G4VJE5_SCHMA Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession G4VJE5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 403 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.8	Very low	37.3	Very low	248 Å²	248	158.5 Å²	158.5	100%	1.222	87%	0.867	S	S	*	*				0	106.1	0	-81.2	168.1	141.8	0	0	108
2	N	31.5	Very low	37.7	Very low	171 Å²	171	163 Å²	163	91%	0.914	87%	0.871	S	S	*	*			trans	-80.1	134.8	179.5	-76.3	-23.8	0	0	0	109.9
3	S	37.8	Very low	37.3	Very low	114 Å²	114	155.6 Å²	155.6	80%	0.797	86%	0.857	S	S	*	*			trans	-147.9	104	151	73	0	0	0	0	111
4	T	34.8	Very low	37.5	Very low	134 Å²	134	156.2 Å²	156.2	82%	0.822	86%	0.856	S	S	*	*			trans	-55.9	143	159.7	33.1	0	0	0	0	112.5
5	F	42.3	Very low	37.4	Very low	207 Å²	207	156.4 Å²	156.4	91%	0.908	85%	0.853	S	S	*	*			trans	-129.3	111.4	154.8	-116.7	-92.1	0	0	0	109.7
6	K	31.4	Very low	37.8	Very low	203 Å²	203	156.4 Å²	156.4	88%	0.883	85%	0.85	S	S	*	*			trans	-86.9	141.4	159.9	-93.4	178.1	173.6	177	0	107.4
7	S	40.4	Very low	37.7	Very low	110 Å²	110	153 Å²	153	77%	0.769	84%	0.838	S	S	*	*			trans	-149.8	115.2	153.7	175.6	0	0	0	0	109
8	S	31.9	Very low	37.6	Very low	103 Å²	103	151.1 Å²	151.1	72%	0.72	84%	0.837	S	S	*	*			trans	-85.7	141.5	168.7	49.8	0	0	0	0	109.8
9	L	40.8	Very low	37.8	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	84%	0.84	S	S	*	*			trans	-134	120.6	157.9	-101.5	154.7	0	0	0	110
10	L	34.5	Very low	37.9	Very low	149 Å²	149	153.4 Å²	153.4	78%	0.78	84%	0.841	S	S	*	*			trans	-84.4	140.6	173.2	-79.1	148.7	0	0	0	109.9
11	T	41.6	Very low	38.1	Very low	134 Å²	134	151.5 Å²	151.5	82%	0.822	84%	0.836	S	S	*	*			trans	-162.8	102.5	146.7	27.3	0	0	0	0	106.2
12	K	41.4	Very low	37.8	Very low	212 Å²	212	147.2 Å²	147.2	92%	0.922	82%	0.817	S	S	*	*				35.1	119.3	96.1	-66	-174	-179.8	-178.9	0	111.1
13	G	32.8	Very low	38.2	Very low	67 Å²	67	147.4 Å²	147.4	69%	0.691	82%	0.815	S	S	*	*			cis	146	147.9	20.5	0	0	0	0	0	105.3
14	I	40.5	Very low	38.5	Very low	164 Å²	164	150.7 Å²	150.7	84%	0.841	82%	0.815	S	S	*	*			trans	162.9	115.7	147.7	-81.2	152.1	0	0	0	108.4	I16	I14-I16 HydrophobicContact CG2-CG1 4.33Å
15	I	36.3	Very low	38.5	Very low	159 Å²	159	152 Å²	152	82%	0.815	82%	0.817	S	S	*	*			trans	-102.2	128.3	170.8	-66.2	163.6	0	0	0	105.6
16	I	42.9	Very low	38.2	Very low	157 Å²	157	153.5 Å²	153.5	81%	0.805	82%	0.818	S	S	*	*			trans	-147.8	120	153.7	-54.4	-178.5	0	0	0	109.3	I14	I14-I16 HydrophobicContact CG2-CG1 4.33Å
17	P	37	Very low	38.5	Very low	98 Å²	98	155.3 Å²	155.3	64%	0.636	82%	0.819	S	S	*	*			trans	-98.3	156.9	167.9	36.3	-28.2	0	0	0	112.5
18	S	34.6	Very low	38.2	Very low	118 Å²	118	155.9 Å²	155.9	83%	0.825	82%	0.823	S	S	*	*			trans	62	113.8	150.7	-54.6	0	0	0	0	120.2
19	I	42.6	Very low	38.4	Very low	174 Å²	174	155.7 Å²	155.7	89%	0.892	82%	0.822	S	S	*	*			trans	-132	126.8	151.9	-63.7	-177.6	0	0	0	110
20	M	38.4	Very low	38.4	Very low	175 Å²	175	154.8 Å²	154.8	86%	0.862	81%	0.813	S	S	*	*			trans	-77.7	175.7	179.7	-111.8	-178.5	138	0	0	113.1
21	P	43	Very low	38.4	Very low	113 Å²	113	156.4 Å²	156.4	73%	0.734	81%	0.81	S	S	*	*			trans	-94.5	166.3	-153	38	-37.3	0	0	0	115.6
22	L	37.3	Very low	38.3	Very low	159 Å²	159	156.8 Å²	156.8	83%	0.832	80%	0.802	S	S	*	*			trans	-131.7	131.4	169.6	-87.3	164.3	0	0	