	Very high	98.7	Very high	18 Å²	18	17.6 Å²	17.6	12%	0.117	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-60.3	-29	-173.6	25.9	-34.6	0	0	0	113.7	D75 T77 A274 L278 W282 R283	D75-P280 WeakPolarHBondContact OD1-CG 3.12Å; T77-P280 HydrophobicContact CG2-CG 4.35Å; A274-P280 HydrophobicContact CB-CB 4.18Å; A274-P280 WeakPolarHBondContact O-CD 3.4Å; L278-P280 VanDerWaalsContact C-CD 3.44Å; P280-W282 VanDerWaalsContact C-N 3.31Å; P280-W282 PolarHBondContact O-N 3.13Å; P280-R283 WeakPolarHBondContact O-CD 3.22Å; P280-R283 PolarHBondContact O-NH1 2.99Å; P280-R283 VanDerWaalsContact O-NH1 3.08Å
281	G	98.5	Very high	98.6	Very high	63 Å²	63	19 Å²	19	65%	0.649	11%	0.105	S	C	*	.	G	3₁₀ helix	trans	-72.4	-14.6	177.3	0	0	0	0	0	115.1	V279 R283	V279-G281 PolarHBondContact O-N 3.35Å; V279-G281 VanDerWaalsContact O-N 3.11Å; G281-R283 VanDerWaalsContact C-N 3.28Å; G281-R283 WeakPolarHBondContact O-CG 3.49Å; G281-R283 PolarHBondContact O-N 2.97Å
282	W	98.7	Very high	98.4	Very high	69 Å²	69	20.8 Å²	20.8	26%	0.261	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	-79.6	-12	-178.5	-68.6	9.2	0	0	0	113.7	V88 L89 M92 V279 P280 M284 V318 I325	V88-W282 HydrophobicContact CG1-CH2 3.6Å; V88-W282 HydrophobicContact CG1-CZ3 3.52Å; L89-W282 HydrophobicContact CD2-CH2 4.25Å; L89-W282 HydrophobicContact CD2-CZ2 4.06Å; M92-W282 HydrophobicContact CB-CH2 4.36Å; M92-W282 HydrophobicContact CG-CE3 4.12Å; M92-W282 HydrophobicContact CG-CH2 3.32Å; M92-W282 HydrophobicContact CG-CZ2 4.09Å; M92-W282 HydrophobicContact CG-CZ3 3.34Å; M92-W282 HydrophobicContact SD-CE3 4.18Å; M92-W282 HydrophobicContact SD-CH2 4.42Å; M92-W282 HydrophobicContact SD-CZ3 3.93Å; V279-W282 HydrophobicContact CB-CB 4.24Å; V279-W282 HydrophobicContact CB-CD2 3.55Å; V279-W282 HydrophobicContact CB-CE3 3.85Å; V279-W282 HydrophobicContact CB-CG 3.74Å; V279-W282 HydrophobicContact CB-CZ2 4.46Å; V279-W282 HydrophobicContact CB-CZ3 4.41Å; V279-W282 HydrophobicContact CG1-CD2 3.75Å; V279-W282 HydrophobicContact CG1-CE3 3.95Å; V279-W282 HydrophobicContact CG1-CG 4.36Å; V279-W282 HydrophobicContact CG1-CH2 3.92Å; V279-W282 HydrophobicContact CG1-CZ2 3.72Å; V279-W282 HydrophobicContact CG1-CZ3 4.03Å; V279-W282 HydrophobicContact CG2-CB 4.4Å; V279-W282 HydrophobicContact CG2-CD2 3.94Å; V279-W282 HydrophobicContact CG2-CE3 3.73Å; V279-W282 HydrophobicContact CG2-CG 4.26Å; V279-W282 HydrophobicContact CG2-CZ3 4.28Å; V279-W282 PolarHBondContact O-N 3.42Å; P280-W282 VanDerWaalsContact C-N 3.31Å; P280-W282 PolarHBondContact O-N 3.13Å; W282-M284 PolarHBondContact O-N 2.95Å; W282-V318 HydrophobicContact CB-CG2 4.33Å; W282-V318 HydrophobicContact CE3-CG1 4.33Å; W282-I325 HydrophobicContact CZ3-CD1 4.09Å
283	R	98.7	Very high	98.1	Very high	91 Å²	91	26.5 Å²	26.5	34%	0.343	14%	0.14	S	C	.	.			trans	53.3	51	173.1	-48.9	-47.4	-54.2	154.2	-2.2	112.9	S137 G138 S140 P280 G281	S137-R283 CarbonylContact C-O 3.29Å; S137-R283 VanDerWaalsContact CA-O 3.31Å; S137-R283 WeakPolarHBondContact CA-O 3.32Å; S137-R283 PolarHBondContact O-NH2 2.91Å; G138-R283 PolarHBondContact N-O 3.16Å; S140-R283 PolarHBondContact OG-NH2 3.36Å; P280-R283 WeakPolarHBondContact O-CD 3.22Å; P280-R283 PolarHBondContact O-NH1 2.99Å; P280-R283 VanDerWaalsContact O-NH1 3.08Å; G281-R283 VanDerWaalsContact C-N 3.28Å; G281-R283 WeakPolarHBondContact O-CG 3.49Å; G281-R283 PolarHBondContact O-N 2.97Å
284	M	98.9	Very high	97.9	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.015	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.3	173.3	-172.6	57.4	60	0	0	110.8	L135 G272 L273 W282 A314 C315 V318 Q319 L322	L135-M284 HydrophobicContact CB-SD 4.47Å; G272-M284 WeakPolarHBondContact CA-O 3.36Å; L273-M284 HydrophobicContact CD1-CB 3.97Å; L273-M284 HydrophobicContact CD1-CG 4.02Å; L273-M284 HydrophobicContact CG-CB 4.31Å; L273-M284 HydrophobicContact CG-CG 4.35Å; L273-M284 PolarHBondContact N-O 3.41Å; W282-M284 PolarHBondContact O-N 2.95Å; M284-A314 HydrophobicContact CE-CB 3.54Å; M284-A314 HydrophobicContact SD-CB 3.87Å; M284-C315 WeakPolarHBondContact CE-O 3.48Å; M284-V318 HydrophobicContact CB-CG1 3.62Å; M284-V318 HydrophobicContact CE-CB 3.6Å; M284-V318 HydrophobicContact CE-CG1 3.77Å; M284-V318 HydrophobicContact CG-CG1 3.87Å; M284-Q319 HydrophobicContact CE-CB 4.43Å; M284-Q319 HydrophobicContact CE-CG 3.53Å; M284-Q319 HydrophobicContact SD-CG 4.24Å; M284-L322 HydrophobicContact CG-CD1 4.35Å
285	G	98.8	Very high	97.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	-177	174.5	0	0	0	0	0	111.2	T136 G271	T136-G285 PolarHBondContact N-O 3.09Å; T136-G285 PolarHBondContact O-N 3.13Å; T136-G285 PolarHBondContact OG1-O 2.92Å; G271-G285 CarbonylContact O-C 3.55Å; G271-G285 WeakPolarHBondContact O-CA 3.39Å
286	W	98.9	Very high	97.8	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	157.5	179.4	44.7	78	0	0	0	112.4	V117 Y121 I133 I134 L135 T136 C270 G271 G272 L273 L288 L322 L326	V117-W286 HydrophobicContact CG1-CB 4.36Å; V117-W286 HydrophobicContact CG1-CD2 3.96Å; V117-W286 HydrophobicContact CG1-CG 3.85Å; V117-W286 HydrophobicContact CG2-CD2 4.27Å; V117-W286 HydrophobicContact CG2-CE3 4.01Å; V117-W286 HydrophobicContact CG2-CZ3 4.42Å; Y121-W286 AromaticContact CE2-CE2 3.71Å; Y121-W286 AromaticContact CE2-CZ2 3.58Å; Y121-W286 HydrophobicContact CE2-CZ2 3.58Å; Y121-W286 AromaticContact CE2-NE1 3.64Å; Y121-W286 AromaticContact CZ-CZ2 3.86Å; Y121-W286 WeakPolarHBondContact OH-CZ2 3.11Å; I133-W286 HydrophobicContact CG2-CB 4.34Å; I134-W286 CarbonylContact O-C 3.53Å; I134-W286 WeakPolarHBondContact O-CA 3.5Å; L135-W286 HydrophobicContact CD2-CB 4.12Å; T136-W286 PolarHBondContact OG1-N 3.25Å; C270-W286 WeakPolarHBondContact CA-O 3.39Å; G271-W286 PolarHBondContact N-O 3.4Å; G271-W286 VanDerWaalsContact N-O 3.07Å; G271-W286 PolarHBondContact O-N 2.91Å; G272-W286 VanDerWaalsContact CA-CH2 3.48Å; G272-W286 VanDerWaalsContact CA-CZ2 3.45Å; L273-W286 HydrophobicContact CD2-CH2 3.9Å; L273-W286 HydrophobicContact CD2-CZ3 4.19Å; L273-W286 HydrophobicContact CG-CH2 4.17Å; L273-W286 HydrophobicContact CG-CZ3 4.07Å; W286-L288 HydrophobicContact CG-CD2 4.28Å; W286-L322 HydrophobicContact CZ3-CD1 3.99Å; W286-L326 HydrophobicContact CH2-CD2 4.39Å
287	I	98.9	Very high	97.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	131.4	161.9	-54.5	168.2	0	0	0	107.2	I133 I134 T136 A142 L145 L268 A269 I289 L304	I133-I287 WeakPolarHBondContact CA-O 3.43Å; I134-I287 HydrophobicContact CB-CB 4.36Å; I134-I287 HydrophobicContact CB-CD1 4.48Å; I134-I287 PolarHBondContact N-O 2.84Å; I134-I287 VanDerWaalsContact N-O 3.1Å; I134-I287 PolarHBondContact O-N 3.31Å; T136-I287 HydrophobicContact CG2-CD1 4.38Å; T136-I287 HydrophobicContact CG2-CG1 4.23Å; A142-I287 HydrophobicContact CB-CD1 4.5Å; A142-I287 HydrophobicContact CB-CG1 3.64Å; L145-I287 HydrophobicContact CB-CD1 3.92Å; L145-I287 HydrophobicContact CD1-CD1 4.3Å; L268-I287 HydrophobicContact CB-CG2 4.29Å; L268-I287 HydrophobicContact CD2-CG2 4.13Å; A269-I287 CarbonylContact O-C 3.58Å; A269-I287 WeakPolarHBondContact O-CA 3.23Å; I287-I289 HydrophobicContact CG2-CG1 4.09Å; I287-L304 HydrophobicContact CD1-CD2 3.87Å
288	L	98.9	Very high	97.7	Very high	6 Å²	6	44.1 Å²	44.1	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.7	167.7	-42.7	178.1	0	0	0	107.7	V117 Y121 L128 I133 A269 W286	V117-L288 HydrophobicContact CG1-CD2 3.67Å; Y121-L288 HydrophobicContact CD1-CD1 4.32Å; Y121-L288 HydrophobicContact CD2-CD1 4.23Å; Y121-L288 HydrophobicContact CD2-CD2 4.41Å; Y121-L288 HydrophobicContact CG-CD1 3.87Å; L128-L288 HydrophobicContact CD1-CB 4.11Å; L128-L288 HydrophobicContact CD1-CD1 4.12Å; L128-L288 HydrophobicContact CD1-CD2 4.26Å; L128-L288 HydrophobicContact CD1-CG 4.4Å; L128-L288 HydrophobicContact CD2-CB 4.33Å; I133-L288 HydrophobicContact CD1-CD2 3.41Å; I133-L288 VanDerWaalsContact CD1-CD2 3.41Å; A269-L288 HydrophobicContact CB-CB 4.22Å; A269-L288 HydrophobicContact CB-CD1 4.44Å; A269-L288 PolarHBondContact N-O 2.88Å; A269-L288 PolarHBondContact O-N 2.87Å; W286-L288 HydrophobicContact CG-CD2 4.28Å
289	I	98.9	Very high	97.7	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	100	-175.4	-54.5	171.4	0	0	0	109	D132 I134 L268 I287 D291 F296 R301 L304	D132-I289 HydrophobicContact CB-CB 4.37Å; D132-I289 WeakPolarHBondContact O-CG1 3.38Å; D132-I289 PolarHBondContact O-N 3.44Å; I134-I289 HydrophobicContact CD1-CD1 4.27Å; L268-I289 HydrophobicContact CD2-CB 4.24Å; L268-I289 HydrophobicContact CD2-CG1 3.92Å; L268-I289 HydrophobicContact CD2-CG2 3.99Å; I287-I289 HydrophobicContact CG2-CG1 4.09Å; I289-D291 HydrophobicContact CG2-CB 4.32Å; I289-D291 PolarHBondContact O-N 2.89Å; I289-F296 HydrophobicContact CG2-CD2 4.09Å; I289-R301 HydrophobicContact CD1-CG 4.29Å; I289-L304 HydrophobicContact CD1-CD1 3.8Å; I289-L304 HydrophobicContact CG1-CD1 4.27Å
290	H	98.6	Very high	97.7	Very high	11 Å²	11	52.9 Å²	52.9	5%	0.051	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	83.1	174.9	-60.6	-84.1	0	0	0	109.8	A259 P266 V267 R292	A259-H290 HydrophobicContact CB-CB 3.73Å; A259-H290 WeakPolarHBondContact CB-CD2 3.42Å; P266-H290 WeakPolarHBondContact CA-O 3.26Å; V267-H290 HydrophobicContact CB-CB 4.24Å; V267-H290 PolarHBondContact N-O 3.02Å; V267-H290 PolarHBondContact O-N 2.91Å; H290-R292 PolarHBondContact O-N 3.44Å
291	D	97	Very high	97.7	Very high	32 Å²	32	54.7 Å²	54.7	17%	0.171	28%	0.276	C	S	.	.			trans	-88.5	102.6	-176.9	-169.7	10.6	0	0	0	111	I289 R294 I295 F296 G297	I289-D291 HydrophobicContact CG2-CB 4.32Å; I289-D291 PolarHBondContact O-N 2.89Å; D291-R294 WeakPolarHBondContact OD1-CA 3.28Å; D291-R294 WeakPolarHBondContact OD2-CA 3.29Å; D291-I295 PolarHBondContact OD1-N 3.27Å; D291-F296 HydrophobicContact CB-CB 4.37Å; D291-F296 HydrophobicContact CB-CD2 4.18Å; D291-F296 PolarHBondContact OD1-N 2.8Å; D291-G297 PolarHBondContact OD2-N 3.44Å
292	R	93.6	Very high	97.7	Very high	43 Å²	43	55.6 Å²	55.6	16%	0.162	26%	0.263	C	S	.	.	S	Bend	trans	-84.3	135.7	174.5	-59	-56.5	-178.4	-179.6	2.2	109.3	E125 A259 S262 E264 V265 H290 R294 I295	E125-R292 VanDerWaalsContact O-CZ 3.28Å; E125-R292 PolarHBondContact O-NH1 3.04Å; E125-R292 PolarHBondContact O-NH2 3.2Å; A259-R292 PolarHBondContact O-NH2 2.89Å; S262-R292 PolarHBondContact O-NE 2.86Å; S262-R292 PolarHBondContact O-NH2 2.89Å; E264-R292 VanDerWaalsContact O-CB 3.27Å; E264-R292 WeakPolarHBondContact O-CB 3.46Å; V265-R292 WeakPolarHBondContact O-CG 3.35Å; H290-R292 PolarHBondContact O-N 3.44Å; R292-R294 PolarHBondContact O-N 3.01Å; R292-I295 WeakPolarHBondContact O-CD1 3.35Å; R292-I295 WeakPolarHBondContact O-CG1 3.3Å; R292-I295 PolarHBondContact O-N 2.79Å; R292-I295 VanDerWaalsContact O-N 3.13Å
293	N	93.4	Very high	97.7	Very high	125 Å²	125	52.9 Å²	52.9	67%	0.668	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	20	177.8	-57.2	-42.7	0	0	0	115.4	I295	N293-I295 HydrophobicContact CB-CD1 4.31Å; N293-I295 HydrophobicContact CB-CG1 4.21Å; N293-I295 PolarHBondContact O-N 3Å
294	R	94.8	Very high	97.7	Very high	216 Å²	216	48.5 Å²	48.5	82%	0.815	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	31.9	-176.1	-54.3	-179.7	176.9	172	-0.8	113.4	D291 R292 G297	D291-R294 WeakPolarHBondContact OD1-CA 3.28Å; D291-R294 WeakPolarHBondContact OD2-CA 3.29Å; R292-R294 PolarHBondContact O-N 3.01Å; R294-G297 WeakPolarHBondContact O-CA 3.19Å; R294-G297 PolarHBondContact O-N 3.45Å
295	I	97.6	Very high	97.7	Very high	106 Å²	106	50.5 Å²	50.5	54%	0.544	25%	0.252	S	S	.	.	S	Bend	trans	-65.6	-42	179.9	-66.9	164.6	0	0	0	110.7	E264 P266 D291 R292 N293	E264-I295 WeakPolarHBondContact O-CD1 3.33Å; P266-I295 HydrophobicContact CB-CB 4.29Å; P266-I295 HydrophobicContact CG-CB 3.96Å; P266-I295 HydrophobicContact CG-CD1 4.28Å; P266-I295 HydrophobicContact CG-CG2 3.79Å; D291-I295 PolarHBondContact OD1-N 3.27Å; R292-I295 WeakPolarHBondContact O-CD1 3.35Å; R292-I295 WeakPolarHBondContact O-CG1 3.3Å; R292-I295 PolarHBondContact O-N 2.79Å; R292-I295 VanDerWaalsContact O-N 3.13Å; N293-I295 HydrophobicContact CB-CD1 4.31Å; N293-I295 HydrophobicContact CB-CG1 4.21Å; N293-I295 PolarHBondContact O-N 3Å
296	F	97.9	Very high	97.7	Very high	12 Å²	12	57.9 Å²	57.9	5%	0.053	28%	0.28	C	S	.	.	S	Bend	trans	-69.2	-40.5	170.6	-70.2	-33.3	0	0	0	111.4	L150 P238 P266 L268 I289 D291 I300	L150-F296 HydrophobicContact CD2-CE1 4.01Å; P238-F296 HydrophobicContact CB-CE1 3.63Å; P238-F296 HydrophobicContact CB-CZ 3.95Å; P238-F296 HydrophobicContact CG-CE1 4.39Å; P266-F296 HydrophobicContact CB-CD1 4.11Å; P266-F296 HydrophobicContact CB-CD2 3.83Å; P266-F296 HydrophobicContact CB-CE1 3.91Å; P266-F296 HydrophobicContact CB-CE2 3.62Å; P266-F296 HydrophobicContact CB-CG 4.08Å; P266-F296 HydrophobicContact CB-CZ 3.65Å; P266-F296 HydrophobicContact CG-CD1 4.31Å; P266-F296 HydrophobicContact CG-CE1 3.96Å; P266-F296 HydrophobicContact CG-CZ 4.06Å; L268-F296 HydrophobicContact CD2-CD2 4.09Å; L268-F296 HydrophobicContact CD2-CE2 3.59Å; L268-F296 HydrophobicContact CD2-CZ 4.15Å; L268-F296 HydrophobicContact CG-CE2 3.75Å; L268-F296 HydrophobicContact CG-CZ 3.8Å; I289-F296 HydrophobicContact CG2-CD2 4.09Å; D291-F296 HydrophobicContact CB-CB 4.37Å; D291-F296 HydrophobicContact CB-CD2 4.18Å; D291-F296 PolarHBondContact OD1-N 2.8Å; F296-I300 HydrophobicContact CB-CB 3.9Å; F296-I300 HydrophobicContact CB-CG1 4.11Å; F296-I300 HydrophobicContact CB-CG2 4.1Å; F296-I300 HydrophobicContact CD1-CG1 4.13Å; F296-I300 HydrophobicContact CD1-CG2 4.29Å; F296-I300 HydrophobicContact CG-CB 4.42Å; F296-I300 HydrophobicContact CG-CG1 4.46Å; F296-I300 HydrophobicContact CG-CG2 4.17Å; F296-I300 WeakPolarHBondContact O-CG1 3.2Å; F296-I300 PolarHBondContact O-N 2.87Å
297	G	96.5	Very high	97.7	Very high	19 Å²	19	59.4 Å²	59.4	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	60.7	-159.8	174.6	0	0	0	0	0	113.3	D291 R294 R301	D291-G297 PolarHBondContact OD2-N 3.44Å; R294-G297 WeakPolarHBondContact O-CA 3.19Å; R294-G297 PolarHBondContact O-N 3.45Å; G297-R301 WeakPolarHBondContact O-CD 3.27Å; G297-R301 WeakPolarHBondContact O-CG 3.44Å
298	S	97.2	Very high	97.6	Very high	94 Å²	94	59.4 Å²	59.4	66%	0.657	29%	0.288	S	S	*	.	H	α-helix	trans	-75	-25.8	-178	56.4	0	0	0	0	113.2	Q302	S298-Q302 WeakPolarHBondContact O-CB 3.45Å; S298-Q302 PolarHBondContact O-N 3.32Å
299	E	97.9	Very high	97.6	Very high	164 Å²	164	64.3 Å²	64.3	77%	0.766	31%	0.311	S	S	*	.	H	α-helix	trans	-70.1	-47.8	-174	-63.6	-164.8	143.8	0	0	112.1	Q302 G303	E299-Q302 PolarHBondContact O-N 3.19Å; E299-G303 PolarHBondContact O-N 3.08Å
300	I	98.6	Very high	97.6	Very high	32 Å²	32	71.7 Å²	71.7	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-45.7	175.9	-66	-62.3	0	0	0	110.6	V149 L150 F296 Q302 G303 L304	V149-I300 HydrophobicContact CG1-CG2 4.08Å; V149-I300 HydrophobicContact CG2-CD1 4.04Å; V149-I300 HydrophobicContact CG2-CG2 4.2Å; L150-I300 HydrophobicContact CD2-CD1 4.07Å; F296-I300 HydrophobicContact CB-CB 3.9Å; F296-I300 HydrophobicContact CB-CG1 4.11Å; F296-I300 HydrophobicContact CB-CG2 4.1Å; F296-I300 HydrophobicContact CD1-CG1 4.13Å; F296-I300 HydrophobicContact CD1-CG2 4.29Å; F296-I300 HydrophobicContact CG-CB 4.42Å; F296-I300 HydrophobicContact CG-CG1 4.46Å; F296-I300 HydrophobicContact CG-CG2 4.17Å; F296-I300 WeakPolarHBondContact O-CG1 3.2Å; F296-I300 PolarHBondContact O-N 2.87Å; I300-Q302 PolarHBondContact O-N 2.88Å; I300-G303 WeakPolarHBondContact O-CA 3.33Å; I300-G303 PolarHBondContact O-N 2.89Å; I300-G303 VanDerWaalsContact O-N 3.16Å; I300-L304 HydrophobicContact CG2-CD1 4.27Å; I300-L304 PolarHBondContact O-N 3.14Å
301	R	98.6	Very high	97.5	Very high	56 Å²	56	75.1 Å²	75.1	21%	0.211	36%	0.357	C	S	.	.	H	α-helix	trans	-57.7	-48.1	177.4	-70.4	175.3	178	-91.5	2.3	111.6	E131 D132 I289 G297 G303 L304 V305	E131-R301 PolarHBondContact O-NH1 2.81Å; D132-R301 IonicContact OD1-CZ 3.89Å; D132-R301 IonicContact OD1-NH1 2.71Å; D132-R301 PolarHBondContact OD1-NH1 2.9Å; D132-R301 IonicContact OD1-NH2 3.16Å; D132-R301 PolarHBondContact OD1-NH2 2.78Å; I289-R301 HydrophobicContact CD1-CG 4.29Å; G297-R301 WeakPolarHBondContact O-CD 3.27Å; G297-R301 WeakPolarHBondContact O-CG 3.44Å; R301-G303 VanDerWaalsContact C-N 3.33Å; R301-G303 PolarHBondContact O-N 3.06Å; R301-L304 PolarHBondContact O-N 3.16Å; R301-V305 VanDerWaalsContact O-CG2 3.31Å; R301-V305 WeakPolarHBondContact O-CG2 3.43Å; R301-V305 PolarHBondContact O-N 2.85Å
302	Q	98.5	Very high	97.4	Very high	82 Å²	82	78.7 Å²	78.7	38%	0.383	38%	0.375	S	S	.	.	H	α-helix	trans	-69.2	-32.8	178.7	-174.7	58.6	79.2	0	0	112.1	S298 E299 I300 V305 R306	S298-Q302 WeakPolarHBondContact O-CB 3.45Å; S298-Q302 PolarHBondContact O-N 3.32Å; E299-Q302 PolarHBondContact O-N 3.19Å; I300-Q302 PolarHBondContact O-N 2.88Å; Q302-V305 PolarHBondContact O-N 3.37Å; Q302-R306 VanDerWaalsContact CG-CZ 3.48Å; Q302-R306 VanDerWaalsContact O-CG 3.27Å; Q302-R306 WeakPolarHBondContact O-CG 3.33Å; Q302-R306 PolarHBondContact O-N 3.14Å
303	G	98.8	Very high	97.4	Very high	12 Å²	12	77.3 Å²	77.3	12%	0.124	37%	0.374	C	S	.	.	H	α-helix	trans	-59.1	-51	171.3	0	0	0	0	0	111.7	E299 I300 R301 V305 R306 L307	E299-G303 PolarHBondContact O-N 3.08Å; I300-G303 WeakPolarHBondContact O-CA 3.33Å; I300-G303 PolarHBondContact O-N 2.89Å; I300-G303 VanDerWaalsContact O-N 3.16Å; R301-G303 VanDerWaalsContact C-N 3.33Å; R301-G303 PolarHBondContact O-N 3.06Å; G303-V305 VanDerWaalsContact C-N 3.34Å; G303-V305 PolarHBondContact O-N 2.8Å; G303-R306 PolarHBondContact O-N 2.89Å; G303-L307 WeakPolarHBondContact O-CG 3.15Å; G303-L307 PolarHBondContact O-N 3.17Å
304	L	98.8	Very high	97.6	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.6	-41.8	175.8	-70.5	168.2	0	0	0	112.2	I134 L145 V149 L268 I287 I289 I300 R301 R306 L307 S308	I134-L304 HydrophobicContact CD1-CB 3.28Å; I134-L304 HydrophobicContact CD1-CD1 3.92Å; I134-L304 HydrophobicContact CD1-CG 4.13Å; L145-L304 HydrophobicContact CB-CD2 4.03Å; V149-L304 HydrophobicContact CB-CD2 3.91Å; V149-L304 HydrophobicContact CB-CG 4.13Å; V149-L304 HydrophobicContact CG1-CD1 4.49Å; V149-L304 HydrophobicContact CG1-CD2 3.59Å; V149-L304 HydrophobicContact CG1-CG 3.86Å; V149-L304 HydrophobicContact CG2-CD2 4.44Å; V149-L304 HydrophobicContact CG2-CG 4.12Å; L268-L304 HydrophobicContact CD2-CD1 4.4Å; I287-L304 HydrophobicContact CD1-CD2 3.87Å; I289-L304 HydrophobicContact CD1-CD1 3.8Å; I289-L304 HydrophobicContact CG1-CD1 4.27Å; I300-L304 HydrophobicContact CG2-CD1 4.27Å; I300-L304 PolarHBondContact O-N 3.14Å; R301-L304 PolarHBondContact O-N 3.16Å; L304-R306 PolarHBondContact O-N 3Å; L304-L307 PolarHBondContact O-N 3.41Å; L304-S308 WeakPolarHBondContact O-CB 3.45Å; L304-S308 PolarHBondContact O-N 2.93Å
305	V	98.8	Very high	97.8	Very high	45 Å²	45	64.6 Å²	64.6	27%	0.273	33%	0.327	S	S	.	.	H	α-helix	trans	-57.9	-50	173.6	172.2	0	0	0	0	110.6	V108 R301 Q302 G303 L307 S308 Q309	V108-V305 HydrophobicContact CG1-CB 4.4Å; V108-V305 HydrophobicContact CG1-CG1 4.45Å; V108-V305 HydrophobicContact CG1-CG2 3.96Å; R301-V305 VanDerWaalsContact O-CG2 3.31Å; R301-V305 WeakPolarHBondContact O-CG2 3.43Å; R301-V305 PolarHBondContact O-N 2.85Å; Q302-V305 PolarHBondContact O-N 3.37Å; G303-V305 VanDerWaalsContact C-N 3.34Å; G303-V305 PolarHBondContact O-N 2.8Å; V305-L307 VanDerWaalsContact C-N 3.35Å; V305-L307 PolarHBondContact O-N 2.89Å; V305-S308 PolarHBondContact O-N 3.03Å; V305-S308 PolarHBondContact O-OG 3.21Å; V305-Q309 WeakPolarHBondContact O-CG 3.44Å; V305-Q309 PolarHBondContact O-N 3.37Å
306	R	98.8	Very high	97.9	Very high	155 Å²	155	60.8 Å²	60.8	59%	0.585	31%	0.309	S	S	*	.	H	α-helix	trans	-60.2	-43.1	177.8	-71	167.9	-172.1	145	0.7	111.8	Q302 G303 L304 Q309	Q302-R306 VanDerWaalsContact CG-CZ 3.48Å; Q302-R306 VanDerWaalsContact O-CG 3.27Å; Q302-R306 WeakPolarHBondContact O-CG 3.33Å; Q302-R306 PolarHBondContact O-N 3.14Å; G303-R306 PolarHBondContact O-N 2.89Å; L304-R306 PolarHBondContact O-N 3Å; R306-Q309 WeakPolarHBondContact O-CB 3.21Å; R306-Q309 PolarHBondContact O-N 3.11Å
307	L	98.8	Very high	97.9	Very high	33 Å²	33	61.4 Å²	61.4	17%	0.173	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-39.4	179.8	-69.2	168.8	0	0	0	111.8	L145 V149 G303 L304 V305 Q309 R310	L145-L307 HydrophobicContact CD2-CB 3.52Å; V149-L307 HydrophobicContact CB-CD1 3.89Å; V149-L307 HydrophobicContact CG2-CD1 4.37Å; G303-L307 WeakPolarHBondContact O-CG 3.15Å; G303-L307 PolarHBondContact O-N 3.17Å; L304-L307 PolarHBondContact O-N 3.41Å; V305-L307 VanDerWaalsContact C-N 3.35Å; V305-L307 PolarHBondContact O-N 2.89Å; L307-Q309 PolarHBondContact O-N 3.04Å; L307-R310 VanDerWaalsContact O-CB 3.27Å; L307-R310 WeakPolarHBondContact O-CB 3.4Å; L307-R310 WeakPolarHBondContact O-CG 3.48Å; L307-R310 PolarHBondContact O-N 2.92Å
308	S	98.6	Very high	98	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-30.1	175.8	75.7	0	0	0	0	113.2	S107 L304 V305 R310 L312	S107-S308 WeakPolarHBondContact CB-OG 3.47Å; S107-S308 PolarHBondContact OG-OG 3.37Å; L304-S308 WeakPolarHBondContact O-CB 3.45Å; L304-S308 PolarHBondContact O-N 2.93Å; V305-S308 PolarHBondContact O-N 3.03Å; V305-S308 PolarHBondContact O-OG 3.21Å; S308-R310 PolarHBondContact O-N 3.22Å; S308-L312 PolarHBondContact O-N 2.63Å
309	Q	98.6	Very high	98.1	Very high	108 Å²	108	56.3 Å²	56.3	51%	0.505	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.9	179.7	-66.2	164.7	-3.7	0	0	112.5	S107 V305 R306 L307 I311	S107-Q309 VanDerWaalsContact OG-CG 3.28Å; S107-Q309 WeakPolarHBondContact OG-CG 3.28Å; V305-Q309 WeakPolarHBondContact O-CG 3.44Å; V305-Q309 PolarHBondContact O-N 3.37Å; R306-Q309 WeakPolarHBondContact O-CB 3.21Å; R306-Q309 PolarHBondContact O-N 3.11Å; L307-Q309 PolarHBondContact O-N 3.04Å; Q309-I311 PolarHBondContact O-N 3.3Å
310	R	97.5	Very high	98.1	Very high	159 Å²	159	48.9 Å²	48.9	60%	0.6	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-38.3	-179.4	-68.3	175.7	62.1	-174	-4.5	113.1	L307 S308	L307-R310 VanDerWaalsContact O-CB 3.27Å; L307-R310 WeakPolarHBondContact O-CB 3.4Å; L307-R310 WeakPolarHBondContact O-CG 3.48Å; L307-R310 PolarHBondContact O-N 2.92Å; S308-R310 PolarHBondContact O-N 3.22Å
311	I	96.6	Very high	98.2	Very high	84 Å²	84	47.4 Å²	47.4	43%	0.431	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	0.1	-179.9	75.6	159.1	0	0	0	113.6	Q141 Q309 G313	Q141-I311 HydrophobicContact CG-CD1 4.09Å; Q309-I311 PolarHBondContact O-N 3.3Å; I311-G313 VanDerWaalsContact C-N 3.34Å; I311-G313 PolarHBondContact O-N 3.47Å
312	L	96.1	Very high	98.2	Very high	107 Å²	107	44.8 Å²	44.8	56%	0.56	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	29.3	176.7	-58.6	80.6	0	0	0	114.8	S308	S308-L312 PolarHBondContact O-N 2.63Å
313	G	94.1	Very high	98.2	Very high	13 Å²	13	45.2 Å²	45.2	13%	0.134	23%	0.227	C	C	.	.			trans	79.9	-170.4	173.1	0	0	0	0	0	115.2	S107 I311	S107-G313 WeakPolarHBondContact O-CA 3.47Å; I311-G313 VanDerWaalsContact C-N 3.34Å; I311-G313 PolarHBondContact O-N 3.47Å
314	A	97.6	Very high	98.2	Very high	7 Å²	7	46.7 Å²	46.7	6%	0.058	24%	0.236	C	C	.	.	S	Bend	trans	-91	166	-176.7	0	0	0	0	0	113.2	T136 M284 T316 Q319	T136-A314 WeakPolarHBondContact O-CB 3.31Å; M284-A314 HydrophobicContact CE-CB 3.54Å; M284-A314 HydrophobicContact SD-CB 3.87Å; A314-T316 PolarHBondContact O-N 2.9Å; A314-T316 VanDerWaalsContact O-N 3.16Å; A314-Q319 PolarHBondContact O-NE2 3.1Å
315	C	98.6	Very high	98.2	Very high	67 Å²	67	46.7 Å²	46.7	45%	0.453	24%	0.236	S	C	.	.			trans	-51.5	119.2	179	178.6	0	0	0	0	112.4	M284 V317 V318 Q319	M284-C315 WeakPolarHBondContact CE-O 3.48Å; C315-V317 VanDerWaalsContact C-N 3.33Å; C315-V317 PolarHBondContact O-N 2.87Å; C315-V318 HydrophobicContact CB-CG2 4.12Å; C315-V318 PolarHBondContact O-N 3.44Å; C315-Q319 WeakPolarHBondContact O-CG 3.21Å; C315-Q319 PolarHBondContact O-N 3.14Å; C315-Q319 VanDerWaalsContact O-N 3.11Å
316	T	98.8	Very high	98.2	Very high	27 Å²	27	44.8 Å²	44.8	17%	0.166	22%	0.224	C	C	.	.	H	α-helix	trans	-67.3	-30.5	-172.8	49.9	0	0	0	0	113.4	F101 G103 A105 Y110 A314 Q319 G320	F101-T316 WeakPolarHBondContact O-CB 3.31Å; F101-T316 PolarHBondContact O-OG1 2.68Å; G103-T316 WeakPolarHBondContact O-CG2 3.17Å; A105-T316 HydrophobicContact CB-CG2 3.67Å; Y110-T316 HydrophobicContact CE2-CG2 4.05Å; A314-T316 PolarHBondContact O-N 2.9Å; A314-T316 VanDerWaalsContact O-N 3.16Å; T316-Q319 WeakPolarHBondContact O-CB 3.32Å; T316-Q319 PolarHBondContact O-N 3.44Å; T316-G320 PolarHBondContact O-N 3.31Å
317	V	98.8	Very high	98.1	Very high	25 Å²	25	41.9 Å²	41.9	15%	0.152	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-43.7	174.7	179.6	0	0	0	0	110.8	M92 A95 I96 C315 G320 A321	M92-V317 HydrophobicContact CE-CB 4.44Å; M92-V317 HydrophobicContact CE-CG1 3.68Å; A95-V317 HydrophobicContact CB-CG1 4.25Å; I96-V317 HydrophobicContact CD1-CG1 4.18Å; I96-V317 HydrophobicContact CG1-CG1 3.45Å; I96-V317 VanDerWaalsContact CG1-CG1 3.45Å; C315-V317 VanDerWaalsContact C-N 3.33Å; C315-V317 PolarHBondContact O-N 2.87Å; V317-G320 CarbonylContact O-C 3.56Å; V317-G320 VanDerWaalsContact O-CA 3.29Å; V317-G320 WeakPolarHBondContact O-CA 3.4Å; V317-G320 PolarHBondContact O-N 3.47Å; V317-A321 PolarHBondContact O-N 3.48Å
318	V	98.8	Very high	98.1	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-37.9	177.3	-173.4	0	0	0	0	110.7	M92 L273 W282 M284 C315 G320 A321 L322	M92-V318 HydrophobicContact CE-CB 4.47Å; M92-V318 HydrophobicContact CE-CG2 3.66Å; M92-V318 HydrophobicContact SD-CB 4.22Å; M92-V318 HydrophobicContact SD-CG1 4.35Å; M92-V318 HydrophobicContact SD-CG2 3.96Å; L273-V318 HydrophobicContact CD1-CG1 4.03Å; W282-V318 HydrophobicContact CB-CG2 4.33Å; W282-V318 HydrophobicContact CE3-CG1 4.33Å; M284-V318 HydrophobicContact CB-CG1 3.62Å; M284-V318 HydrophobicContact CE-CB 3.6Å; M284-V318 HydrophobicContact CE-CG1 3.77Å; M284-V318 HydrophobicContact CG-CG1 3.87Å; C315-V318 HydrophobicContact CB-CG2 4.12Å; C315-V318 PolarHBondContact O-N 3.44Å; V318-G320 PolarHBondContact O-N 3.47Å; V318-A321 PolarHBondContact O-N 3.29Å; V318-L322 PolarHBondContact O-N 3.46Å; V318-L322 VanDerWaalsContact O-N 3.1Å
319	Q	98.8	Very high	98.1	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-60	-36.6	169.9	-60.2	-174.1	40.2	0	0	111.3	Y110 S113 L135 M284 A314 C315 T316 A321 L322	Y110-Q319 HydrophobicContact CD2-CB 4.01Å; S113-Q319 PolarHBondContact OG-O 3.08Å; L135-Q319 HydrophobicContact CD1-CB 4.4Å; L135-Q319 HydrophobicContact CD1-CG 3.83Å; M284-Q319 HydrophobicContact CE-CB 4.43Å; M284-Q319 HydrophobicContact CE-CG 3.53Å; M284-Q319 HydrophobicContact SD-CG 4.24Å; A314-Q319 PolarHBondContact O-NE2 3.1Å; C315-Q319 WeakPolarHBondContact O-CG 3.21Å; C315-Q319 PolarHBondContact O-N 3.14Å; C315-Q319 VanDerWaalsContact O-N 3.11Å; T316-Q319 WeakPolarHBondContact O-CB 3.32Å; T316-Q319 PolarHBondContact O-N 3.44Å; Q319-A321 VanDerWaalsContact C-N 3.3Å; Q319-A321 PolarHBondContact O-N 2.97Å; Q319-L322 WeakPolarHBondContact O-CB 3.34Å; Q319-L322 PolarHBondContact O-N 3.5Å
320	G	98.8	Very high	98.1	Very high	8 Å²	8	43 Å²	43	8%	0.082	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-38	175.7	0	0	0	0	0	113.5	R112 T316 V317 V318	R112-G320 VanDerWaalsContact NH2-C 3.35Å; R112-G320 VanDerWaalsContact NH2-CA 3.26Å; R112-G320 PolarHBondContact NH2-O 2.86Å; T316-G320 PolarHBondContact O-N 3.31Å; V317-G320 CarbonylContact O-C 3.56Å; V317-G320 VanDerWaalsContact O-CA 3.29Å; V317-G320 WeakPolarHBondContact O-CA 3.4Å; V317-G320 PolarHBondContact O-N 3.47Å; V318-G320 PolarHBondContact O-N 3.47Å
321	A	98.8	Very high	98	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-86.1	-15	179.2	0	0	0	0	0	113.7	A91 M92 A95 V317 V318 Q319 E323 S324 I325	A91-A321 HydrophobicContact CB-CB 3.97Å; A91-A321 WeakPolarHBondContact O-CB 3.46Å; M92-A321 HydrophobicContact CG-CB 4.21Å; M92-A321 HydrophobicContact SD-CB 3.57Å; M92-A321 VanDerWaalsContact SD-CB 3.57Å; A95-A321 HydrophobicContact CB-CB 4.14Å; V317-A321 PolarHBondContact O-N 3.48Å; V318-A321 PolarHBondContact O-N 3.29Å; Q319-A321 VanDerWaalsContact C-N 3.3Å; Q319-A321 PolarHBondContact O-N 2.97Å; A321-E323 PolarHBondContact O-N 3.25Å; A321-S324 PolarHBondContact O-N 3.33Å; A321-S324 VanDerWaalsContact O-N 3.13Å; A321-I325 HydrophobicContact CB-CD1 3.69Å; A321-I325 HydrophobicContact CB-CG1 4.18Å; A321-I325 WeakPolarHBondContact O-CG1 3.47Å; A321-I325 PolarHBondContact O-N 2.81Å
322	L	98.7	Very high	98.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.4	-43	-162.3	-169.1	58.7	0	0	0	114.2	V117 L135 L273 M284 W286 V318 Q319 S324 I325 L326	V117-L322 HydrophobicContact CG2-CD2 3.56Å; V117-L322 HydrophobicContact CG2-CG 4.25Å; L135-L322 HydrophobicContact CD1-CD2 4.17Å; L135-L322 HydrophobicContact CD2-CD2 4.13Å; L273-L322 HydrophobicContact CD1-CD1 3.95Å; L273-L322 HydrophobicContact CD2-CD1 4.22Å; L273-L322 HydrophobicContact CG-CD1 4.28Å; M284-L322 HydrophobicContact CG-CD1 4.35Å; W286-L322 HydrophobicContact CZ3-CD1 3.99Å; V318-L322 PolarHBondContact O-N 3.46Å; V318-L322 VanDerWaalsContact O-N 3.1Å; Q319-L322 WeakPolarHBondContact O-CB 3.34Å; Q319-L322 PolarHBondContact O-N 3.5Å; L322-S324 PolarHBondContact O-N 2.68Å; L322-I325 PolarHBondContact O-N 3.13Å; L322-L326 HydrophobicContact CD1-CD1 4.25Å; L322-L326 HydrophobicContact CD1-CG 4.27Å; L322-L326 HydrophobicContact CG-CD1 4.05Å; L322-L326 HydrophobicContact CG-CG 4.47Å; L322-L326 WeakPolarHBondContact O-CB 3.45Å; L322-L326 VanDerWaalsContact O-CG 3.28Å; L322-L326 WeakPolarHBondContact O-CG 3.19Å; L322-L326 PolarHBondContact O-N 2.79Å
323	E	98.6	Very high	98.2	Very high	91 Å²	91	34 Å²	34	43%	0.425	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-46.4	178.5	-176.7	178.4	-170.2	0	0	112.1	A116 A321 L326 N327	A116-E323 HydrophobicContact CB-CB 3.82Å; A116-E323 HydrophobicContact CB-CG 4.08Å; A321-E323 PolarHBondContact O-N 3.25Å; E323-L326 PolarHBondContact O-N 3.2Å; E323-N327 WeakPolarHBondContact O-CB 3.17Å; E323-N327 PolarHBondContact O-N 3.41Å; E323-N327 PolarHBondContact O-ND2 2.97Å
324	S	98.8	Very high	98.4	Very high	44 Å²	44	35.1 Å²	35.1	31%	0.308	21%	0.214	S	C	.	.	H	α-helix	trans	-69.2	-38	177.8	-59.3	0	0	0	0	112	A321 L322 L326 N328	A321-S324 PolarHBondContact O-N 3.33Å; A321-S324 VanDerWaalsContact O-N 3.13Å; L322-S324 PolarHBondContact O-N 2.68Å; S324-L326 PolarHBondContact O-N 3.15Å; S324-N328 WeakPolarHBondContact O-CA 3.4Å; S324-N328 WeakPolarHBondContact O-CB 3.49Å; S324-N328 PolarHBondContact O-N 2.71Å
325	I	98.8	Very high	98.4	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-49.3	175	-69.2	171.1	0	0	0	110.3	V88 A91 L273 W277 W282 A321 L322 T329	V88-I325 HydrophobicContact CG1-CD1 4.22Å; V88-I325 HydrophobicContact CG1-CG1 4.14Å; V88-I325 HydrophobicContact CG1-CG2 4.39Å; V88-I325 HydrophobicContact CG2-CG2 4.33Å; A91-I325 HydrophobicContact CB-CG1 3.77Å; L273-I325 HydrophobicContact CD1-CD1 4.04Å; L273-I325 HydrophobicContact CD1-CG2 4.29Å; L273-I325 HydrophobicContact CD2-CG2 3.73Å; W277-I325 HydrophobicContact CG-CG2 4.18Å; W282-I325 HydrophobicContact CZ3-CD1 4.09Å; A321-I325 HydrophobicContact CB-CD1 3.69Å; A321-I325 HydrophobicContact CB-CG1 4.18Å; A321-I325 WeakPolarHBondContact O-CG1 3.47Å; A321-I325 PolarHBondContact O-N 2.81Å; L322-I325 PolarHBondContact O-N 3.13Å; I325-T329 WeakPolarHBondContact O-CB 3.41Å; I325-T329 PolarHBondContact O-N 3.41Å; I325-T329 PolarHBondContact O-OG1 3.03Å
326	L	98.6	Very high	98.4	Very high	5 Å²	5	38 Å²	38	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-43.6	-177.1	-68.1	174.6	0	0	0	112	A116 V117 F120 W277 W286 L322 E323 S324	A116-L326 HydrophobicContact CB-CD1 4.33Å; V117-L326 HydrophobicContact CG2-CD1 4Å; F120-L326 HydrophobicContact CB-CD1 4.2Å; F120-L326 HydrophobicContact CD1-CD2 4.28Å; F120-L326 HydrophobicContact CD2-CB 3.77Å; F120-L326 HydrophobicContact CD2-CD2 4.23Å; F120-L326 HydrophobicContact CD2-CG 4.44Å; F120-L326 HydrophobicContact CE1-CD2 4.43Å; F120-L326 HydrophobicContact CE2-CB 4.19Å; F120-L326 HydrophobicContact CE2-CD2 4.38Å; F120-L326 VanDerWaalsContact CE2-O 3.29Å; F120-L326 WeakPolarHBondContact CE2-O 3.38Å; F120-L326 HydrophobicContact CG-CB 4.3Å; F120-L326 HydrophobicContact CG-CD1 4.45Å; F120-L326 HydrophobicContact CG-CD2 4.17Å; F120-L326 HydrophobicContact CZ-CD2 4.47Å; W277-L326 HydrophobicContact CH2-CD2 3.76Å; W277-L326 HydrophobicContact CZ2-CD2 3.66Å; W286-L326 HydrophobicContact CH2-CD2 4.39Å; L322-L326 HydrophobicContact CD1-CD1 4.25Å; L322-L326 HydrophobicContact CD1-CG 4.27Å; L322-L326 HydrophobicContact CG-CD1 4.05Å; L322-L326 HydrophobicContact CG-CG 4.47Å; L322-L326 WeakPolarHBondContact O-CB 3.45Å; L322-L326 VanDerWaalsContact O-CG 3.28Å; L322-L326 WeakPolarHBondContact O-CG 3.19Å; L322-L326 PolarHBondContact O-N 2.79Å; E323-L326 PolarHBondContact O-N 3.2Å; S324-L326 PolarHBondContact O-N 3.15Å
327	N	97.6	Very high	98.4	Very high	94 Å²	94	37 Å²	37	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-89.6	-26	-170.7	-65.5	-21.3	0	0	0	114.4	E323	E323-N327 WeakPolarHBondContact O-CB 3.17Å; E323-N327 PolarHBondContact O-N 3.41Å; E323-N327 PolarHBondContact O-ND2 2.97Å
328	N	98.1	Very high	98.4	Very high	105 Å²	105	36.8 Å²	36.8	56%	0.561	23%	0.226	S	C	*	.	H	α-helix	trans	-111.6	-6.8	-169.5	-55.6	-19.1	0	0	0	114	S324 P330	S324-N328 WeakPolarHBondContact O-CA 3.4Å; S324-N328 WeakPolarHBondContact O-CB 3.49Å; S324-N328 PolarHBondContact O-N 2.71Å; N328-P330 WeakPolarHBondContact O-CD 3.15Å
329	T	98.6	Very high	98.3	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.049	25%	0.248	C	C	.	.	S	Bend	trans	-67.5	122.5	174	-60.4	0	0	0	0	109	D85 V88 W277 I325 F333 Y334	D85-T329 HydrophobicContact CB-CG2 4.22Å; V88-T329 HydrophobicContact CG2-CG2 4.14Å; V88-T329 VanDerWaalsContact CG2-OG1 3.23Å; V88-T329 WeakPolarHBondContact CG2-OG1 3.44Å; W277-T329 PolarHBondContact NE1-OG1 3.08Å; I325-T329 WeakPolarHBondContact O-CB 3.41Å; I325-T329 PolarHBondContact O-N 3.41Å; I325-T329 PolarHBondContact O-OG1 3.03Å; T329-F333 HydrophobicContact CG2-CB 4.32Å; T329-F333 HydrophobicContact CG2-CD1 3.47Å; T329-F333 VanDerWaalsContact CG2-CD1 3.47Å; T329-F333 HydrophobicContact CG2-CE1 4.1Å; T329-F333 HydrophobicContact CG2-CG 4.14Å; T329-Y334 VanDerWaalsContact CB-OH 3.22Å; T329-Y334 WeakPolarHBondContact CB-OH 3.49Å; T329-Y334 HydrophobicContact CG2-CE1 3.88Å; T329-Y334 HydrophobicContact CG2-CE2 4.11Å; T329-Y334 WeakPolarHBondContact CG2-OH 3.39Å
330	P	98.1	Very high	98.3	Very high	51 Å²	51	41.5 Å²	41.5	33%	0.331	26%	0.259	S	S	.	.			trans	-69.3	144.2	-170.4	26.6	-34.3	0	0	0	112	D85 N328 G332 F333	D85-P330 VanDerWaalsContact OD1-CD 3.29Å; D85-P330 WeakPolarHBondContact OD1-CD 3.35Å; N328-P330 WeakPolarHBondContact O-CD 3.15Å; P330-G332 PolarHBondContact O-N 3.25Å; P330-G332 VanDerWaalsContact O-N 3.1Å; P330-F333 HydrophobicContact CG-CB 4.22Å; P330-F333 WeakPolarHBondContact O-CB 3.39Å; P330-F333 PolarHBondContact O-N 3Å
331	P	97.4	Very high	98.3	Very high	105 Å²	105	41.1 Å²	41.1	68%	0.682	26%	0.256	S	S	*	.	H	α-helix	trans	-53.1	-33.9	175.2	-29	35.9	0	0	0	114.2	F333 Y334 S335	P331-F333 PolarHBondContact O-N 3.27Å; P331-Y334 PolarHBondContact O-N 3.26Å; P331-Y334 VanDerWaalsContact O-N 3.14Å; P331-S335 PolarHBondContact O-N 3.04Å; P331-S335 PolarHBondContact O-OG 3.3Å
332	G	98.2	Very high	98.3	Very high	45 Å²	45	43.3 Å²	43.3	46%	0.464	27%	0.265	S	S	.	.	H	α-helix	trans	-57	-33.7	178.2	0	0	0	0	0	114.3	P330 S335 S336	P330-G332 PolarHBondContact O-N 3.25Å; P330-G332 VanDerWaalsContact O-N 3.1Å; G332-S335 VanDerWaalsContact CA-OG 3.3Å; G332-S335 WeakPolarHBondContact CA-OG 3.35Å; G332-S335 PolarHBondContact O-OG 2.89Å; G332-S336 WeakPolarHBondContact O-CB 3.34Å; G332-S336 PolarHBondContact O-N 3.21Å; G332-S336 PolarHBondContact O-OG 3.4Å; G332-S336 VanDerWaalsContact O-OG 3.13Å
333	F	98.6	Very high	98.3	Very high	13 Å²	13	45 Å²	45	6%	0.057	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-43.8	176.4	162.8	-103.1	0	0	0	112	P83 D85 R276 L278 T329 P330 P331 S336 T337	P83-F333 WeakPolarHBondContact O-CE2 3.28Å; D85-F333 HydrophobicContact CB-CB 4.09Å; D85-F333 HydrophobicContact CB-CD1 4.27Å; D85-F333 HydrophobicContact CB-CD2 3.67Å; D85-F333 HydrophobicContact CB-CE2 4.13Å; D85-F333 HydrophobicContact CB-CG 3.74Å; R276-F333 WeakPolarHBondContact O-CE1 3.4Å; L278-F333 HydrophobicContact CD1-CE2 3.79Å; L278-F333 HydrophobicContact CD1-CZ 3.76Å; L278-F333 HydrophobicContact CG-CZ 4.08Å; T329-F333 HydrophobicContact CG2-CB 4.32Å; T329-F333 HydrophobicContact CG2-CD1 3.47Å; T329-F333 VanDerWaalsContact CG2-CD1 3.47Å; T329-F333 HydrophobicContact CG2-CE1 4.1Å; T329-F333 HydrophobicContact CG2-CG 4.14Å; P330-F333 HydrophobicContact CG-CB 4.22Å; P330-F333 WeakPolarHBondContact O-CB 3.39Å; P330-F333 PolarHBondContact O-N 3Å; P331-F333 PolarHBondContact O-N 3.27Å; F333-S336 PolarHBondContact O-OG 3.07Å; F333-T337 WeakPolarHBondContact O-CB 3.3Å; F333-T337 PolarHBondContact O-N 3.47Å; F333-T337 VanDerWaalsContact O-N 3.15Å; F333-T337 PolarHBondContact O-OG1 3.21Å
334	Y	98.1	Very high	98.3	Very high	36 Å²	36	40.7 Å²	40.7	14%	0.141	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-46.2	177.7	-50.4	-61.9	0	0	0	110.3	R276 W277 T329 P331 S336 T337 I338	R276-Y334 HydrophobicContact CG-CD1 3.97Å; R276-Y334 HydrophobicContact CG-CE1 4.04Å; W277-Y334 HydrophobicContact CD2-CE1 4.48Å; W277-Y334 AromaticContact CE2-CE1 3.96Å; W277-Y334 HydrophobicContact CZ2-CE1 4.26Å; W277-Y334 WeakPolarHBondContact CZ2-OH 3.4Å; W277-Y334 AromaticContact NE1-CE1 3.87Å; W277-Y334 AromaticContact NE1-CZ 3.92Å; W277-Y334 PolarHBondContact NE1-OH 2.97Å; W277-Y334 VanDerWaalsContact NE1-OH 3.08Å; T329-Y334 VanDerWaalsContact CB-OH 3.22Å; T329-Y334 WeakPolarHBondContact CB-OH 3.49Å; T329-Y334 HydrophobicContact CG2-CE1 3.88Å; T329-Y334 HydrophobicContact CG2-CE2 4.11Å; T329-Y334 WeakPolarHBondContact CG2-OH 3.39Å; P331-Y334 PolarHBondContact O-N 3.26Å; P331-Y334 VanDerWaalsContact O-N 3.14Å; Y334-S336 PolarHBondContact O-N 3.08Å; Y334-T337 PolarHBondContact O-N 2.95Å; Y334-I338 VanDerWaalsContact O-CG1 3.3Å; Y334-I338 WeakPolarHBondContact O-CG1 3.38Å; Y334-I338 PolarHBondContact O-N 3.18Å
335	S	97.6	Very high	98.3	Very high	66 Å²	66	38.6 Å²	38.6	46%	0.462	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-40.4	179.9	55.1	0	0	0	0	112.7	P331 G332 I338 S339	P331-S335 PolarHBondContact O-N 3.04Å; P331-S335 PolarHBondContact O-OG 3.3Å; G332-S335 VanDerWaalsContact CA-OG 3.3Å; G332-S335 WeakPolarHBondContact CA-OG 3.35Å; G332-S335 PolarHBondContact O-OG 2.89Å; S335-I338 PolarHBondContact O-N 3.2Å; S335-S339 WeakPolarHBondContact O-CB 3.22Å; S335-S339 PolarHBondContact O-N 3.13Å; S335-S339 PolarHBondContact O-OG 3.44Å; S335-S339 VanDerWaalsContact O-OG 3.06Å
336	S	97.7	Very high	98.3	Very high	69 Å²	69	43.1 Å²	43.1	48%	0.483	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-39.6	178.2	62.9	0	0	0	0	112.1	G332 F333 Y334 I338 S339 C340	G332-S336 WeakPolarHBondContact O-CB 3.34Å; G332-S336 PolarHBondContact O-N 3.21Å; G332-S336 PolarHBondContact O-OG 3.4Å; G332-S336 VanDerWaalsContact O-OG 3.13Å; F333-S336 PolarHBondContact O-OG 3.07Å; Y334-S336 PolarHBondContact O-N 3.08Å; S336-I338 VanDerWaalsContact C-N 3.33Å; S336-I338 PolarHBondContact O-N 3.44Å; S336-S339 PolarHBondContact O-N 3.01Å; S336-C340 PolarHBondContact O-N 3.05Å
337	T	98.4	Very high	98.3	Very high	6 Å²	6	44.2 Å²	44.2	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-59.3	-46.5	173.6	-58.3	0	0	0	0	110.5	M248 L278 F333 Y334 C340 L341	M248-T337 HydrophobicContact CE-CG2 4.14Å; L278-T337 HydrophobicContact CD1-CG2 4.3Å; L278-T337 HydrophobicContact CD2-CG2 4.35Å; F333-T337 WeakPolarHBondContact O-CB 3.3Å; F333-T337 PolarHBondContact O-N 3.47Å; F333-T337 VanDerWaalsContact O-N 3.15Å; F333-T337 PolarHBondContact O-OG1 3.21Å; Y334-T337 PolarHBondContact O-N 2.95Å; T337-C340 PolarHBondContact O-N 2.77Å; T337-L341 HydrophobicContact CG2-CD1 4.09Å; T337-L341 VanDerWaalsContact O-CG 3.3Å; T337-L341 WeakPolarHBondContact O-CG 3.36Å; T337-L341 PolarHBondContact O-N 3.45Å; T337-L341 VanDerWaalsContact O-N 3.09Å
338	I	98.4	Very high	98.3	Very high	19 Å²	19	39.7 Å²	39.7	10%	0.097	25%	0.245	C	C	.	.	H	α-helix	trans	-67.2	-41.7	179.3	-64.7	-62.3	0	0	0	112.2	M248 V249 F250 Y334 S335 S336 C340 L341 Q342	M248-I338 VanDerWaalsContact CA-CD1 3.46Å; M248-I338 HydrophobicContact CB-CD1 3.9Å; M248-I338 HydrophobicContact CE-CD1 4.48Å; V249-I338 VanDerWaalsContact O-CG2 3.28Å; V249-I338 WeakPolarHBondContact O-CG2 3.17Å; F250-I338 HydrophobicContact CD1-CG2 4.26Å; Y334-I338 VanDerWaalsContact O-CG1 3.3Å; Y334-I338 WeakPolarHBondContact O-CG1 3.38Å; Y334-I338 PolarHBondContact O-N 3.18Å; S335-I338 PolarHBondContact O-N 3.2Å; S336-I338 VanDerWaalsContact C-N 3.33Å; S336-I338 PolarHBondContact O-N 3.44Å; I338-C340 VanDerWaalsContact C-N 3.3Å; I338-C340 PolarHBondContact O-N 3.11Å; I338-L341 HydrophobicContact CD1-CD1 4.3Å; I338-L341 PolarHBondContact O-N 3.02Å; I338-Q342 WeakPolarHBondContact O-CB 3.03Å; I338-Q342 PolarHBondContact O-N 2.81Å
339	S	98.1	Very high	98.3	Very high	69 Å²	69	38.1 Å²	38.1	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-60.1	-39.6	175.3	-64.5	0	0	0	0	112.3	S335 S336 S343	S335-S339 WeakPolarHBondContact O-CB 3.22Å; S335-S339 PolarHBondContact O-N 3.13Å; S335-S339 PolarHBondContact O-OG 3.44Å; S335-S339 VanDerWaalsContact O-OG 3.06Å; S336-S339 PolarHBondContact O-N 3.01Å; S339-S343 WeakPolarHBondContact O-CB 3.44Å; S339-S343 PolarHBondContact O-N 2.67Å
340	C	98.1	Very high	98.3	Very high	37 Å²	37	41.4 Å²	41.4	25%	0.25	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-47.2	174.9	176.9	0	0	0	0	111.8	L82 S336 T337 I338 Q342 S343 N344	L82-C340 HydrophobicContact CD2-CB 4.25Å; S336-C340 PolarHBondContact O-N 3.05Å; T337-C340 PolarHBondContact O-N 2.77Å; I338-C340 VanDerWaalsContact C-N 3.3Å; I338-C340 PolarHBondContact O-N 3.11Å; C340-Q342 VanDerWaalsContact C-N 3.34Å; C340-Q342 PolarHBondContact O-N 3.33Å; C340-S343 PolarHBondContact O-N 3.02Å; C340-N344 PolarHBondContact O-N 2.88Å; C340-N344 VanDerWaalsContact O-N 3.12Å
341	L	98.6	Very high	98.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-40.4	179	-67	168.4	0	0	0	112.1	M248 F250 T337 I338 A345 M367 L415 T416	M248-L341 HydrophobicContact CE-CD1 3.69Å; F250-L341 HydrophobicContact CE1-CB 3.98Å; T337-L341 HydrophobicContact CG2-CD1 4.09Å; T337-L341 VanDerWaalsContact O-CG 3.3Å; T337-L341 WeakPolarHBondContact O-CG 3.36Å; T337-L341 PolarHBondContact O-N 3.45Å; T337-L341 VanDerWaalsContact O-N 3.09Å; I338-L341 HydrophobicContact CD1-CD1 4.3Å; I338-L341 PolarHBondContact O-N 3.02Å; L341-A345 WeakPolarHBondContact O-CB 3.42Å; L341-A345 PolarHBondContact O-N 2.83Å; L341-M367 HydrophobicContact CD1-CG 4.29Å; L341-M367 HydrophobicContact CD2-CB 4.4Å; L341-M367 HydrophobicContact CD2-CG 4.12Å; L341-L415 HydrophobicContact CD2-CB 4.26Å; L341-T416 HydrophobicContact CD2-CG2 3.7Å
342	Q	98.6	Very high	98.4	Very high	46 Å²	46	36.5 Å²	36.5	22%	0.215	22%	0.22	C	C	.	.	H	α-helix	trans	-66.1	-48.1	176.9	-177.3	-174.2	1.9	0	0	111.6	F250 I338 C340 N344 A345 E346	F250-Q342 HydrophobicContact CD1-CB 4.01Å; F250-Q342 HydrophobicContact CD2-CG 4.33Å; F250-Q342 HydrophobicContact CE1-CB 4.22Å; F250-Q342 HydrophobicContact CG-CB 4.19Å; F250-Q342 HydrophobicContact CG-CG 4.25Å; I338-Q342 WeakPolarHBondContact O-CB 3.03Å; I338-Q342 PolarHBondContact O-N 2.81Å; C340-Q342 VanDerWaalsContact C-N 3.34Å; C340-Q342 PolarHBondContact O-N 3.33Å; Q342-N344 VanDerWaalsContact C-N 3.29Å; Q342-N344 PolarHBondContact O-N 3.42Å; Q342-A345 WeakPolarHBondContact O-CA 3.5Å; Q342-A345 WeakPolarHBondContact O-CB 3.39Å; Q342-A345 PolarHBondContact O-N 3.42Å; Q342-E346 HydrophobicContact CG-CG 4.39Å; Q342-E346 WeakPolarHBondContact CG-OE1 3.3Å; Q342-E346 PolarHBondContact NE2-OE1 3.22Å; Q342-E346 WeakPolarHBondContact O-CG 3.43Å; Q342-E346 PolarHBondContact O-N 2.82Å
343	S	98.4	Very high	98.4	Very high	35 Å²	35	37.1 Å²	37.1	25%	0.245	22%	0.218	C	C	.	.	H	α-helix	trans	-54.3	-48.7	177.4	-174.5	0	0	0	0	110.6	S339 C340 A345 E346 I347 E419	S339-S343 WeakPolarHBondContact O-CB 3.44Å; S339-S343 PolarHBondContact O-N 2.67Å; C340-S343 PolarHBondContact O-N 3.02Å; S343-A345 VanDerWaalsContact C-N 3.34Å; S343-A345 PolarHBondContact O-N 2.93Å; S343-E346 PolarHBondContact O-N 3.01Å; S343-I347 VanDerWaalsContact O-CG1 3.3Å; S343-I347 WeakPolarHBondContact O-CG1 3.16Å; S343-I347 PolarHBondContact O-N 3.19Å; S343-E419 PolarHBondContact OG-OE2 3.32Å
344	N	98.6	Very high	98.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-34.4	176.8	-82.5	-16.4	0	0	0	113.6	C340 Q342 C348 L415 V417 E419 M422	C340-N344 PolarHBondContact O-N 2.88Å; C340-N344 VanDerWaalsContact O-N 3.12Å; Q342-N344 VanDerWaalsContact C-N 3.29Å; Q342-N344 PolarHBondContact O-N 3.42Å; N344-C348 WeakPolarHBondContact O-CB 3.4Å; N344-C348 PolarHBondContact O-N 3.11Å; N344-L415 HydrophobicContact CB-CB 4.25Å; N344-L415 WeakPolarHBondContact CB-O 3.4Å; N344-L415 PolarHBondContact ND2-O 3.03Å; N344-V417 PolarHBondContact ND2-O 3.06Å; N344-E419 WeakPolarHBondContact OD1-CA 3.29Å; N344-M422 HydrophobicContact CB-CE 4.23Å
345	A	98.8	Very high	98.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-47.9	174.2	0	0	0	0	0	111.1	F250 L341 Q342 S343 C348 F349 M362 P363 L415	F250-A345 HydrophobicContact CE2-CB 3.57Å; F250-A345 HydrophobicContact CZ-CB 3.72Å; L341-A345 WeakPolarHBondContact O-CB 3.42Å; L341-A345 PolarHBondContact O-N 2.83Å; Q342-A345 WeakPolarHBondContact O-CA 3.5Å; Q342-A345 WeakPolarHBondContact O-CB 3.39Å; Q342-A345 PolarHBondContact O-N 3.42Å; S343-A345 VanDerWaalsContact C-N 3.34Å; S343-A345 PolarHBondContact O-N 2.93Å; A345-C348 PolarHBondContact O-N 3.1Å; A345-F349 WeakPolarHBondContact O-CB 3.42Å; A345-F349 PolarHBondContact O-N 3.19Å; A345-M362 HydrophobicContact CB-CE 3.99Å; A345-P363 HydrophobicContact CB-CG 3.9Å; A345-L415 HydrophobicContact CB-CD1 3.82Å
346	E	98.7	Very high	98.5	Very high	95 Å²	95	39.1 Å²	39.1	44%	0.444	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-43.4	-179.8	-70.5	172.3	-178.2	0	0	111.3	Q342 S343 S350 M362	Q342-E346 HydrophobicContact CG-CG 4.39Å; Q342-E346 WeakPolarHBondContact CG-OE1 3.3Å; Q342-E346 PolarHBondContact NE2-OE1 3.22Å; Q342-E346 WeakPolarHBondContact O-CG 3.43Å; Q342-E346 PolarHBondContact O-N 2.82Å; S343-E346 PolarHBondContact O-N 3.01Å; E346-S350 WeakPolarHBondContact O-CB 3.45Å; E346-S350 PolarHBondContact O-N 3.06Å; E346-M362 HydrophobicContact CG-CE 3.81Å
347	I	98.7	Very high	98.5	Very high	28 Å²	28	36 Å²	36	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-55.2	174.1	-69.9	165.4	0	0	0	110.5	S343 F349 S350 E351 E419 M422 L423	S343-I347 VanDerWaalsContact O-CG1 3.3Å; S343-I347 WeakPolarHBondContact O-CG1 3.16Å; S343-I347 PolarHBondContact O-N 3.19Å; I347-F349 VanDerWaalsContact C-N 3.35Å; I347-F349 PolarHBondContact O-N 3.35Å; I347-S350 PolarHBondContact O-N 3.04Å; I347-E351 HydrophobicContact CG2-CG 4.17Å; I347-E351 VanDerWaalsContact O-CB 3.3Å; I347-E351 WeakPolarHBondContact O-CB 3.09Å; I347-E351 VanDerWaalsContact O-CG 3.25Å; I347-E351 WeakPolarHBondContact O-CG 3.49Å; I347-E351 PolarHBondContact O-N 3.34Å; I347-E419 HydrophobicContact CD1-CG 3.36Å; I347-M422 HydrophobicContact CB-CG 4.43Å; I347-M422 HydrophobicContact CG2-CG 3.88Å; I347-L423 HydrophobicContact CG2-CD2 3.56Å; I347-L423 HydrophobicContact CG2-CG 3.97Å
348	C	98.6	Very high	98.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-46.6	-177.3	-174.7	0	0	0	0	111.3	N344 A345 L352 L369 L415 M422	N344-C348 WeakPolarHBondContact O-CB 3.4Å; N344-C348 PolarHBondContact O-N 3.11Å; A345-C348 PolarHBondContact O-N 3.1Å; C348-L352 VanDerWaalsContact O-CB 3.26Å; C348-L352 WeakPolarHBondContact O-CB 3.39Å; C348-L352 VanDerWaalsContact O-CG 3.24Å; C348-L352 WeakPolarHBondContact O-CG 3.43Å; C348-L352 PolarHBondContact O-N 2.89Å; C348-L369 HydrophobicContact CB-CD1 4.41Å; C348-L415 HydrophobicContact CB-CD2 4.14Å; C348-M422 HydrophobicContact CB-CE 4.22Å; C348-M422 HydrophobicContact CB-CG 4.44Å; C348-M422 HydrophobicContact CB-SD 3.83Å
349	F	98.8	Very high	98.5	Very high	71 Å²	71	38.9 Å²	38.9	31%	0.311	24%	0.235	S	C	.	.	H	α-helix	trans	-62	-50.5	177.6	179.3	-97.9	0	0	0	111.6	A345 I347 S353 P360 M362 L369	A345-F349 WeakPolarHBondContact O-CB 3.42Å; A345-F349 PolarHBondContact O-N 3.19Å; I347-F349 VanDerWaalsContact C-N 3.35Å; I347-F349 PolarHBondContact O-N 3.35Å; F349-S353 WeakPolarHBondContact O-CB 3.49Å; F349-S353 PolarHBondContact O-N 3.29Å; F349-S353 PolarHBondContact O-OG 2.89Å; F349-P360 HydrophobicContact CD2-CB 4.01Å; F349-P360 HydrophobicContact CD2-CG 3.97Å; F349-P360 HydrophobicContact CE2-CG 4.23Å; F349-P360 WeakPolarHBondContact CE2-O 3.34Å; F349-M362 HydrophobicContact CB-SD 3.58Å; F349-M362 VanDerWaalsContact CB-SD 3.58Å; F349-M362 HydrophobicContact CD1-SD 4.09Å; F349-M362 HydrophobicContact CD2-CB 3.72Å; F349-M362 HydrophobicContact CD2-CG 4.49Å; F349-M362 HydrophobicContact CD2-SD 4.14Å; F349-M362 HydrophobicContact CE2-CB 3.77Å; F349-M362 HydrophobicContact CG-CB 4.15Å; F349-M362 HydrophobicContact CG-CG 4.45Å; F349-M362 HydrophobicContact CG-SD 3.66Å; F349-M362 HydrophobicContact CZ-CB 4.23Å; F349-L369 HydrophobicContact CB-CD1 4.13Å
350	S	98.6	Very high	98.5	Very high	77 Å²	77	36.3 Å²	36.3	54%	0.538	22%	0.216	S	C	.	.	H	α-helix	trans	-62.5	-48.4	-178.9	-178.3	0	0	0	0	112.1	E346 I347 A354	E346-S350 WeakPolarHBondContact O-CB 3.45Å; E346-S350 PolarHBondContact O-N 3.06Å; I347-S350 PolarHBondContact O-N 3.04Å; S350-A354 PolarHBondContact O-N 3.41Å
351	E	98.6	Very high	98.6	Very high	54 Å²	54	35.6 Å²	35.6	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-66	-42.9	-177.2	-69.7	-69.9	130.6	0	0	112	I347 V355 C426 R430	I347-E351 HydrophobicContact CG2-CG 4.17Å; I347-E351 VanDerWaalsContact O-CB 3.3Å; I347-E351 WeakPolarHBondContact O-CB 3.09Å; I347-E351 VanDerWaalsContact O-CG 3.25Å; I347-E351 WeakPolarHBondContact O-CG 3.49Å; I347-E351 PolarHBondContact O-N 3.34Å; E351-V355 WeakPolarHBondContact O-CG2 3.44Å; E351-C426 HydrophobicContact CB-CB 3.63Å; E351-C426 HydrophobicContact CG-CB 4.05Å; E351-R430 IonicContact OE2-CZ 3.19Å; E351-R430 IonicContact OE2-NH1 2.64Å; E351-R430 PolarHBondContact OE2-NH1 2.89Å; E351-R430 IonicContact OE2-NH2 3.18Å
352	L	98.7	Very high	98.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-80.4	-27.2	-177.8	-59.9	-174.9	0	0	0	113	C348 A354 V355 L358 P360 V371 C426 I429	C348-L352 VanDerWaalsContact O-CB 3.26Å; C348-L352 WeakPolarHBondContact O-CB 3.39Å; C348-L352 VanDerWaalsContact O-CG 3.24Å; C348-L352 WeakPolarHBondContact O-CG 3.43Å; C348-L352 PolarHBondContact O-N 2.89Å; L352-A354 PolarHBondContact O-N 3.03Å; L352-V355 HydrophobicContact CD2-CG2 4.49Å; L352-V355 WeakPolarHBondContact O-CB 3.49Å; L352-V355 PolarHBondContact O-N 2.94Å; L352-V355 VanDerWaalsContact O-N 3.1Å; L352-L358 HydrophobicContact CD2-CD1 4.29Å; L352-P360 HydrophobicContact CB-CB 4.46Å; L352-P360 HydrophobicContact CB-CG 4.17Å; L352-V371 HydrophobicContact CD1-CG2 3.81Å; L352-C426 HydrophobicContact CD2-CB 4.28Å; L352-I429 HydrophobicContact CD2-CB 4.08Å; L352-I429 HydrophobicContact CD2-CD1 4.29Å; L352-I429 HydrophobicContact CD2-CG2 3.73Å
353	S	98.6	Very high	98.5	Very high	58 Å²	58	36.5 Å²	36.5	41%	0.406	22%	0.216	S	C	.	.	H	α-helix	trans	-64.9	-24.9	172.6	-62.6	0	0	0	0	112.3	F349 V355 P360	F349-S353 WeakPolarHBondContact O-CB 3.49Å; F349-S353 PolarHBondContact O-N 3.29Å; F349-S353 PolarHBondContact O-OG 2.89Å; S353-V355 VanDerWaalsContact C-N 3.28Å; S353-P360 WeakPolarHBondContact OG-CG 3.45Å
354	A	98.1	Very high	98.5	Very high	75 Å²	75	36.4 Å²	36.4	62%	0.62	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.6	176.7	0	0	0	0	0	113.2	S350 L352 P356	S350-A354 PolarHBondContact O-N 3.41Å; L352-A354 PolarHBondContact O-N 3.03Å; A354-P356 WeakPolarHBondContact O-CD 3.24Å
355	V	98.6	Very high	98.5	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.03	22%	0.215	C	C	.	.	S	Bend	trans	-93.5	115.6	-178.6	-177.8	0	0	0	0	109.6	E351 L352 S353 G357 L358 R430 C433	E351-V355 WeakPolarHBondContact O-CG2 3.44Å; L352-V355 HydrophobicContact CD2-CG2 4.49Å; L352-V355 WeakPolarHBondContact O-CB 3.49Å; L352-V355 PolarHBondContact O-N 2.94Å; L352-V355 VanDerWaalsContact O-N 3.1Å; S353-V355 VanDerWaalsContact C-N 3.28Å; V355-G357 PolarHBondContact O-N 3.34Å; V355-L358 HydrophobicContact CB-CB 4.32Å; V355-L358 HydrophobicContact CB-CD1 3.98Å; V355-L358 HydrophobicContact CB-CG 4.23Å; V355-L358 HydrophobicContact CG1-CD1 3.83Å; V355-L358 HydrophobicContact CG1-CG 3.98Å; V355-L358 PolarHBondContact O-N 2.93Å; V355-L358 VanDerWaalsContact O-N 3.14Å; V355-R430 HydrophobicContact CG2-CB 3.69Å; V355-R430 HydrophobicContact CG2-CG 3.97Å; V355-C433 HydrophobicContact CG1-CB 3.36Å
356	P	98.3	Very high	98.5	Very high	77 Å²	77	36.4 Å²	36.4	50%	0.5	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	134	175	-25.7	35.4	0	0	0	111.8	A354 Y437	A354-P356 WeakPolarHBondContact O-CD 3.24Å; P356-Y437 VanDerWaalsContact C-CE2 3.47Å; P356-Y437 HydrophobicContact CB-CD1 4.2Å; P356-Y437 HydrophobicContact CB-CD2 3.91Å; P356-Y437 HydrophobicContact CB-CE1 3.92Å; P356-Y437 HydrophobicContact CB-CE2 3.62Å; P356-Y437 HydrophobicContact CB-CG 4.21Å; P356-Y437 VanDerWaalsContact O-CD2 3.28Å; P356-Y437 WeakPolarHBondContact O-CD2 3.44Å
357	G	98.1	Very high	98.5	Very high	3 Å²	3	31.9 Å²	31.9	3%	0.031	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-3.1	-178.2	0	0	0	0	0	115.2	V355 E374	V355-G357 PolarHBondContact O-N 3.34Å; G357-E374 WeakPolarHBondContact CA-OE2 3.46Å; G357-E374 PolarHBondContact O-N 3.49Å
358	L	98.8	Very high	98.5	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136	175.2	-61.3	-172	0	0	0	111.8	L352 V355 V371 G372 F387 F411 I429	L352-L358 HydrophobicContact CD2-CD1 4.29Å; V355-L358 HydrophobicContact CB-CB 4.32Å; V355-L358 HydrophobicContact CB-CD1 3.98Å; V355-L358 HydrophobicContact CB-CG 4.23Å; V355-L358 HydrophobicContact CG1-CD1 3.83Å; V355-L358 HydrophobicContact CG1-CG 3.98Å; V355-L358 PolarHBondContact O-N 2.93Å; V355-L358 VanDerWaalsContact O-N 3.14Å; L358-V371 HydrophobicContact CB-CG1 4.01Å; L358-V371 HydrophobicContact CD1-CG1 4.39Å; L358-V371 HydrophobicContact CD2-CG1 4.29Å; L358-V371 HydrophobicContact CG-CG1 4.47Å; L358-G372 WeakPolarHBondContact CA-O 3.42Å; L358-F387 HydrophobicContact CD2-CZ 4.27Å; L358-F411 HydrophobicContact CD1-CZ 4.37Å; L358-F411 HydrophobicContact CD2-CE1 4.04Å; L358-F411 HydrophobicContact CD2-CZ 4.5Å; L358-I429 HydrophobicContact CD1-CG2 3.75Å
359	N	98.5	Very high	98.5	Very high	81 Å²	81	30.7 Å²	30.7	43%	0.433	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	78.9	-178.8	-70.2	-41.6	0	0	0	110.5	G372 E374	N359-G372 PolarHBondContact N-O 2.83Å; N359-G372 PolarHBondContact O-N 3.37Å; N359-E374 VanDerWaalsContact ND2-CG 3.26Å; N359-E374 WeakPolarHBondContact ND2-CG 3.14Å; N359-E374 PolarHBondContact ND2-OE1 2.94Å
360	P	98.8	Very high	98.5	Very high	15 Å²	15	27.3 Å²	27.3	10%	0.097	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	144.7	174.8	31.3	-36.2	0	0	0	111.4	F349 L352 S353 L369 V371	F349-P360 HydrophobicContact CD2-CB 4.01Å; F349-P360 HydrophobicContact CD2-CG 3.97Å; F349-P360 HydrophobicContact CE2-CG 4.23Å; F349-P360 WeakPolarHBondContact CE2-O 3.34Å; L352-P360 HydrophobicContact CB-CB 4.46Å; L352-P360 HydrophobicContact CB-CG 4.17Å; S353-P360 WeakPolarHBondContact OG-CG 3.45Å; P360-L369 HydrophobicContact CB-CD2 3.9Å; P360-V371 HydrophobicContact CB-CG1 4.35Å; P360-V371 HydrophobicContact CB-CG2 4.21Å
361	V	98.7	Very high	98.5	Very high	22 Å²	22	23.6 Å²	23.6	13%	0.133	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120	171.8	-175.5	0	0	0	0	108.9	P185 W189 P363 M370	P185-V361 HydrophobicContact CB-CG2 4.11Å; W189-V361 HydrophobicContact CZ2-CB 4.47Å; W189-V361 HydrophobicContact CZ2-CG2 3.95Å; W189-V361 VanDerWaalsContact NE1-CB 3.34Å; W189-V361 VanDerWaalsContact NE1-CG1 3.31Å; V361-P363 WeakPolarHBondContact O-CD 3.33Å; V361-M370 PolarHBondContact N-O 3.09Å
362	M	98.2	Very high	98.5	Very high	64 Å²	64	21.1 Å²	21.1	32%	0.315	14%	0.136	S	C	.	.			trans	-62.3	122.4	-176.4	-174.5	62.9	-177.1	0	0	110.9	A345 E346 F349	A345-M362 HydrophobicContact CB-CE 3.99Å; E346-M362 HydrophobicContact CG-CE 3.81Å; F349-M362 HydrophobicContact CB-SD 3.58Å; F349-M362 VanDerWaalsContact CB-SD 3.58Å; F349-M362 HydrophobicContact CD1-SD 4.09Å; F349-M362 HydrophobicContact CD2-CB 3.72Å; F349-M362 HydrophobicContact CD2-CG 4.49Å; F349-M362 HydrophobicContact CD2-SD 4.14Å; F349-M362 HydrophobicContact CE2-CB 3.77Å; F349-M362 HydrophobicContact CG-CB 4.15Å; F349-M362 HydrophobicContact CG-CG 4.45Å; F349-M362 HydrophobicContact CG-SD 3.66Å; F349-M362 HydrophobicContact CZ-CB 4.23Å
363	P	98.4	Very high	98.5	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.013	14%	0.139	C	C	.	.			trans	-79.5	160.4	176.1	31.6	-33.3	0	0	0	110.9	G217 F250 A345 V361 Y368 L369 L415	G217-P363 WeakPolarHBondContact O-CA 3.48Å; G217-P363 WeakPolarHBondContact O-CB 3.47Å; F250-P363 WeakPolarHBondContact CD2-O 3.26Å; F250-P363 HydrophobicContact CE2-CB 4.43Å; F250-P363 HydrophobicContact CE2-CG 4.08Å; F250-P363 VanDerWaalsContact CE2-O 3.22Å; F250-P363 WeakPolarHBondContact CE2-O 3.3Å; F250-P363 HydrophobicContact CZ-CG 4.42Å; A345-P363 HydrophobicContact CB-CG 3.9Å; V361-P363 WeakPolarHBondContact O-CD 3.33Å; P363-Y368 WeakPolarHBondContact CB-O 3.22Å; P363-L369 VanDerWaalsContact CD-CD1 3.44Å; P363-L369 HydrophobicContact CG-CB 4.13Å; P363-L369 HydrophobicContact CG-CD1 4.07Å; P363-L369 HydrophobicContact CG-CG 4.31Å; P363-L415 HydrophobicContact CG-CD1 3.86Å
364	S	98.4	Very high	98.5	Very high	33 Å²	33	22.2 Å²	22.2	23%	0.231	14%	0.135	C	C	.	.	S	Bend	trans	-117.6	-0.3	175.8	-56.1	0	0	0	0	112.4	G217 V219 V249 F250	G217-S364 PolarHBondContact O-N 2.89Å; V219-S364 VanDerWaalsContact CG2-C 3.44Å; V219-S364 WeakPolarHBondContact CG2-O 3.11Å; V249-S364 WeakPolarHBondContact CA-O 3.41Å; F250-S364 PolarHBondContact N-O 3.12Å
365	G	98.2	Very high	98.5	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-179.7	-161.5	179.9	0	0	0	0	0	113.5	G217 M248	G217-G365 WeakPolarHBondContact CA-O 3.41Å; G217-G365 PolarHBondContact O-N 3.18Å; M248-G365 CarbonylContact O-C 3.47Å; M248-G365 WeakPolarHBondContact O-CA 3.38Å
366	A	98.4	Very high	98.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	-138.6	-172.3	0	0	0	0	0	112.5	P212 S213 Y245 M248	P212-A366 HydrophobicContact CB-CB 4.12Å; S213-A366 WeakPolarHBondContact O-CB 3.14Å; Y245-A366 HydrophobicContact CD1-CB 3.73Å; Y245-A366 HydrophobicContact CD2-CB 4.06Å; Y245-A366 HydrophobicContact CE1-CB 4.2Å; Y245-A366 HydrophobicContact CG-CB 3.66Å; M248-A366 PolarHBondContact O-N 3.44Å
367	M	98.7	Very high	98.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138	14.1	-171.9	-64.9	175.7	178.3	0	0	112.7	P76 Y245 M248 K275 L278 L341 L415 T416	P76-M367 HydrophobicContact CB-CE 4.05Å; P76-M367 HydrophobicContact CB-SD 3.92Å; P76-M367 HydrophobicContact CG-CE 3.97Å; P76-M367 HydrophobicContact CG-SD 4.05Å; Y245-M367 HydrophobicContact CD1-CG 4.46Å; Y245-M367 HydrophobicContact CE1-CB 4.36Å; Y245-M367 HydrophobicContact CE1-CE 4.21Å; Y245-M367 HydrophobicContact CE1-CG 3.85Å; Y245-M367 HydrophobicContact CE1-SD 3.81Å; M248-M367 HydrophobicContact CE-CE 3.39Å; M248-M367 HydrophobicContact CE-CG 4.47Å; M248-M367 HydrophobicContact SD-CE 3.83Å; K275-M367 HydrophobicContact CB-CE 3.88Å; K275-M367 HydrophobicContact CD-CE 4.27Å; K275-M367 HydrophobicContact CD-SD 4.17Å; L278-M367 HydrophobicContact CD2-CE 4.15Å; L341-M367 HydrophobicContact CD1-CG 4.29Å; L341-M367 HydrophobicContact CD2-CB 4.4Å; L341-M367 HydrophobicContact CD2-CG 4.12Å; M367-L415 PolarHBondContact O-N 2.95Å; M367-T416 HydrophobicContact CB-CG2 3.92Å; M367-T416 HydrophobicContact CG-CG2 3.98Å; M367-T416 HydrophobicContact SD-CG2 4.01Å
368	Y	98.7	Very high	98.4	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.9	-166.4	-48.6	-69.1	0	0	0	111.9	G74 N214 P215 G217 Y245 K275 P363 R412 V413 V414	G74-Y368 PolarHBondContact O-OH 3.47Å; N214-Y368 HydrophobicContact CB-CD2 3.64Å; N214-Y368 HydrophobicContact CB-CE2 3.5Å; N214-Y368 WeakPolarHBondContact OD1-CD2 3.27Å; N214-Y368 WeakPolarHBondContact OD1-CE2 3.38Å; P215-Y368 WeakPolarHBondContact O-CB 3.41Å; G217-Y368 WeakPolarHBondContact CA-O 3.45Å; Y245-Y368 HydrophobicContact CE1-CE2 4.35Å; Y245-Y368 HydrophobicContact CE2-CE2 4.2Å; Y245-Y368 AromaticContact CZ-CE2 3.68Å; Y245-Y368 WeakPolarHBondContact OH-CE2 3.37Å; Y245-Y368 PolarHBondContact OH-OH 2.84Å; K275-Y368 PolarHBondContact NZ-OH 3.24Å; P363-Y368 WeakPolarHBondContact CB-O 3.22Å; Y368-R412 HydrophobicContact CD1-CG 4.38Å; Y368-R412 HydrophobicContact CG-CG 4.47Å; Y368-V413 WeakPolarHBondContact CA-O 3.5Å; Y368-V414 HydrophobicContact CD1-CB 4.4Å; Y368-V414 HydrophobicContact CD1-CG1 3.85Å; Y368-V414 HydrophobicContact CE1-CG1 3.79Å
369	L	98.5	Very high	98.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.5	171.8	-177.3	153.1	0	0	0	108.3	C348 F349 P360 P363 V371 R412 V413 L415	C348-L369 HydrophobicContact CB-CD1 4.41Å; F349-L369 HydrophobicContact CB-CD1 4.13Å; P360-L369 HydrophobicContact CB-CD2 3.9Å; P363-L369 VanDerWaalsContact CD-CD1 3.44Å; P363-L369 HydrophobicContact CG-CB 4.13Å; P363-L369 HydrophobicContact CG-CD1 4.07Å; P363-L369 HydrophobicContact CG-CG 4.31Å; L369-V371 HydrophobicContact CD2-CG2 3.37Å; L369-R412 WeakPolarHBondContact O-CA 3.48Å; L369-V413 PolarHBondContact N-O 3.11Å; L369-V413 PolarHBondContact O-N 3.37Å; L369-L415 HydrophobicContact CB-CD1 4.38Å; L369-L415 HydrophobicContact CB-CD2 4.08Å; L369-L415 HydrophobicContact CB-CG 4.43Å
370	M	98.9	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.4	174.5	-73.2	-74.1	-73.3	0	0	110.3	P162 W189 P215 V361 A402 F410 R412	P162-M370 HydrophobicContact CB-CE 4.21Å; P162-M370 HydrophobicContact CG-CE 4.03Å; W189-M370 HydrophobicContact CZ2-CB 3.69Å; W189-M370 HydrophobicContact CZ2-CG 4.31Å; P215-M370 HydrophobicContact CB-CG 4.23Å; P215-M370 HydrophobicContact CB-SD 3.7Å; P215-M370 HydrophobicContact CG-CE 4.28Å; P215-M370 HydrophobicContact CG-CG 4.26Å; P215-M370 HydrophobicContact CG-SD 3.76Å; P215-M370 WeakPolarHBondContact O-CG 3.29Å; V361-M370 PolarHBondContact N-O 3.09Å; M370-A402 HydrophobicContact CE-CB 3.59Å; M370-A402 HydrophobicContact SD-CB 4.41Å; M370-F410 HydrophobicContact CB-CD1 4.19Å; M370-F410 HydrophobicContact CE-CB 3.71Å; M370-F410 HydrophobicContact CE-CD1 4.05Å; M370-F410 HydrophobicContact CE-CG 4.14Å; M370-R412 HydrophobicContact SD-CB 3.8Å; M370-R412 HydrophobicContact SD-CG 4.15Å
371	V	98.9	Very high	98.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	117.6	179.7	-170.7	0	0	0	0	109.3	L352 L358 P360 L369 F410 F411 V413	L352-V371 HydrophobicContact CD1-CG2 3.81Å; L358-V371 HydrophobicContact CB-CG1 4.01Å; L358-V371 HydrophobicContact CD1-CG1 4.39Å; L358-V371 HydrophobicContact CD2-CG1 4.29Å; L358-V371 HydrophobicContact CG-CG1 4.47Å; P360-V371 HydrophobicContact CB-CG1 4.35Å; P360-V371 HydrophobicContact CB-CG2 4.21Å; L369-V371 HydrophobicContact CD2-CG2 3.37Å; V371-F410 CarbonylContact O-C 3.54Å; V371-F410 WeakPolarHBondContact O-CA 3.48Å; V371-F410 WeakPolarHBondContact O-CD1 3.38Å; V371-F411 HydrophobicContact CB-CD1 4.33Å; V371-F411 HydrophobicContact CB-CD2 4.01Å; V371-F411 HydrophobicContact CB-CE1 3.91Å; V371-F411 HydrophobicContact CB-CE2 3.57Å; V371-F411 HydrophobicContact CB-CG 4.39Å; V371-F411 HydrophobicContact CB-CZ 3.52Å; V371-F411 HydrophobicContact CG1-CE1 3.9Å; V371-F411 HydrophobicContact CG1-CE2 4.12Å; V371-F411 HydrophobicContact CG1-CZ 3.56Å; V371-F411 HydrophobicContact CG2-CD2 4.13Å; V371-F411 HydrophobicContact CG2-CE2 3.53Å; V371-F411 HydrophobicContact CG2-CZ 3.87Å; V371-F411 PolarHBondContact N-O 3.11Å; V371-F411 PolarHBondContact O-N 2.97Å; V371-V413 HydrophobicContact CG2-CG2 4.32Å
372	G	98.8	Very high	98.2	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.7	172.6	0	0	0	0	0	111.1	L358 N359 F410	L358-G372 WeakPolarHBondContact CA-O 3.42Å; N359-G372 PolarHBondContact N-O 2.83Å; N359-G372 PolarHBondContact O-N 3.37Å; G372-F410 VanDerWaalsContact N-CE1 3.3Å
373	I	98.8	Very high	98.1	Very high	11 Å²	11	35.1 Å²	35.1	6%	0.056	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.2	176.2	-45.3	170.8	0	0	0	107.4	M375 F378 D384 F387 D409 F411	I373-M375 VanDerWaalsContact C-N 3.27Å; I373-M375 HydrophobicContact CB-SD 3.88Å; I373-M375 HydrophobicContact CD1-SD 4.29Å; I373-M375 HydrophobicContact CG2-CG 4.47Å; I373-M375 HydrophobicContact CG2-SD 3.54Å; I373-M375 VanDerWaalsContact CG2-SD 3.54Å; I373-M375 PolarHBondContact O-N 3.39Å; I373-F378 HydrophobicContact CG2-CD2 3.74Å; I373-F378 HydrophobicContact CG2-CE2 3.87Å; I373-D384 HydrophobicContact CD1-CB 3.93Å; I373-F387 HydrophobicContact CD1-CB 4.21Å; I373-F387 HydrophobicContact CD1-CD1 4.05Å; I373-F387 HydrophobicContact CD1-CD2 4.3Å; I373-F387 HydrophobicContact CD1-CG 3.94Å; I373-F387 HydrophobicContact CG2-CD2 3.99Å; I373-F387 HydrophobicContact CG2-CE2 3.93Å; I373-D409 PolarHBondContact N-O 2.62Å; I373-F411 HydrophobicContact CD1-CD1 3.86Å; I373-F411 HydrophobicContact CD1-CE1 4.44Å; I373-F411 HydrophobicContact CG1-CD1 3.85Å; I373-F411 HydrophobicContact CG1-CE1 4.09Å
374	E	98.3	Very high	98.1	Very high	70 Å²	70	35 Å²	35	33%	0.327	18%	0.182	S	C	.	.			trans	-78.1	81.9	171.2	-59.7	179.7	162.1	0	0	108.8	G357 N359 D376 H377 F378	G357-E374 WeakPolarHBondContact CA-OE2 3.46Å; G357-E374 PolarHBondContact O-N 3.49Å; N359-E374 VanDerWaalsContact ND2-CG 3.26Å; N359-E374 WeakPolarHBondContact ND2-CG 3.14Å; N359-E374 PolarHBondContact ND2-OE1 2.94Å; E374-D376 PolarHBondContact O-N 3.06Å; E374-D376 VanDerWaalsContact O-N 3.08Å; E374-H377 WeakPolarHBondContact O-CB 3.43Å; E374-H377 PolarHBondContact O-N 3.41Å; E374-H377 IonicContact OE2-CD2 3.04Å; E374-H377 PolarHBondContact OE2-CD2 3.31Å; E374-H377 IonicContact OE2-NE2 3.61Å; E374-F378 WeakPolarHBondContact O-CD2 3.46Å
375	M	97.9	Very high	98.1	Very high	29 Å²	29	34.8 Å²	34.8	14%	0.143	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-55.5	-30.6	-170.9	-67.2	-59.3	-60.6	0	0	113.8	I373 H377 F378 F381 D409	I373-M375 VanDerWaalsContact C-N 3.27Å; I373-M375 HydrophobicContact CB-SD 3.88Å; I373-M375 HydrophobicContact CD1-SD 4.29Å; I373-M375 HydrophobicContact CG2-CG 4.47Å; I373-M375 HydrophobicContact CG2-SD 3.54Å; I373-M375 VanDerWaalsContact CG2-SD 3.54Å; I373-M375 PolarHBondContact O-N 3.39Å; M375-H377 PolarHBondContact O-N 2.86Å; M375-F378 CarbonylContact O-C 3.52Å; M375-F378 PolarHBondContact O-N 3.03Å; M375-F381 HydrophobicContact CE-CB 3.89Å; M375-F381 WeakPolarHBondContact CE-O 3.43Å; M375-D409 HydrophobicContact CG-CB 3.9Å; M375-D409 WeakPolarHBondContact CG-OD1 3.49Å
376	D	97.4	Very high	98.1	Very high	157 Å²	157	37.1 Å²	37.1	84%	0.84	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-59.6	-26.4	175.6	-69.2	-19	0	0	0	113.1	E374	E374-D376 PolarHBondContact O-N 3.06Å; E374-D376 VanDerWaalsContact O-N 3.08Å
377	H	98	Very high	98.1	Very high	34 Å²	34	37.1 Å²	37.1	16%	0.157	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-87.4	-2.9	175.7	-70.4	-58.1	0	0	0	114	E374 M375 Y437 R438	E374-H377 WeakPolarHBondContact O-CB 3.43Å; E374-H377 PolarHBondContact O-N 3.41Å; E374-H377 IonicContact OE2-CD2 3.04Å; E374-H377 PolarHBondContact OE2-CD2 3.31Å; E374-H377 IonicContact OE2-NE2 3.61Å; M375-H377 PolarHBondContact O-N 2.86Å; H377-Y437 HydrophobicContact CB-CD2 3.69Å; H377-Y437 HydrophobicContact CB-CE2 3.35Å; H377-Y437 AromaticContact CG-CE2 3.5Å; H377-Y437 VanDerWaalsContact CG-CE2 3.5Å; H377-Y437 AromaticContact CG-CZ 3.84Å; H377-Y437 AromaticContact ND1-CE2 3.96Å; H377-Y437 AromaticContact ND1-CZ 3.82Å; H377-Y437 CarbonylContact O-C 3.51Å; H377-Y437 WeakPolarHBondContact O-CA 3.3Å; H377-R438 PolarHBondContact ND1-O 2.97Å; H377-R438 PolarHBondContact O-N 3.49Å
378	F	98.1	Very high	98.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.			trans	-129.9	64.1	176.3	-54	-81.3	0	0	0	111.4	I373 E374 M375 E380 F381 F387 C433 W436 Y437	I373-F378 HydrophobicContact CG2-CD2 3.74Å; I373-F378 HydrophobicContact CG2-CE2 3.87Å; E374-F378 WeakPolarHBondContact O-CD2 3.46Å; M375-F378 CarbonylContact O-C 3.52Å; M375-F378 PolarHBondContact O-N 3.03Å; F378-E380 PolarHBondContact O-N 3.3Å; F378-F381 HydrophobicContact CB-CD2 3.55Å; F378-F381 HydrophobicContact CB-CE2 4.04Å; F378-F381 HydrophobicContact CD1-CE2 4.28Å; F378-F381 HydrophobicContact CG-CD2 4.28Å; F378-F381 HydrophobicContact CG-CE2 4.46Å; F378-F381 PolarHBondContact O-N 2.97Å; F378-F387 HydrophobicContact CD1-CE2 4.23Å; F378-F387 HydrophobicContact CD2-CE2 4.18Å; F378-F387 HydrophobicContact CE1-CE2 4.27Å; F378-F387 HydrophobicContact CE2-CE2 4.2Å; F378-F387 HydrophobicContact CG-CE2 4.18Å; F378-F387 HydrophobicContact CZ-CE2 4.25Å; F378-C433 HydrophobicContact CE1-CB 4.11Å; F378-C433 HydrophobicContact CZ-CB 4.21Å; F378-W436 HydrophobicContact CD1-CB 4.05Å; F378-Y437 HydrophobicContact CE1-CD2 4.14Å; F378-Y437 AromaticContact CZ-CD2 3.96Å; F378-Y437 HydrophobicContact CZ-CD2 3.96Å
379	P	97.1	Very high	98.1	Very high	85 Å²	85	38.8 Å²	38.8	55%	0.552	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.7	-171.3	27.4	-36.3	0	0	0	114.3	F381 R438	P379-F381 VanDerWaalsContact C-N 3.27Å; P379-R438 HydrophobicContact CG-CB 4.45Å; P379-R438 HydrophobicContact CG-CG 3.79Å
380	E	97.1	Very high	98.1	Very high	79 Å²	79	44.2 Å²	44.2	37%	0.369	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-15	173.6	-65.1	89.7	165.6	0	0	114.1	F378 W436 R438	F378-E380 PolarHBondContact O-N 3.3Å; E380-W436 HydrophobicContact CB-CE3 4.01Å; E380-W436 HydrophobicContact CB-CZ3 4.12Å; E380-W436 HydrophobicContact CG-CE3 3.88Å; E380-W436 HydrophobicContact CG-CZ3 3.81Å; E380-R438 IonicContact OE1-CZ 3.18Å; E380-R438 IonicContact OE1-NE 2.77Å; E380-R438 PolarHBondContact OE1-NE 3.15Å; E380-R438 IonicContact OE1-NH2 2.74Å; E380-R438 PolarHBondContact OE1-NH2 3.42Å
381	F	97.9	Very high	98	Very high	16 Å²	16	44.2 Å²	44.2	7%	0.07	22%	0.22	C	C	.	.			trans	-110.1	134.7	179.4	-50.6	-53.2	0	0	0	111.1	M375 F378 P379 D386 F387 R390 F432 W436	M375-F381 HydrophobicContact CE-CB 3.89Å; M375-F381 WeakPolarHBondContact CE-O 3.43Å; F378-F381 HydrophobicContact CB-CD2 3.55Å; F378-F381 HydrophobicContact CB-CE2 4.04Å; F378-F381 HydrophobicContact CD1-CE2 4.28Å; F378-F381 HydrophobicContact CG-CD2 4.28Å; F378-F381 HydrophobicContact CG-CE2 4.46Å; F378-F381 PolarHBondContact O-N 2.97Å; P379-F381 VanDerWaalsContact C-N 3.27Å; F381-D386 HydrophobicContact CB-CB 4.39Å; F381-F387 HydrophobicContact CB-CB 4.39Å; F381-F387 HydrophobicContact CD2-CB 4.28Å; F381-F387 AromaticContact CD2-CD2 3.44Å; F381-F387 HydrophobicContact CD2-CD2 3.44Å; F381-F387 VanDerWaalsContact CD2-CD2 3.44Å; F381-F387 HydrophobicContact CD2-CE2 4.19Å; F381-F387 HydrophobicContact CD2-CG 4.24Å; F381-F387 AromaticContact CE2-CD2 3.76Å; F381-F387 HydrophobicContact CE2-CD2 3.76Å; F381-F387 HydrophobicContact CE2-CE2 4.15Å; F381-F387 HydrophobicContact CG-CB 4.24Å; F381-F387 HydrophobicContact CG-CD2 4.23Å; F381-R390 HydrophobicContact CD1-CB 4.5Å; F381-R390 HydrophobicContact CE1-CB 3.74Å; F381-R390 HydrophobicContact CE1-CG 3.79Å; F381-R390 HydrophobicContact CZ-CB 4.33Å; F381-R390 HydrophobicContact CZ-CG 4.2Å; F381-F432 HydrophobicContact CE1-CZ 4.24Å; F381-F432 HydrophobicContact CE2-CE1 4.19Å; F381-F432 AromaticContact CE2-CZ 3.9Å; F381-F432 HydrophobicContact CE2-CZ 3.9Å; F381-F432 HydrophobicContact CZ-CE1 4.2Å; F381-F432 HydrophobicContact CZ-CE2 4.19Å; F381-F432 AromaticContact CZ-CZ 3.45Å; F381-F432 HydrophobicContact CZ-CZ 3.45Å; F381-F432 VanDerWaalsContact CZ-CZ 3.45Å; F381-W436 HydrophobicContact CE2-CB 3.8Å; F381-W436 HydrophobicContact CE2-CG 4Å; F381-W436 HydrophobicContact CZ-CB 3.96Å; F381-W436 AromaticContact CZ-CD1 3.93Å; F381-W436 AromaticContact CZ-CD2 3.86Å; F381-W436 HydrophobicContact CZ-CD2 3.86Å; F381-W436 HydrophobicContact CZ-CE3 4.39Å; F381-W436 AromaticContact CZ-CG 3.63Å; F381-W436 HydrophobicContact CZ-CG 3.63Å
382	Q	96.8	Very high	98	Very high	169 Å²	169	44.2 Å²	44.2	79%	0.79	22%	0.22	S	C	*	.	S	Bend	trans	-85.8	-24.7	-179.6	-54.9	-176.1	-8.9	0	0	112.7	D386	Q382-D386 VanDerWaalsContact CB-OD2 3.3Å; Q382-D386 WeakPolarHBondContact CB-OD2 3.43Å; Q382-D386 PolarHBondContact N-OD2 3.47Å
383	N	97.8	Very high	98	Very high	48 Å²	48	46.5 Å²	46.5	26%	0.257	23%	0.234	S	C	.	.	S	Bend	trans	-163.4	177.2	-176.4	55.6	63.6	0	0	0	110.4	V385 D386 F387	N383-V385 VanDerWaalsContact C-N 3.31Å; N383-V385 PolarHBondContact O-N 2.99Å; N383-V385 WeakPolarHBondContact OD1-CA 3.33Å; N383-V385 WeakPolarHBondContact OD1-CB 3.3Å; N383-V385 PolarHBondContact OD1-N 3.06Å; N383-D386 PolarHBondContact O-N 2.9Å; N383-D386 PolarHBondContact OD1-N 3.32Å; N383-F387 PolarHBondContact O-N 3.04Å; N383-F387 VanDerWaalsContact O-N 3.13Å
384	D	98.3	Very high	98	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-28.4	177.4	62.6	-31.7	0	0	0	114.3	I373 T388 P401 A402 S403 F410	I373-D384 HydrophobicContact CD1-CB 3.93Å; D384-T388 WeakPolarHBondContact O-CB 3.39Å; D384-T388 WeakPolarHBondContact O-CG2 3.34Å; D384-T388 PolarHBondContact O-N 3.14Å; D384-T388 PolarHBondContact O-OG1 3.01Å; D384-P401 HydrophobicContact CB-CB 4.22Å; D384-P401 WeakPolarHBondContact OD2-CB 3.23Å; D384-A402 PolarHBondContact OD2-N 3.13Å; D384-S403 WeakPolarHBondContact OD1-CB 3.48Å; D384-S403 PolarHBondContact OD1-OG 3.46Å; D384-S403 WeakPolarHBondContact OD2-CB 3.48Å; D384-S403 PolarHBondContact OD2-N 2.9Å; D384-S403 PolarHBondContact OD2-OG 3.34Å; D384-F410 WeakPolarHBondContact CB-O 3.47Å; D384-F410 VanDerWaalsContact OD2-O 3.1Å
385	V	98.1	Very high	98	Very high	27 Å²	27	45.7 Å²	45.7	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-50.4	174.5	-174.1	0	0	0	0	109.9	I54 M58 N383 F387 T388 E389 P401	I54-V385 HydrophobicContact CG2-CG1 4.19Å; I54-V385 HydrophobicContact CG2-CG2 3.96Å; M58-V385 HydrophobicContact CE-CG1 4.09Å; M58-V385 HydrophobicContact CG-CG1 3.76Å; M58-V385 HydrophobicContact SD-CG1 4.19Å; N383-V385 VanDerWaalsContact C-N 3.31Å; N383-V385 PolarHBondContact O-N 2.99Å; N383-V385 WeakPolarHBondContact OD1-CA 3.33Å; N383-V385 WeakPolarHBondContact OD1-CB 3.3Å; N383-V385 PolarHBondContact OD1-N 3.06Å; V385-F387 VanDerWaalsContact C-N 3.32Å; V385-F387 PolarHBondContact O-N 2.92Å; V385-T388 PolarHBondContact O-N 3.27Å; V385-T388 PolarHBondContact O-OG1 3.1Å; V385-T388 VanDerWaalsContact O-OG1 3.07Å; V385-E389 HydrophobicContact CG1-CG 4.49Å; V385-E389 WeakPolarHBondContact O-CB 3.42Å; V385-E389 WeakPolarHBondContact O-CG 3.37Å; V385-E389 PolarHBondContact O-N 3.05Å; V385-P401 HydrophobicContact CB-CB 4.48Å; V385-P401 HydrophobicContact CG2-CB 3.94Å; V385-P401 HydrophobicContact CG2-CG 4.07Å
386	D	97.6	Very high	98	Very high	49 Å²	49	44.3 Å²	44.3	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-59.3	-43.7	177.4	-71	-6.5	0	0	0	111.5	F381 Q382 N383 R390	F381-D386 HydrophobicContact CB-CB 4.39Å; Q382-D386 VanDerWaalsContact CB-OD2 3.3Å; Q382-D386 WeakPolarHBondContact CB-OD2 3.43Å; Q382-D386 PolarHBondContact N-OD2 3.47Å; N383-D386 PolarHBondContact O-N 2.9Å; N383-D386 PolarHBondContact OD1-N 3.32Å; D386-R390 WeakPolarHBondContact O-CB 3.43Å; D386-R390 PolarHBondContact O-N 3.17Å
387	F	98.6	Very high	98.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-51	176.9	-175.7	-78.4	0	0	0	111.2	L358 I373 F378 F381 N383 V385 R390 L391 F411 F432	L358-F387 HydrophobicContact CD2-CZ 4.27Å; I373-F387 HydrophobicContact CD1-CB 4.21Å; I373-F387 HydrophobicContact CD1-CD1 4.05Å; I373-F387 HydrophobicContact CD1-CD2 4.3Å; I373-F387 HydrophobicContact CD1-CG 3.94Å; I373-F387 HydrophobicContact CG2-CD2 3.99Å; I373-F387 HydrophobicContact CG2-CE2 3.93Å; F378-F387 HydrophobicContact CD1-CE2 4.23Å; F378-F387 HydrophobicContact CD2-CE2 4.18Å; F378-F387 HydrophobicContact CE1-CE2 4.27Å; F378-F387 HydrophobicContact CE2-CE2 4.2Å; F378-F387 HydrophobicContact CG-CE2 4.18Å; F378-F387 HydrophobicContact CZ-CE2 4.25Å; F381-F387 HydrophobicContact CB-CB 4.39Å; F381-F387 HydrophobicContact CD2-CB 4.28Å; F381-F387 AromaticContact CD2-CD2 3.44Å; F381-F387 HydrophobicContact CD2-CD2 3.44Å; F381-F387 VanDerWaalsContact CD2-CD2 3.44Å; F381-F387 HydrophobicContact CD2-CE2 4.19Å; F381-F387 HydrophobicContact CD2-CG 4.24Å; F381-F387 AromaticContact CE2-CD2 3.76Å; F381-F387 HydrophobicContact CE2-CD2 3.76Å; F381-F387 HydrophobicContact CE2-CE2 4.15Å; F381-F387 HydrophobicContact CG-CB 4.24Å; F381-F387 HydrophobicContact CG-CD2 4.23Å; N383-F387 PolarHBondContact O-N 3.04Å; N383-F387 VanDerWaalsContact O-N 3.13Å; V385-F387 VanDerWaalsContact C-N 3.32Å; V385-F387 PolarHBondContact O-N 2.92Å; F387-R390 PolarHBondContact O-N 3.43Å; F387-L391 WeakPolarHBondContact O-CB 3.48Å; F387-L391 PolarHBondContact O-N 3.34Å; F387-F411 HydrophobicContact CE1-CD1 4.41Å; F387-F411 HydrophobicContact CE1-CE1 4.06Å; F387-F432 HydrophobicContact CD1-CE1 4.19Å; F387-F432 HydrophobicContact CD2-CE1 4.2Å; F387-F432 HydrophobicContact CE1-CD1 4.29Å; F387-F432 AromaticContact CE1-CE1 3.81Å; F387-F432 HydrophobicContact CE1-CE1 3.81Å; F387-F432 AromaticContact CE2-CE1 3.82Å; F387-F432 HydrophobicContact CE2-CE1 3.82Å; F387-F432 HydrophobicContact CG-CE1 4.37Å; F387-F432 HydrophobicContact CZ-CD1 4.01Å; F387-F432 AromaticContact CZ-CE1 3.61Å; F387-F432 HydrophobicContact CZ-CE1 3.61Å
388	T	98.4	Very high	98.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-71.8	-33.5	-177.2	52.5	0	0	0	0	112.9	M58 D384 V385 L391 V392 C399 P401 F411	M58-T388 VanDerWaalsContact CE-OG1 3.3Å; M58-T388 WeakPolarHBondContact CE-OG1 3.43Å; D384-T388 WeakPolarHBondContact O-CB 3.39Å; D384-T388 WeakPolarHBondContact O-CG2 3.34Å; D384-T388 PolarHBondContact O-N 3.14Å; D384-T388 PolarHBondContact O-OG1 3.01Å; V385-T388 PolarHBondContact O-N 3.27Å; V385-T388 PolarHBondContact O-OG1 3.1Å; V385-T388 VanDerWaalsContact O-OG1 3.07Å; T388-L391 PolarHBondContact O-N 2.98Å; T388-V392 WeakPolarHBondContact O-CG2 3.39Å; T388-V392 PolarHBondContact O-N 3.28Å; T388-V392 VanDerWaalsContact O-N 3.08Å; T388-C399 HydrophobicContact CG2-CB 4.21Å; T388-P401 HydrophobicContact CG2-CB 4.37Å; T388-P401 WeakPolarHBondContact OG1-CD 3.39Å; T388-F411 HydrophobicContact CG2-CB 3.93Å; T388-F411 HydrophobicContact CG2-CG 4.46Å
389	E	98.1	Very high	98.1	Very high	39 Å²	39	35.9 Å²	35.9	18%	0.182	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-45.5	169.9	-77.9	-166.7	163.9	0	0	112	M58 K59 V385 L391 V392 T393	M58-E389 WeakPolarHBondContact CA-OE1 3.5Å; M58-E389 HydrophobicContact CB-CG 4.06Å; M58-E389 WeakPolarHBondContact CB-OE1 3.29Å; M58-E389 HydrophobicContact CE-CB 4.43Å; M58-E389 HydrophobicContact CE-CG 3.53Å; M58-E389 HydrophobicContact CG-CG 4.06Å; K59-E389 PolarHBondContact N-OE1 3.4Å; V385-E389 HydrophobicContact CG1-CG 4.49Å; V385-E389 WeakPolarHBondContact O-CB 3.42Å; V385-E389 WeakPolarHBondContact O-CG 3.37Å; V385-E389 PolarHBondContact O-N 3.05Å; E389-L391 VanDerWaalsContact C-N 3.34Å; E389-V392 PolarHBondContact O-N 2.88Å; E389-T393 PolarHBondContact O-N 3.1Å; E389-T393 PolarHBondContact O-OG1 2.91Å
390	R	98.3	Very high	98.1	Very high	113 Å²	113	32 Å²	32	43%	0.426	15%	0.153	S	C	.	.	H	α-helix	trans	-66.9	-39.8	-179.9	-168.1	62	50.2	177.6	3	111.2	F381 D386 F387 V392 T393 E394 F432	F381-R390 HydrophobicContact CD1-CB 4.5Å; F381-R390 HydrophobicContact CE1-CB 3.74Å; F381-R390 HydrophobicContact CE1-CG 3.79Å; F381-R390 HydrophobicContact CZ-CB 4.33Å; F381-R390 HydrophobicContact CZ-CG 4.2Å; D386-R390 WeakPolarHBondContact O-CB 3.43Å; D386-R390 PolarHBondContact O-N 3.17Å; F387-R390 PolarHBondContact O-N 3.43Å; R390-V392 VanDerWaalsContact C-N 3.31Å; R390-V392 PolarHBondContact O-N 3.1Å; R390-T393 PolarHBondContact O-N 3.3Å; R390-T393 VanDerWaalsContact O-N 3.1Å; R390-E394 WeakPolarHBondContact CD-OE1 3.41Å; R390-E394 HydrophobicContact CG-CG 4.38Å; R390-E394 WeakPolarHBondContact CG-OE1 3.28Å; R390-E394 PolarHBondContact O-N 3.45Å; R390-F432 HydrophobicContact CB-CE2 4.1Å; R390-F432 HydrophobicContact CB-CZ 3.96Å; R390-F432 HydrophobicContact CG-CE2 3.69Å; R390-F432 HydrophobicContact CG-CZ 3.99Å
391	L	98.7	Very high	98.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.2	-43.5	173.4	179.8	66.6	0	0	0	111.6	F387 T388 E389 Q395 S396 V397 I429 F432	F387-L391 WeakPolarHBondContact O-CB 3.48Å; F387-L391 PolarHBondContact O-N 3.34Å; T388-L391 PolarHBondContact O-N 2.98Å; E389-L391 VanDerWaalsContact C-N 3.34Å; L391-Q395 HydrophobicContact CD1-CB 3.94Å; L391-Q395 HydrophobicContact CD1-CG 3.86Å; L391-Q395 WeakPolarHBondContact O-CA 3.18Å; L391-Q395 VanDerWaalsContact O-CB 3.28Å; L391-Q395 WeakPolarHBondContact O-CB 3.47Å; L391-Q395 PolarHBondContact O-N 2.87Å; L391-S396 PolarHBondContact O-N 2.93Å; L391-V397 HydrophobicContact CD1-CB 4.47Å; L391-V397 HydrophobicContact CD2-CB 4.31Å; L391-V397 HydrophobicContact CD2-CG1 4.26Å; L391-V397 HydrophobicContact CG-CB 4.18Å; L391-V397 WeakPolarHBondContact CG-O 3.3Å; L391-I429 HydrophobicContact CD1-CG1 4.11Å; L391-I429 HydrophobicContact CD2-CG1 3.96Å; L391-F432 HydrophobicContact CB-CD1 4.39Å; L391-F432 HydrophobicContact CB-CE1 4.24Å; L391-F432 HydrophobicContact CB-CZ 4.36Å; L391-F432 HydrophobicContact CD1-CB 3.75Å; L391-F432 HydrophobicContact CD1-CD1 3.75Å; L391-F432 HydrophobicContact CD1-CD2 4.3Å; L391-F432 HydrophobicContact CD1-CE1 4.43Å; L391-F432 HydrophobicContact CD1-CG 3.66Å
392	V	98.4	Very high	98.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.3	-47.5	173.8	171.1	0	0	0	0	110.9	L60 P62 M68 T388 E389 R390 E394 S396 V397 F398	L60-V392 HydrophobicContact CB-CG1 4.38Å; L60-V392 HydrophobicContact CD2-CB 4.46Å; L60-V392 HydrophobicContact CD2-CG1 4.45Å; L60-V392 HydrophobicContact CD2-CG2 4.06Å; P62-V392 WeakPolarHBondContact CA-O 3.24Å; P62-V392 HydrophobicContact CB-CG1 4.44Å; M68-V392 HydrophobicContact CE-CG1 4.1Å; M68-V392 HydrophobicContact CE-CG2 4.32Å; M68-V392 HydrophobicContact SD-CG1 4.46Å; T388-V392 WeakPolarHBondContact O-CG2 3.39Å; T388-V392 PolarHBondContact O-N 3.28Å; T388-V392 VanDerWaalsContact O-N 3.08Å; E389-V392 PolarHBondContact O-N 2.88Å; R390-V392 VanDerWaalsContact C-N 3.31Å; R390-V392 PolarHBondContact O-N 3.1Å; V392-E394 VanDerWaalsContact C-N 3.31Å; V392-E394 PolarHBondContact O-N 2.9Å; V392-S396 VanDerWaalsContact O-CA 3.23Å; V392-S396 WeakPolarHBondContact O-CA 3.21Å; V392-S396 PolarHBondContact O-N 2.97Å; V392-V397 WeakPolarHBondContact CG2-O 3.09Å; V392-V397 PolarHBondContact N-O 3.42Å; V392-F398 HydrophobicContact CG2-CB 3.62Å; V392-F398 HydrophobicContact CG2-CD2 3.78Å; V392-F398 HydrophobicContact CG2-CG 3.97Å
393	T	97.9	Very high	98.2	Very high	51 Å²	51	20.8 Å²	20.8	31%	0.313	10%	0.104	S	C	.	.	H	α-helix	trans	-62.6	-36.6	-176	-55.3	0	0	0	0	113.1	I61 N63 E389 R390	I61-T393 VanDerWaalsContact O-CA 3.29Å; I61-T393 WeakPolarHBondContact O-CA 3.39Å; N63-T393 WeakPolarHBondContact CB-O 3.47Å; N63-T393 PolarHBondContact N-O 3.49Å; E389-T393 PolarHBondContact O-N 3.1Å; E389-T393 PolarHBondContact O-OG1 2.91Å; R390-T393 PolarHBondContact O-N 3.3Å; R390-T393 VanDerWaalsContact O-N 3.1Å
394	E	98.3	Very high	98.1	Very high	48 Å²	48	18.5 Å²	18.5	22%	0.224	9%	0.091	C	C	.	.	H	α-helix	trans	-97.6	-34	-174.5	-67.9	-178.1	-166.2	0	0	113.6	N63 R390 V392 F432 W436	N63-E394 PolarHBondContact ND2-O 3.34Å; R390-E394 WeakPolarHBondContact CD-OE1 3.41Å; R390-E394 HydrophobicContact CG-CG 4.38Å; R390-E394 WeakPolarHBondContact CG-OE1 3.28Å; R390-E394 PolarHBondContact O-N 3.45Å; V392-E394 VanDerWaalsContact C-N 3.31Å; V392-E394 PolarHBondContact O-N 2.9Å; E394-F432 HydrophobicContact CB-CD2 4.37Å; E394-F432 WeakPolarHBondContact OE2-CD2 3.47Å; E394-W436 VanDerWaalsContact OE1-CZ2 3.24Å; E394-W436 WeakPolarHBondContact OE1-CZ2 3.34Å; E394-W436 PolarHBondContact OE1-NE1 3.29Å; E394-W436 PolarHBondContact OE2-NE1 3.14Å
395	Q	98.6	Very high	98.1	Very high	16 Å²	16	18.7 Å²	18.7	8%	0.075	9%	0.092	C	C	.	.	H	α-helix	trans	-117.1	-9.5	-171.5	-60.3	-59.6	-31.5	0	0	114.5	L391 V397 R428 F432	L391-Q395 HydrophobicContact CD1-CB 3.94Å; L391-Q395 HydrophobicContact CD1-CG 3.86Å; L391-Q395 WeakPolarHBondContact O-CA 3.18Å; L391-Q395 VanDerWaalsContact O-CB 3.28Å; L391-Q395 WeakPolarHBondContact O-CB 3.47Å; L391-Q395 PolarHBondContact O-N 2.87Å; Q395-V397 HydrophobicContact CB-CG2 4.21Å; Q395-V397 PolarHBondContact O-N 2.79Å; Q395-R428 HydrophobicContact CB-CB 4.09Å; Q395-R428 HydrophobicContact CG-CB 4.35Å; Q395-R428 WeakPolarHBondContact CG-O 3.38Å; Q395-R428 VanDerWaalsContact O-CD 3.3Å; Q395-R428 WeakPolarHBondContact O-CD 3.29Å; Q395-R428 PolarHBondContact O-NH1 3.03Å; Q395-F432 HydrophobicContact CG-CB 3.72Å; Q395-F432 HydrophobicContact CG-CD2 4.39Å; Q395-F432 HydrophobicContact CG-CG 4.4Å
396	S	98.6	Very high	98	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.097	C	C	.	.			trans	53.8	38.5	-172	-51.2	0	0	0	0	112	N63 K66 M68 I69 L391 V392	N63-S396 WeakPolarHBondContact CA-OG 3.48Å; N63-S396 WeakPolarHBondContact CB-OG 3.4Å; N63-S396 PolarHBondContact N-OG 3.48Å; N63-S396 PolarHBondContact O-OG 3.41Å; K66-S396 VanDerWaalsContact O-CB 3.29Å; K66-S396 WeakPolarHBondContact O-CB 3.07Å; K66-S396 PolarHBondContact O-OG 3.31Å; M68-S396 CarbonylContact C-O 3.51Å; M68-S396 WeakPolarHBondContact CA-O 2.99Å; M68-S396 VanDerWaalsContact SD-O 3.38Å; I69-S396 PolarHBondContact N-O 3.45Å; L391-S396 PolarHBondContact O-N 2.93Å; V392-S396 VanDerWaalsContact O-CA 3.23Å; V392-S396 WeakPolarHBondContact O-CA 3.21Å; V392-S396 PolarHBondContact O-N 2.97Å
397	V	98.7	Very high	98	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.7	172.9	179.1	0	0	0	0	108.2	I69 L71 L391 V392 Q395 A425 R428 I429	I69-V397 WeakPolarHBondContact O-CA 3.43Å; L71-V397 HydrophobicContact CD1-CG1 3.96Å; L71-V397 HydrophobicContact CG-CG1 4.35Å; L391-V397 HydrophobicContact CD1-CB 4.47Å; L391-V397 HydrophobicContact CD2-CB 4.31Å; L391-V397 HydrophobicContact CD2-CG1 4.26Å; L391-V397 HydrophobicContact CG-CB 4.18Å; L391-V397 WeakPolarHBondContact CG-O 3.3Å; V392-V397 WeakPolarHBondContact CG2-O 3.09Å; V392-V397 PolarHBondContact N-O 3.42Å; Q395-V397 HydrophobicContact CB-CG2 4.21Å; Q395-V397 PolarHBondContact O-N 2.79Å; V397-A425 HydrophobicContact CG1-CB 4.12Å; V397-A425 HydrophobicContact CG2-CB 4.32Å; V397-R428 HydrophobicContact CG2-CB 3.83Å; V397-R428 HydrophobicContact CG2-CG 4.45Å; V397-I429 HydrophobicContact CG1-CD1 4.15Å; V397-I429 HydrophobicContact CG1-CG1 4.16Å
398	F	98.4	Very high	98	Very high	14 Å²	14	22.3 Å²	22.3	6%	0.061	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	102.4	-179.9	-176.9	-152.9	0	0	0	112.2	V55 M58 L60 M68 I69 L71 S72 V392	V55-F398 HydrophobicContact CG1-CE1 4.43Å; V55-F398 HydrophobicContact CG1-CZ 4.15Å; V55-F398 HydrophobicContact CG2-CZ 4.14Å; M58-F398 HydrophobicContact CE-CE2 4.08Å; M58-F398 HydrophobicContact SD-CE2 4.25Å; L60-F398 HydrophobicContact CD1-CD1 4.37Å; L60-F398 HydrophobicContact CD1-CE1 3.77Å; L60-F398 HydrophobicContact CD1-CE2 4.31Å; L60-F398 HydrophobicContact CD1-CZ 3.75Å; L60-F398 HydrophobicContact CD2-CD2 4.09Å; L60-F398 HydrophobicContact CD2-CE2 3.85Å; L60-F398 HydrophobicContact CD2-CZ 4.13Å; M68-F398 HydrophobicContact CE-CB 3.39Å; M68-F398 HydrophobicContact CE-CD1 4.32Å; M68-F398 HydrophobicContact CE-CG 4.19Å; I69-F398 PolarHBondContact O-N 2.94Å; L71-F398 CarbonylContact C-O 3.59Å; L71-F398 VanDerWaalsContact C-O 3.29Å; L71-F398 VanDerWaalsContact CA-O 3.28Å; L71-F398 WeakPolarHBondContact CA-O 3.42Å; L71-F398 WeakPolarHBondContact CB-O 3.48Å; L71-F398 PolarHBondContact N-O 2.99Å; S72-F398 PolarHBondContact N-O 3.08Å; S72-F398 VanDerWaalsContact N-O 3.13Å; S72-F398 WeakPolarHBondContact OG-CD1 3.45Å; S72-F398 WeakPolarHBondContact OG-CE1 3.47Å; V392-F398 HydrophobicContact CG2-CB 3.62Å; V392-F398 HydrophobicContact CG2-CD2 3.78Å; V392-F398 HydrophobicContact CG2-CG 3.97Å
399	C	98.4	Very high	98	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-91.4	149.8	165.2	-58.4	0	0	0	0	109.6	T388 P401 F411	T388-C399 HydrophobicContact CG2-CB 4.21Å; C399-P401 WeakPolarHBondContact O-CD 3.44Å; C399-F411 HydrophobicContact CB-CB 4.07Å; C399-F411 HydrophobicContact CB-CD2 3.49Å; C399-F411 VanDerWaalsContact CB-CD2 3.49Å; C399-F411 HydrophobicContact CB-CE2 4.13Å; C399-F411 HydrophobicContact CB-CG 3.93Å
400	L	98.2	Very high	98.1	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	118.5	-179.8	-174.4	66.3	0	0	0	109.8	I51 V55 A402 A404 F405 F411 R412	I51-L400 HydrophobicContact CG2-CD1 4.13Å; I51-L400 HydrophobicContact CG2-CD2 4.31Å; V55-L400 HydrophobicContact CG2-CD1 3.56Å; L400-A402 PolarHBondContact O-N 3.37Å; L400-A404 HydrophobicContact CG-CB 4.42Å; L400-F405 HydrophobicContact CD2-CE2 3.6Å; L400-F405 HydrophobicContact CD2-CZ 3.41Å; L400-F405 VanDerWaalsContact CD2-CZ 3.41Å; L400-F405 HydrophobicContact CG-CE2 4.22Å; L400-F405 HydrophobicContact CG-CZ 4.48Å; L400-F411 CarbonylContact O-C 3.42Å; L400-F411 VanDerWaalsContact O-CA 3.31Å; L400-F411 WeakPolarHBondContact O-CA 3.29Å; L400-F411 WeakPolarHBondContact O-CB 3.4Å; L400-R412 HydrophobicContact CB-CB 4.46Å; L400-R412 PolarHBondContact N-O 2.73Å; L400-R412 VanDerWaalsContact N-O 3.14Å; L400-R412 PolarHBondContact O-N 3.02Å
401	P	98.4	Very high	98.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	135.5	175.4	24.1	-34.1	0	0	0	110.8	I54 M58 D384 V385 T388 C399 S403 A404	I54-P401 HydrophobicContact CG2-CG 4Å; M58-P401 HydrophobicContact CE-CG 4.07Å; M58-P401 HydrophobicContact SD-CG 3.97Å; D384-P401 HydrophobicContact CB-CB 4.22Å; D384-P401 WeakPolarHBondContact OD2-CB 3.23Å; V385-P401 HydrophobicContact CB-CB 4.48Å; V385-P401 HydrophobicContact CG2-CB 3.94Å; V385-P401 HydrophobicContact CG2-CG 4.07Å; T388-P401 HydrophobicContact CG2-CB 4.37Å; T388-P401 WeakPolarHBondContact OG1-CD 3.39Å; C399-P401 WeakPolarHBondContact O-CD 3.44Å; P401-S403 VanDerWaalsContact C-N 3.26Å; P401-S403 PolarHBondContact O-N 3.45Å; P401-A404 WeakPolarHBondContact O-CB 3.28Å; P401-A404 PolarHBondContact O-N 2.95Å; P401-A404 VanDerWaalsContact O-N 3.13Å
402	A	98.1	Very high	98.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-78.2	-8.7	-174.4	0	0	0	0	0	114.2	M370 D384 L400 A404 F405 E406 Y407 F410	M370-A402 HydrophobicContact CE-CB 3.59Å; M370-A402 HydrophobicContact SD-CB 4.41Å; D384-A402 PolarHBondContact OD2-N 3.13Å; L400-A402 PolarHBondContact O-N 3.37Å; A402-A404 PolarHBondContact O-N 2.93Å; A402-A404 VanDerWaalsContact O-N 3.08Å; A402-F405 HydrophobicContact CB-CD2 4.43Å; A402-F405 CarbonylContact O-C 3.59Å; A402-F405 WeakPolarHBondContact O-CA 3.48Å; A402-F405 WeakPolarHBondContact O-CB 3.48Å; A402-F405 PolarHBondContact O-N 3.29Å; A402-E406 PolarHBondContact O-N 3.39Å; A402-Y407 CarbonylContact C-O 3.39Å; A402-Y407 WeakPolarHBondContact CB-O 3.24Å; A402-Y407 CarbonylContact O-C 3.47Å; A402-Y407 PolarHBondContact O-N 2.9Å; A402-F410 VanDerWaalsContact CB-C 3.48Å; A402-F410 HydrophobicContact CB-CB 3.45Å; A402-F410 VanDerWaalsContact CB-CB 3.45Å; A402-F410 WeakPolarHBondContact CB-O 3.25Å; A402-F410 PolarHBondContact N-O 3.2Å
403	S	97.4	Very high	98.1	Very high	28 Å²	28	20.2 Å²	20.2	20%	0.196	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-49.1	-29.2	158.8	-77.3	0	0	0	0	111.8	D384 P401 F405 E406	D384-S403 WeakPolarHBondContact OD1-CB 3.48Å; D384-S403 PolarHBondContact OD1-OG 3.46Å; D384-S403 WeakPolarHBondContact OD2-CB 3.48Å; D384-S403 PolarHBondContact OD2-N 2.9Å; D384-S403 PolarHBondContact OD2-OG 3.34Å; P401-S403 VanDerWaalsContact C-N 3.26Å; P401-S403 PolarHBondContact O-N 3.45Å; S403-F405 PolarHBondContact O-N 2.98Å; S403-E406 PolarHBondContact O-N 3.26Å; S403-E406 VanDerWaalsContact O-N 3.1Å
404	A	95.6	Very high	98.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-67.6	-15.6	173.7	0	0	0	0	0	114.5	I51 I54 L400 P401 A402	I51-A404 HydrophobicContact CB-CB 4.47Å; I51-A404 HydrophobicContact CG1-CB 3.98Å; I54-A404 HydrophobicContact CD1-CB 4.03Å; I54-A404 VanDerWaalsContact CD1-N 3.31Å; L400-A404 HydrophobicContact CG-CB 4.42Å; P401-A404 WeakPolarHBondContact O-CB 3.28Å; P401-A404 PolarHBondContact O-N 2.95Å; P401-A404 VanDerWaalsContact O-N 3.13Å; A402-A404 PolarHBondContact O-N 2.93Å; A402-A404 VanDerWaalsContact O-N 3.08Å
405	F	97	Very high	98.1	Very high	4 Å²	4	15.5 Å²	15.5	2%	0.018	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-113.5	18.8	175.6	-53	-66.1	0	0	0	111.7	I51 P162 G163 P215 L400 A402 S403 Y407 R412	I51-F405 HydrophobicContact CD1-CE1 3.83Å; I51-F405 HydrophobicContact CD1-CZ 4.26Å; I51-F405 HydrophobicContact CG1-CE1 4.26Å; P162-F405 WeakPolarHBondContact CA-O 3.27Å; P162-F405 HydrophobicContact CB-CB 3.94Å; G163-F405 WeakPolarHBondContact O-CD1 3.21Å; P215-F405 HydrophobicContact CB-CD1 4.47Å; P215-F405 HydrophobicContact CB-CD2 3.9Å; P215-F405 HydrophobicContact CB-CE1 4.38Å; P215-F405 HydrophobicContact CB-CE2 3.83Å; P215-F405 HydrophobicContact CB-CG 4.25Å; P215-F405 HydrophobicContact CB-CZ 4.07Å; P215-F405 HydrophobicContact CG-CB 4.19Å; P215-F405 HydrophobicContact CG-CD1 4.26Å; P215-F405 HydrophobicContact CG-CD2 3.83Å; P215-F405 HydrophobicContact CG-CE2 4.28Å; P215-F405 HydrophobicContact CG-CG 3.83Å; L400-F405 HydrophobicContact CD2-CE2 3.6Å; L400-F405 HydrophobicContact CD2-CZ 3.41Å; L400-F405 VanDerWaalsContact CD2-CZ 3.41Å; L400-F405 HydrophobicContact CG-CE2 4.22Å; L400-F405 HydrophobicContact CG-CZ 4.48Å; A402-F405 HydrophobicContact CB-CD2 4.43Å; A402-F405 CarbonylContact O-C 3.59Å; A402-F405 WeakPolarHBondContact O-CA 3.48Å; A402-F405 WeakPolarHBondContact O-CB 3.48Å; A402-F405 PolarHBondContact O-N 3.29Å; S403-F405 PolarHBondContact O-N 2.98Å; F405-Y407 PolarHBondContact O-N 2.94Å; F405-R412 HydrophobicContact CE2-CB 3.92Å; F405-R412 HydrophobicContact CE2-CG 4.48Å
406	E	96.9	Very high	98.1	Very high	58 Å²	58	14.9 Å²	14.9	27%	0.271	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	25.8	-178.6	-48	-75.6	148.8	0	0	113.5	R161 K168 L180 A402 S403	R161-E406 WeakPolarHBondContact CD-O 3.44Å; R161-E406 PolarHBondContact NE-O 3.22Å; R161-E406 PolarHBondContact NH1-O 2.99Å; R161-E406 PolarHBondContact NH2-O 2.93Å; K168-E406 HydrophobicContact CD-CG 4.46Å; K168-E406 IonicContact NZ-OE1 3.88Å; K168-E406 PolarHBondContact NZ-OE1 3.18Å; K168-E406 IonicContact NZ-OE2 3.7Å; K168-E406 PolarHBondContact NZ-OE2 2.68Å; L180-E406 HydrophobicContact CD1-CB 3.79Å; L180-E406 HydrophobicContact CD1-CG 4Å; A402-E406 PolarHBondContact O-N 3.39Å; S403-E406 PolarHBondContact O-N 3.26Å; S403-E406 VanDerWaalsContact O-N 3.1Å
407	Y	98	Very high	98.1	Very high	41 Å²	41	14.9 Å²	14.9	16%	0.161	8%	0.077	C	C	.	.			trans	-133.6	83.8	-178.5	-156.6	-99.5	0	0	0	110.5	R161 P162 P185 W189 A402 F405 F410	R161-Y407 HydrophobicContact CG-CD2 3.65Å; R161-Y407 HydrophobicContact CG-CE2 4.39Å; P162-Y407 HydrophobicContact CB-CG 4.07Å; P162-Y407 HydrophobicContact CG-CD1 4.26Å; P162-Y407 HydrophobicContact CG-CD2 4.42Å; P162-Y407 HydrophobicContact CG-CG 4.04Å; P185-Y407 WeakPolarHBondContact CG-OH 3.42Å; W189-Y407 HydrophobicContact CH2-CD1 4.22Å; W189-Y407 AromaticContact CH2-CE1 3.64Å; W189-Y407 HydrophobicContact CH2-CE1 3.64Å; W189-Y407 HydrophobicContact CZ3-CD1 4.38Å; W189-Y407 AromaticContact CZ3-CE1 3.73Å; W189-Y407 HydrophobicContact CZ3-CE1 3.73Å; W189-Y407 AromaticContact CZ3-CZ 3.83Å; A402-Y407 CarbonylContact C-O 3.39Å; A402-Y407 WeakPolarHBondContact CB-O 3.24Å; A402-Y407 CarbonylContact O-C 3.47Å; A402-Y407 PolarHBondContact O-N 2.9Å; F405-Y407 PolarHBondContact O-N 2.94Å; Y407-F410 HydrophobicContact CD1-CB 4.37Å; Y407-F410 AromaticContact CD1-CD2 3.68Å; Y407-F410 HydrophobicContact CD1-CD2 3.68Å; Y407-F410 HydrophobicContact CD1-CE2 4.17Å; Y407-F410 HydrophobicContact CD1-CG 4.02Å; Y407-F410 AromaticContact CE1-CD2 3.55Å; Y407-F410 HydrophobicContact CE1-CD2 3.55Å; Y407-F410 AromaticContact CE1-CE2 3.54Å; Y407-F410 HydrophobicContact CE1-CE2 3.54Å; Y407-F410 HydrophobicContact CE1-CG 4.16Å; Y407-F410 HydrophobicContact CE1-CZ 4.09Å
408	P	97.9	Very high	98	Very high	53 Å²	53	15.8 Å²	15.8	34%	0.344	8%	0.083	S	C	.	.			trans	-58.8	170.7	-178.4	-23.6	34.8	0	0	0	113.5	F410	P408-F410 PolarHBondContact O-N 2.66Å
409	D	98.6	Very high	98	Very high	69 Å²	69	19.6 Å²	19.6	37%	0.369	10%	0.101	S	C	.	.	S	Bend	trans	62.2	21.9	175.4	-49.6	-24.7	0	0	0	114.2	I373 M375	I373-D409 PolarHBondContact N-O 2.62Å; M375-D409 HydrophobicContact CG-CB 3.9Å; M375-D409 WeakPolarHBondContact CG-OD1 3.49Å
410	F	98.8	Very high	98	Very high	29 Å²	29	25.6 Å²	25.6	13%	0.127	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	162.6	172.4	-83.2	-108.6	0	0	0	110	P185 W189 M370 V371 G372 D384 A402 Y407 P408	P185-F410 HydrophobicContact CB-CZ 4.37Å; P185-F410 HydrophobicContact CG-CZ 4.2Å; W189-F410 AromaticContact CH2-CD1 4Å; W189-F410 HydrophobicContact CH2-CD1 4Å; W189-F410 AromaticContact CH2-CE1 3.59Å; W189-F410 HydrophobicContact CH2-CE1 3.59Å; W189-F410 AromaticContact CH2-CZ 3.94Å; W189-F410 HydrophobicContact CH2-CZ 3.94Å; W189-F410 HydrophobicContact CZ2-CD1 4.07Å; W189-F410 AromaticContact CZ2-CE1 3.61Å; W189-F410 HydrophobicContact CZ2-CE1 3.61Å; W189-F410 HydrophobicContact CZ2-CZ 4.33Å; M370-F410 HydrophobicContact CB-CD1 4.19Å; M370-F410 HydrophobicContact CE-CB 3.71Å; M370-F410 HydrophobicContact CE-CD1 4.05Å; M370-F410 HydrophobicContact CE-CG 4.14Å; V371-F410 CarbonylContact O-C 3.54Å; V371-F410 WeakPolarHBondContact O-CA 3.48Å; V371-F410 WeakPolarHBondContact O-CD1 3.38Å; G372-F410 VanDerWaalsContact N-CE1 3.3Å; D384-F410 WeakPolarHBondContact CB-O 3.47Å; D384-F410 VanDerWaalsContact OD2-O 3.1Å; A402-F410 VanDerWaalsContact CB-C 3.48Å; A402-F410 HydrophobicContact CB-CB 3.45Å; A402-F410 VanDerWaalsContact CB-CB 3.45Å; A402-F410 WeakPolarHBondContact CB-O 3.25Å; A402-F410 PolarHBondContact N-O 3.2Å; Y407-F410 HydrophobicContact CD1-CB 4.37Å; Y407-F410 AromaticContact CD1-CD2 3.68Å; Y407-F410 HydrophobicContact CD1-CD2 3.68Å; Y407-F410 HydrophobicContact CD1-CE2 4.17Å; Y407-F410 HydrophobicContact CD1-CG 4.02Å; Y407-F410 AromaticContact CE1-CD2 3.55Å; Y407-F410 HydrophobicContact CE1-CD2 3.55Å; Y407-F410 AromaticContact CE1-CE2 3.54Å; Y407-F410 HydrophobicContact CE1-CE2 3.54Å; Y407-F410 HydrophobicContact CE1-CG 4.16Å; Y407-F410 HydrophobicContact CE1-CZ 4.09Å; P408-F410 PolarHBondContact O-N 2.66Å
411	F	98.8	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.4	160.8	61.5	-97.8	0	0	0	111.1	L358 V371 I373 F387 T388 C399 L400 V413	L358-F411 HydrophobicContact CD1-CZ 4.37Å; L358-F411 HydrophobicContact CD2-CE1 4.04Å; L358-F411 HydrophobicContact CD2-CZ 4.5Å; V371-F411 HydrophobicContact CB-CD1 4.33Å; V371-F411 HydrophobicContact CB-CD2 4.01Å; V371-F411 HydrophobicContact CB-CE1 3.91Å; V371-F411 HydrophobicContact CB-CE2 3.57Å; V371-F411 HydrophobicContact CB-CG 4.39Å; V371-F411 HydrophobicContact CB-CZ 3.52Å; V371-F411 HydrophobicContact CG1-CE1 3.9Å; V371-F411 HydrophobicContact CG1-CE2 4.12Å; V371-F411 HydrophobicContact CG1-CZ 3.56Å; V371-F411 HydrophobicContact CG2-CD2 4.13Å; V371-F411 HydrophobicContact CG2-CE2 3.53Å; V371-F411 HydrophobicContact CG2-CZ 3.87Å; V371-F411 PolarHBondContact N-O 3.11Å; V371-F411 PolarHBondContact O-N 2.97Å; I373-F411 HydrophobicContact CD1-CD1 3.86Å; I373-F411 HydrophobicContact CD1-CE1 4.44Å; I373-F411 HydrophobicContact CG1-CD1 3.85Å; I373-F411 HydrophobicContact CG1-CE1 4.09Å; F387-F411 HydrophobicContact CE1-CD1 4.41Å; F387-F411 HydrophobicContact CE1-CE1 4.06Å; T388-F411 HydrophobicContact CG2-CB 3.93Å; T388-F411 HydrophobicContact CG2-CG 4.46Å; C399-F411 HydrophobicContact CB-CB 4.07Å; C399-F411 HydrophobicContact CB-CD2 3.49Å; C399-F411 VanDerWaalsContact CB-CD2 3.49Å; C399-F411 HydrophobicContact CB-CE2 4.13Å; C399-F411 HydrophobicContact CB-CG 3.93Å; L400-F411 CarbonylContact O-C 3.42Å; L400-F411 VanDerWaalsContact O-CA 3.31Å; L400-F411 WeakPolarHBondContact O-CA 3.29Å; L400-F411 WeakPolarHBondContact O-CB 3.4Å; F411-V413 HydrophobicContact CD2-CG2 3.84Å; F411-V413 HydrophobicContact CE2-CG2 3.64Å
412	R	98.8	Very high	98	Very high	9 Å²	9	28.1 Å²	28.1	3%	0.034	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.1	175.1	-168.6	-165.4	72.4	179.9	-5.3	110.8	S72 N214 P215 Y368 L369 M370 L400 F405	S72-R412 PolarHBondContact O-NH2 2.96Å; N214-R412 PolarHBondContact OD1-NH1 3.3Å; P215-R412 HydrophobicContact CB-CB 4.32Å; P215-R412 HydrophobicContact CB-CG 3.8Å; Y368-R412 HydrophobicContact CD1-CG 4.38Å; Y368-R412 HydrophobicContact CG-CG 4.47Å; L369-R412 WeakPolarHBondContact O-CA 3.48Å; M370-R412 HydrophobicContact SD-CB 3.8Å; M370-R412 HydrophobicContact SD-CG 4.15Å; L400-R412 HydrophobicContact CB-CB 4.46Å; L400-R412 PolarHBondContact N-O 2.73Å; L400-R412 VanDerWaalsContact N-O 3.14Å; L400-R412 PolarHBondContact O-N 3.02Å; F405-R412 HydrophobicContact CE2-CB 3.92Å; F405-R412 HydrophobicContact CE2-CG 4.48Å
413	V	98.8	Very high	98	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	138	169.9	174.7	0	0	0	0	109.7	L71 Y368 L369 V371 F411 M422	L71-V413 HydrophobicContact CB-CG1 4.28Å; L71-V413 HydrophobicContact CD1-CG1 3.99Å; L71-V413 HydrophobicContact CD1-CG2 4.47Å; Y368-V413 WeakPolarHBondContact CA-O 3.5Å; L369-V413 PolarHBondContact N-O 3.11Å; L369-V413 PolarHBondContact O-N 3.37Å; V371-V413 HydrophobicContact CG2-CG2 4.32Å; F411-V413 HydrophobicContact CD2-CG2 3.84Å; F411-V413 HydrophobicContact CE2-CG2 3.64Å; V413-M422 HydrophobicContact CG1-CE 3.97Å; V413-M422 HydrophobicContact CG1-SD 4.41Å
414	V	98.5	Very high	98.1	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	140.3	168.3	-55.2	0	0	0	0	110.8	L71 I73 Y368 V417 M422	L71-V414 WeakPolarHBondContact O-CG1 3.46Å; L71-V414 PolarHBondContact O-N 3.42Å; I73-V414 WeakPolarHBondContact O-CG1 3.36Å; Y368-V414 HydrophobicContact CD1-CB 4.4Å; Y368-V414 HydrophobicContact CD1-CG1 3.85Å; Y368-V414 HydrophobicContact CE1-CG1 3.79Å; V414-V417 HydrophobicContact CG2-CG1 4.03Å; V414-M422 WeakPolarHBondContact O-CE 3.34Å
415	L	98.6	Very high	98.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	S	Bend	trans	-99.2	13.3	-176.9	-58	175.7	0	0	0	112.9	L341 N344 A345 C348 P363 M367 L369 M422	L341-L415 HydrophobicContact CD2-CB 4.26Å; N344-L415 HydrophobicContact CB-CB 4.25Å; N344-L415 WeakPolarHBondContact CB-O 3.4Å; N344-L415 PolarHBondContact ND2-O 3.03Å; A345-L415 HydrophobicContact CB-CD1 3.82Å; C348-L415 HydrophobicContact CB-CD2 4.14Å; P363-L415 HydrophobicContact CG-CD1 3.86Å; M367-L415 PolarHBondContact O-N 2.95Å; L369-L415 HydrophobicContact CB-CD1 4.38Å; L369-L415 HydrophobicContact CB-CD2 4.08Å; L369-L415 HydrophobicContact CB-CG 4.43Å; L415-M422 HydrophobicContact CD2-CE 3.97Å
416	T	98.2	Very high	98.3	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.012	17%	0.17	C	C	.	.			trans	-100	-4.1	-170.8	52.6	0	0	0	0	113.5	P76 N81 L82 L341 M367	P76-T416 HydrophobicContact CB-CG2 3.75Å; N81-T416 PolarHBondContact ND2-O 3.34Å; N81-T416 PolarHBondContact OD1-O 2.78Å; L82-T416 HydrophobicContact CD1-CG2 3.98Å; L341-T416 HydrophobicContact CD2-CG2 3.7Å; M367-T416 HydrophobicContact CB-CG2 3.92Å; M367-T416 HydrophobicContact CG-CG2 3.98Å; M367-T416 HydrophobicContact SD-CG2 4.01Å
417	V	97.7	Very high	98.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.163	C	C	.	.	S	Bend	trans	-70.5	156.6	178	-55	0	0	0	0	111	L71 F79 N344 V414 L421 M422	L71-V417 HydrophobicContact CD2-CB 4.49Å; L71-V417 HydrophobicContact CD2-CG1 3.7Å; L71-V417 HydrophobicContact CD2-CG2 4.01Å; F79-V417 HydrophobicContact CD2-CB 4.47Å; F79-V417 HydrophobicContact CD2-CG1 4.08Å; F79-V417 HydrophobicContact CE1-CG1 4.48Å; F79-V417 HydrophobicContact CE2-CB 4.3Å; F79-V417 HydrophobicContact CE2-CG1 3.48Å; F79-V417 VanDerWaalsContact CE2-CG1 3.48Å; F79-V417 HydrophobicContact CZ-CG1 3.7Å; N344-V417 PolarHBondContact ND2-O 3.06Å; V414-V417 HydrophobicContact CG2-CG1 4.03Å; V417-L421 HydrophobicContact CB-CB 4.44Å; V417-L421 HydrophobicContact CG2-CB 4.46Å; V417-M422 HydrophobicContact CG2-CB 3.84Å; V417-M422 HydrophobicContact CG2-CE 3.92Å
418	P	98.1	Very high	98.4	Very high	19 Å²	19	31.2 Å²	31.2	12%	0.123	16%	0.159	C	C	.	.			trans	-51.9	143.1	166.6	-25.7	32.1	0	0	0	112.2	F79 N81 E420 L421 M422	F79-P418 HydrophobicContact CB-CG 4.14Å; N81-P418 HydrophobicContact CB-CG 4.19Å; P418-E420 VanDerWaalsContact C-N 3.27Å; P418-E420 HydrophobicContact CB-CG 4.45Å; P418-E420 WeakPolarHBondContact CB-OE1 3.45Å; P418-E420 WeakPolarHBondContact CB-OE2 3.45Å; P418-E420 PolarHBondContact O-N 3.1Å; P418-L421 HydrophobicContact CB-CG 4.41Å; P418-L421 HydrophobicContact CG-CD1 4.16Å; P418-L421 WeakPolarHBondContact O-CA 3.17Å; P418-L421 WeakPolarHBondContact O-CB 3.29Å; P418-L421 PolarHBondContact O-N 2.98Å; P418-M422 PolarHBondContact O-N 2.77Å
419	E	97.7	Very high	98.5	Very high	95 Å²	95	28.7 Å²	28.7	44%	0.444	14%	0.143	S	C	.	.	H	α-helix	trans	-56.5	-41.1	-173.6	-171.3	178.2	111.5	0	0	112.2	S343 N344 I347 L421 M422 L423	S343-E419 PolarHBondContact OG-OE2 3.32Å; N344-E419 WeakPolarHBondContact OD1-CA 3.29Å; I347-E419 HydrophobicContact CD1-CG 3.36Å; E419-L421 VanDerWaalsContact C-N 3.29Å; E419-L421 PolarHBondContact O-N 3.27Å; E419-M422 WeakPolarHBondContact O-CB 3.32Å; E419-M422 PolarHBondContact O-N 3.32Å; E419-M422 VanDerWaalsContact O-N 3.11Å; E419-L423 PolarHBondContact O-N 3.2Å
420	E	97.9	Very high	98.5	Very high	126 Å²	126	30 Å²	30	59%	0.589	14%	0.143	S	C	*	.	H	α-helix	trans	-62.9	-34.3	177.2	68	-80.6	-168.1	0	0	112.8	P418 E424	P418-E420 VanDerWaalsContact C-N 3.27Å; P418-E420 HydrophobicContact CB-CG 4.45Å; P418-E420 WeakPolarHBondContact CB-OE1 3.45Å; P418-E420 WeakPolarHBondContact CB-OE2 3.45Å; P418-E420 PolarHBondContact O-N 3.1Å; E420-E424 WeakPolarHBondContact O-CB 3.38Å; E420-E424 PolarHBondContact O-N 2.99Å; E420-E424 VanDerWaalsContact O-N 3.1Å
421	L	98.1	Very high	98.5	Very high	55 Å²	55	32.4 Å²	32.4	29%	0.288	16%	0.157	S	C	.	.	H	α-helix	trans	-76.2	-31.4	175.1	-68.3	-175.3	0	0	0	111.5	I69 F79 V417 P418 E419 A425	I69-L421 HydrophobicContact CD1-CD2 4.27Å; I69-L421 HydrophobicContact CG1-CD2 4.44Å; I69-L421 HydrophobicContact CG2-CB 4.45Å; F79-L421 HydrophobicContact CD1-CD1 4.17Å; F79-L421 HydrophobicContact CE1-CD1 4.16Å; V417-L421 HydrophobicContact CB-CB 4.44Å; V417-L421 HydrophobicContact CG2-CB 4.46Å; P418-L421 HydrophobicContact CB-CG 4.41Å; P418-L421 HydrophobicContact CG-CD1 4.16Å; P418-L421 WeakPolarHBondContact O-CA 3.17Å; P418-L421 WeakPolarHBondContact O-CB 3.29Å; P418-L421 PolarHBondContact O-N 2.98Å; E419-L421 VanDerWaalsContact C-N 3.29Å; E419-L421 PolarHBondContact O-N 3.27Å; L421-A425 WeakPolarHBondContact O-CB 3.46Å; L421-A425 PolarHBondContact O-N 2.76Å
422	M	98.6	Very high	98.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-49.2	172.5	-177.9	57.3	80.3	0	0	110.7	N344 I347 C348 V413 V414 L415 V417 P418 E419 A425 C426	N344-M422 HydrophobicContact CB-CE 4.23Å; I347-M422 HydrophobicContact CB-CG 4.43Å; I347-M422 HydrophobicContact CG2-CG 3.88Å; C348-M422 HydrophobicContact CB-CE 4.22Å; C348-M422 HydrophobicContact CB-CG 4.44Å; C348-M422 HydrophobicContact CB-SD 3.83Å; V413-M422 HydrophobicContact CG1-CE 3.97Å; V413-M422 HydrophobicContact CG1-SD 4.41Å; V414-M422 WeakPolarHBondContact O-CE 3.34Å; L415-M422 HydrophobicContact CD2-CE 3.97Å; V417-M422 HydrophobicContact CG2-CB 3.84Å; V417-M422 HydrophobicContact CG2-CE 3.92Å; P418-M422 PolarHBondContact O-N 2.77Å; E419-M422 WeakPolarHBondContact O-CB 3.32Å; E419-M422 PolarHBondContact O-N 3.32Å; E419-M422 VanDerWaalsContact O-N 3.11Å; M422-A425 PolarHBondContact O-N 2.96Å; M422-C426 WeakPolarHBondContact O-CB 3.23Å; M422-C426 PolarHBondContact O-N 3.31Å; M422-C426 PolarHBondContact O-SG 3.46Å
423	L	98.6	Very high	98.5	Very high	73 Å²	73	32.1 Å²	32.1	38%	0.382	16%	0.156	S	C	.	.	H	α-helix	trans	-59.4	-48.7	177.5	-75.8	166.1	0	0	0	112.1	I347 E419 A425 C426 G427	I347-L423 HydrophobicContact CG2-CD2 3.56Å; I347-L423 HydrophobicContact CG2-CG 3.97Å; E419-L423 PolarHBondContact O-N 3.2Å; L423-A425 PolarHBondContact O-N 2.99Å; L423-C426 PolarHBondContact O-N 3.24Å; L423-G427 PolarHBondContact O-N 3.11Å
424	E	98.7	Very high	98.4	Very high	89 Å²	89	42 Å²	42	42%	0.416	19%	0.193	S	C	.	.	H	α-helix	trans	-60.6	-44.6	177.7	174.7	66	-174.8	0	0	111.5	I69 E420 G427 R428	I69-E424 HydrophobicContact CD1-CB 4.13Å; I69-E424 HydrophobicContact CD1-CG 3.6Å; E420-E424 WeakPolarHBondContact O-CB 3.38Å; E420-E424 PolarHBondContact O-N 2.99Å; E420-E424 VanDerWaalsContact O-N 3.1Å; E424-G427 PolarHBondContact O-N 2.84Å; E424-R428 WeakPolarHBondContact O-CG 3.47Å; E424-R428 PolarHBondContact O-N 3.27Å; E424-R428 IonicContact OE1-CZ 3.13Å; E424-R428 IonicContact OE1-NE 3.33Å; E424-R428 PolarHBondContact OE1-NE 2.85Å; E424-R428 IonicContact OE1-NH2 2.71Å; E424-R428 PolarHBondContact OE1-NH2 2.76Å
425	A	98.7	Very high	98.4	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.1	-43	179.2	0	0	0	0	0	112.2	I69 L71 V397 L421 M422 L423 G427 R428 I429	I69-A425 HydrophobicContact CD1-CB 4.25Å; I69-A425 HydrophobicContact CG2-CB 4.03Å; L71-A425 HydrophobicContact CD1-CB 3.72Å; L71-A425 HydrophobicContact CD2-CB 4.43Å; L71-A425 HydrophobicContact CG-CB 4.31Å; V397-A425 HydrophobicContact CG1-CB 4.12Å; V397-A425 HydrophobicContact CG2-CB 4.32Å; L421-A425 WeakPolarHBondContact O-CB 3.46Å; L421-A425 PolarHBondContact O-N 2.76Å; M422-A425 PolarHBondContact O-N 2.96Å; L423-A425 PolarHBondContact O-N 2.99Å; A425-G427 VanDerWaalsContact C-N 3.32Å; A425-G427 PolarHBondContact O-N 3.32Å; A425-R428 PolarHBondContact O-N 3.34Å; A425-I429 VanDerWaalsContact O-CG1 3.27Å; A425-I429 WeakPolarHBondContact O-CG1 3.3Å; A425-I429 PolarHBondContact O-N 2.8Å
426	C	98.8	Very high	98.4	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-42	175.1	-67.3	0	0	0	0	111.5	E351 L352 M422 L423 R428 I429 R430	E351-C426 HydrophobicContact CB-CB 3.63Å; E351-C426 HydrophobicContact CG-CB 4.05Å; L352-C426 HydrophobicContact CD2-CB 4.28Å; M422-C426 WeakPolarHBondContact O-CB 3.23Å; M422-C426 PolarHBondContact O-N 3.31Å; M422-C426 PolarHBondContact O-SG 3.46Å; L423-C426 PolarHBondContact O-N 3.24Å; C426-R428 VanDerWaalsContact C-N 3.35Å; C426-R428 PolarHBondContact O-N 3.32Å; C426-I429 PolarHBondContact O-N 2.87Å; C426-R430 WeakPolarHBondContact O-CB 3.37Å; C426-R430 PolarHBondContact O-N 2.97Å
427	G	98.8	Very high	98.4	Very high	11 Å²	11	51.1 Å²	51.1	11%	0.113	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-43.6	175	0	0	0	0	0	112.9	L423 E424 A425 R430 D431	L423-G427 PolarHBondContact O-N 3.11Å; E424-G427 PolarHBondContact O-N 2.84Å; A425-G427 VanDerWaalsContact C-N 3.32Å; A425-G427 PolarHBondContact O-N 3.32Å; G427-R430 WeakPolarHBondContact O-CB 3.36Å; G427-R430 PolarHBondContact O-N 2.94Å; G427-D431 PolarHBondContact O-N 3.35Å
428	R	98.8	Very high	98.3	Very high	22 Å²	22	55.7 Å²	55.7	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-38	176	-72.2	-174.3	-169.8	176.7	13.8	113.5	P67 Q395 V397 E424 A425 C426 D431 F432	P67-R428 PolarHBondContact O-NH1 3.37Å; Q395-R428 HydrophobicContact CB-CB 4.09Å; Q395-R428 HydrophobicContact CG-CB 4.35Å; Q395-R428 WeakPolarHBondContact CG-O 3.38Å; Q395-R428 VanDerWaalsContact O-CD 3.3Å; Q395-R428 WeakPolarHBondContact O-CD 3.29Å; Q395-R428 PolarHBondContact O-NH1 3.03Å; V397-R428 HydrophobicContact CG2-CB 3.83Å; V397-R428 HydrophobicContact CG2-CG 4.45Å; E424-R428 WeakPolarHBondContact O-CG 3.47Å; E424-R428 PolarHBondContact O-N 3.27Å; E424-R428 IonicContact OE1-CZ 3.13Å; E424-R428 IonicContact OE1-NE 3.33Å; E424-R428 PolarHBondContact OE1-NE 2.85Å; E424-R428 IonicContact OE1-NH2 2.71Å; E424-R428 PolarHBondContact OE1-NH2 2.76Å; A425-R428 PolarHBondContact O-N 3.34Å; C426-R428 VanDerWaalsContact C-N 3.35Å; C426-R428 PolarHBondContact O-N 3.32Å; R428-D431 PolarHBondContact O-N 2.93Å; R428-F432 WeakPolarHBondContact O-CB 3.4Å; R428-F432 PolarHBondContact O-N 3.38Å
429	I	98.9	Very high	98	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-45	174.1	-69.9	162.8	0	0	0	109.9	L71 L352 L358 L391 V397 A425 C426 D431 F432 C433	L71-I429 HydrophobicContact CD1-CD1 4.36Å; L352-I429 HydrophobicContact CD2-CB 4.08Å; L352-I429 HydrophobicContact CD2-CD1 4.29Å; L352-I429 HydrophobicContact CD2-CG2 3.73Å; L358-I429 HydrophobicContact CD1-CG2 3.75Å; L391-I429 HydrophobicContact CD1-CG1 4.11Å; L391-I429 HydrophobicContact CD2-CG1 3.96Å; V397-I429 HydrophobicContact CG1-CD1 4.15Å; V397-I429 HydrophobicContact CG1-CG1 4.16Å; A425-I429 VanDerWaalsContact O-CG1 3.27Å; A425-I429 WeakPolarHBondContact O-CG1 3.3Å; A425-I429 PolarHBondContact O-N 2.8Å; C426-I429 PolarHBondContact O-N 2.87Å; I429-D431 PolarHBondContact O-N 2.94Å; I429-F432 WeakPolarHBondContact O-CB 3.31Å; I429-F432 PolarHBondContact O-N 3.03Å; I429-C433 PolarHBondContact O-N 2.82Å; I429-C433 PolarHBondContact O-SG 3.34Å
430	R	98.8	Very high	97.4	Very high	96 Å²	96	58.8 Å²	58.8	36%	0.362	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-46.9	175.3	173.8	176.8	57.6	-125.7	-1.4	112	E351 V355 C426 G427 F432 C433 R434	E351-R430 IonicContact OE2-CZ 3.19Å; E351-R430 IonicContact OE2-NH1 2.64Å; E351-R430 PolarHBondContact OE2-NH1 2.89Å; E351-R430 IonicContact OE2-NH2 3.18Å; V355-R430 HydrophobicContact CG2-CB 3.69Å; V355-R430 HydrophobicContact CG2-CG 3.97Å; C426-R430 WeakPolarHBondContact O-CB 3.37Å; C426-R430 PolarHBondContact O-N 2.97Å; G427-R430 WeakPolarHBondContact O-CB 3.36Å; G427-R430 PolarHBondContact O-N 2.94Å; R430-F432 VanDerWaalsContact C-N 3.32Å; R430-F432 PolarHBondContact O-N 2.85Å; R430-C433 PolarHBondContact O-N 2.74Å; R430-R434 WeakPolarHBondContact O-CB 3.49Å; R430-R434 PolarHBondContact O-N 2.95Å
431	D	98.6	Very high	96.2	Very high	81 Å²	81	57.3 Å²	57.3	43%	0.433	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-39.7	178.7	-74.4	-13.3	0	0	0	112	G427 R428 I429 R434 V435	G427-D431 PolarHBondContact O-N 3.35Å; R428-D431 PolarHBondContact O-N 2.93Å; I429-D431 PolarHBondContact O-N 2.94Å; D431-R434 PolarHBondContact O-N 3.17Å; D431-V435 WeakPolarHBondContact O-CG2 3.2Å; D431-V435 PolarHBondContact O-N 3.1Å
432	F	98.7	Very high	94.2	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-52.6	173.3	173.6	-103.3	0	0	0	112	F381 F387 R390 L391 E394 Q395 R428 I429 R430 R434 V435 W436	F381-F432 HydrophobicContact CE1-CZ 4.24Å; F381-F432 HydrophobicContact CE2-CE1 4.19Å; F381-F432 AromaticContact CE2-CZ 3.9Å; F381-F432 HydrophobicContact CE2-CZ 3.9Å; F381-F432 HydrophobicContact CZ-CE1 4.2Å; F381-F432 HydrophobicContact CZ-CE2 4.19Å; F381-F432 AromaticContact CZ-CZ 3.45Å; F381-F432 HydrophobicContact CZ-CZ 3.45Å; F381-F432 VanDerWaalsContact CZ-CZ 3.45Å; F387-F432 HydrophobicContact CD1-CE1 4.19Å; F387-F432 HydrophobicContact CD2-CE1 4.2Å; F387-F432 HydrophobicContact CE1-CD1 4.29Å; F387-F432 AromaticContact CE1-CE1 3.81Å; F387-F432 HydrophobicContact CE1-CE1 3.81Å; F387-F432 AromaticContact CE2-CE1 3.82Å; F387-F432 HydrophobicContact CE2-CE1 3.82Å; F387-F432 HydrophobicContact CG-CE1 4.37Å; F387-F432 HydrophobicContact CZ-CD1 4.01Å; F387-F432 AromaticContact CZ-CE1 3.61Å; F387-F432 HydrophobicContact CZ-CE1 3.61Å; R390-F432 HydrophobicContact CB-CE2 4.1Å; R390-F432 HydrophobicContact CB-CZ 3.96Å; R390-F432 HydrophobicContact CG-CE2 3.69Å; R390-F432 HydrophobicContact CG-CZ 3.99Å; L391-F432 HydrophobicContact CB-CD1 4.39Å; L391-F432 HydrophobicContact CB-CE1 4.24Å; L391-F432 HydrophobicContact CB-CZ 4.36Å; L391-F432 HydrophobicContact CD1-CB 3.75Å; L391-F432 HydrophobicContact CD1-CD1 3.75Å; L391-F432 HydrophobicContact CD1-CD2 4.3Å; L391-F432 HydrophobicContact CD1-CE1 4.43Å; L391-F432 HydrophobicContact CD1-CG 3.66Å; E394-F432 HydrophobicContact CB-CD2 4.37Å; E394-F432 WeakPolarHBondContact OE2-CD2 3.47Å; Q395-F432 HydrophobicContact CG-CB 3.72Å; Q395-F432 HydrophobicContact CG-CD2 4.39Å; Q395-F432 HydrophobicContact CG-CG 4.4Å; R428-F432 WeakPolarHBondContact O-CB 3.4Å; R428-F432 PolarHBondContact O-N 3.38Å; I429-F432 WeakPolarHBondContact O-CB 3.31Å; I429-F432 PolarHBondContact O-N 3.03Å; R430-F432 VanDerWaalsContact C-N 3.32Å; R430-F432 PolarHBondContact O-N 2.85Å; F432-R434 VanDerWaalsContact C-N 3.26Å; F432-R434 PolarHBondContact O-N 3.07Å; F432-V435 PolarHBondContact O-N 3.35Å; F432-V435 VanDerWaalsContact O-N 3.1Å; F432-W436 AromaticContact CD2-CD1 3.52Å; F432-W436 AromaticContact CD2-NE1 3.72Å; F432-W436 AromaticContact CE2-CD1 3.23Å; F432-W436 HydrophobicContact CE2-CG 4.32Å; F432-W436 AromaticContact CE2-NE1 3.32Å; F432-W436 VanDerWaalsContact CE2-NE1 3.32Å; F432-W436 AromaticContact CZ-CD1 3.67Å; F432-W436 HydrophobicContact CZ-CG 4.45Å; F432-W436 VanDerWaalsContact O-CD1 3.28Å; F432-W436 PolarHBondContact O-N 2.96Å
433	C	98.6	Very high	92.1	Very high	2 Å²	2	68.3 Å²	68.3	1%	0.014	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-37.8	-179.9	-63.1	0	0	0	0	111.1	V355 F378 I429 R430 V435 W436 Y437	V355-C433 HydrophobicContact CG1-CB 3.36Å; F378-C433 HydrophobicContact CE1-CB 4.11Å; F378-C433 HydrophobicContact CZ-CB 4.21Å; I429-C433 PolarHBondContact O-N 2.82Å; I429-C433 PolarHBondContact O-SG 3.34Å; R430-C433 PolarHBondContact O-N 2.74Å; C433-V435 PolarHBondContact O-N 3.47Å; C433-W436 PolarHBondContact O-N 3.26Å; C433-Y437 WeakPolarHBondContact O-CA 3.27Å; C433-Y437 WeakPolarHBondContact O-CB 3.49Å; C433-Y437 PolarHBondContact O-N 3.04Å
434	R	97.7	Very high	89.6	Confident	209 Å²	209	68 Å²	68	79%	0.789	37%	0.369	S	S	*	.	H	α-helix	trans	-59.2	-31.4	177.1	-175.2	177.1	178.7	179.4	1.6	113.7	R430 D431 F432	R430-R434 WeakPolarHBondContact O-CB 3.49Å; R430-R434 PolarHBondContact O-N 2.95Å; D431-R434 PolarHBondContact O-N 3.17Å; F432-R434 VanDerWaalsContact C-N 3.26Å; F432-R434 PolarHBondContact O-N 3.07Å
435	V	98	Very high	87.2	Confident	85 Å²	85	71 Å²	71	52%	0.515	39%	0.388	S	S	.	.	H	α-helix	trans	-75.9	-43	178	173.4	0	0	0	0	111	D431 F432 C433 R438	D431-V435 WeakPolarHBondContact O-CG2 3.2Å; D431-V435 PolarHBondContact O-N 3.1Å; F432-V435 PolarHBondContact O-N 3.35Å; F432-V435 VanDerWaalsContact O-N 3.1Å; C433-V435 PolarHBondContact O-N 3.47Å; V435-R438 PolarHBondContact O-NH1 2.97Å
436	W	98.1	Very high	84.6	Confident	58 Å²	58	79.3 Å²	79.3	22%	0.22	43%	0.432	C	S	.	.	H	α-helix	trans	-94.5	-19.7	-169.8	-64.8	108.8	0	0	0	114.2	F378 E380 F381 E394 F432 C433	F378-W436 HydrophobicContact CD1-CB 4.05Å; E380-W436 HydrophobicContact CB-CE3 4.01Å; E380-W436 HydrophobicContact CB-CZ3 4.12Å; E380-W436 HydrophobicContact CG-CE3 3.88Å; E380-W436 HydrophobicContact CG-CZ3 3.81Å; F381-W436 HydrophobicContact CE2-CB 3.8Å; F381-W436 HydrophobicContact CE2-CG 4Å; F381-W436 HydrophobicContact CZ-CB 3.96Å; F381-W436 AromaticContact CZ-CD1 3.93Å; F381-W436 AromaticContact CZ-CD2 3.86Å; F381-W436 HydrophobicContact CZ-CD2 3.86Å; F381-W436 HydrophobicContact CZ-CE3 4.39Å; F381-W436 AromaticContact CZ-CG 3.63Å; F381-W436 HydrophobicContact CZ-CG 3.63Å; E394-W436 VanDerWaalsContact OE1-CZ2 3.24Å; E394-W436 WeakPolarHBondContact OE1-CZ2 3.34Å; E394-W436 PolarHBondContact OE1-NE1 3.29Å; E394-W436 PolarHBondContact OE2-NE1 3.14Å; F432-W436 AromaticContact CD2-CD1 3.52Å; F432-W436 AromaticContact CD2-NE1 3.72Å; F432-W436 AromaticContact CE2-CD1 3.23Å; F432-W436 HydrophobicContact CE2-CG 4.32Å; F432-W436 AromaticContact CE2-NE1 3.32Å; F432-W436 VanDerWaalsContact CE2-NE1 3.32Å; F432-W436 AromaticContact CZ-CD1 3.67Å; F432-W436 HydrophobicContact CZ-CG 4.45Å; F432-W436 VanDerWaalsContact O-CD1 3.28Å; F432-W436 PolarHBondContact O-N 2.96Å; C433-W436 PolarHBondContact O-N 3.26Å
437	Y	97.9	Very high	82.1	Confident	51 Å²	51	86.7 Å²	86.7	20%	0.2	47%	0.471	C	S	.	.			trans	-62.2	137.6	180	-176.2	-94.6	0	0	0	111.4	P356 H377 F378 C433 P439	P356-Y437 VanDerWaalsContact C-CE2 3.47Å; P356-Y437 HydrophobicContact CB-CD1 4.2Å; P356-Y437 HydrophobicContact CB-CD2 3.91Å; P356-Y437 HydrophobicContact CB-CE1 3.92Å; P356-Y437 HydrophobicContact CB-CE2 3.62Å; P356-Y437 HydrophobicContact CB-CG 4.21Å; P356-Y437 VanDerWaalsContact O-CD2 3.28Å; P356-Y437 WeakPolarHBondContact O-CD2 3.44Å; H377-Y437 HydrophobicContact CB-CD2 3.69Å; H377-Y437 HydrophobicContact CB-CE2 3.35Å; H377-Y437 AromaticContact CG-CE2 3.5Å; H377-Y437 VanDerWaalsContact CG-CE2 3.5Å; H377-Y437 AromaticContact CG-CZ 3.84Å; H377-Y437 AromaticContact ND1-CE2 3.96Å; H377-Y437 AromaticContact ND1-CZ 3.82Å; H377-Y437 CarbonylContact O-C 3.51Å; H377-Y437 WeakPolarHBondContact O-CA 3.3Å; F378-Y437 HydrophobicContact CE1-CD2 4.14Å; F378-Y437 AromaticContact CZ-CD2 3.96Å; F378-Y437 HydrophobicContact CZ-CD2 3.96Å; C433-Y437 WeakPolarHBondContact O-CA 3.27Å; C433-Y437 WeakPolarHBondContact O-CB 3.49Å; C433-Y437 PolarHBondContact O-N 3.04Å; Y437-P439 HydrophobicContact CE1-CB 4.18Å
438	R	97.3	Very high	79.8	Confident	97 Å²	97	94 Å²	94	37%	0.366	51%	0.507	S	S	.	.			trans	-119.2	117.8	172.4	-59.7	-63.2	172.5	-107.1	-1.5	108.3	H377 P379 E380 V435	H377-R438 PolarHBondContact ND1-O 2.97Å; H377-R438 PolarHBondContact O-N 3.49Å; P379-R438 HydrophobicContact CG-CB 4.45Å; P379-R438 HydrophobicContact CG-CG 3.79Å; E380-R438 IonicContact OE1-CZ 3.18Å; E380-R438 IonicContact OE1-NE 2.77Å; E380-R438 PolarHBondContact OE1-NE 3.15Å; E380-R438 IonicContact OE1-NH2 2.74Å; E380-R438 PolarHBondContact OE1-NH2 3.42Å; V435-R438 PolarHBondContact O-NH1 2.97Å
439	P	90.9	Very high	76.9	Confident	92 Å²	92	106 Å²	106	60%	0.597	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-61.1	155.8	175.4	27.7	-33.5	0	0	0	110	Y437 S441	Y437-P439 HydrophobicContact CE1-CB 4.18Å; P439-S441 PolarHBondContact O-N 3.11Å
440	P	85.5	Confident	75.8	Confident	87 Å²	87	111.3 Å²	111.3	57%	0.565	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-53.6	133.6	175.3	0.3	2	0	0	0	109.5	C442	P440-C442 PolarHBondContact O-N 3.48Å; P440-C442 VanDerWaalsContact O-N 3.17Å
441	S	73.1	Confident	74.6	Confident	95 Å²	95	112.1 Å²	112.1	66%	0.664	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59.5	120.2	174.3	49.4	0	0	0	0	108.9	P439 D443	P439-S441 PolarHBondContact O-N 3.11Å; S441-D443 PolarHBondContact O-N 2.77Å
442	C	55.1	Low	73.3	Confident	132 Å²	132	113.8 Å²	113.8	89%	0.892	61%	0.614	S	S	*	*			trans	-70.9	59.7	169.6	-64.4	0	0	0	0	110.6	P440	P440-C442 PolarHBondContact O-N 3.48Å; P440-C442 VanDerWaalsContact O-N 3.17Å
443	D	55.4	Low	71.8	Confident	153 Å²	153	120.5 Å²	120.5	82%	0.818	65%	0.65	S	S	*	*			trans	-108.4	88.5	173.6	-77.3	-30.5	0	0	0	108.7	S441	S441-D443 PolarHBondContact O-N 2.77Å
444	G	45.2	Very low	70.1	Confident	67 Å²	67	127.9 Å²	127.9	69%	0.691	69%	0.69	S	S	*	*	S	Bend	trans	-167.5	77.8	178	0	0	0	0	0	112.4
445	N	48.2	Very low	68.3	Low	152 Å²	152	122.5 Å²	122.5	81%	0.813	68%	0.683	S	S	*	*			trans	45.5	85.5	152.4	-65.6	-13.5	0	0	0	119.1
446	D	43.8	Very low	66.2	Low	174 Å²	174	125.2 Å²	125.2	93%	0.93	70%	0.695	S	S	*	*			trans	-108.9	70.1	140.8	-94.4	-25.2	0	0	0	108.4
447	L	48	Very low	63.7	Low	157 Å²	157	130.4 Å²	130.4	82%	0.822	73%	0.732	S	S	*	*			trans	-136.4	78.2	161.8	-82.6	172.8	0	0	0	107
448	D	48.8	Very low	60.9	Low	164 Å²	164	137 Å²	137	88%	0.877	78%	0.776	S	S	*	*			trans	-177.5	84.7	145.5	-96.8	-12.9	0	0	0	109.4
449	Q	39.2	Very low	57.6	Low	274 Å²	274	140.6 Å²	140.6	100%	1.28	81%	0.814	S	S	*	*			trans	-149.2	0	141.2	-74.7	-157.8	-0.2	0	0	110.5

Retrieved 449 of 449 residues in 326.1 ms (Link to these results)

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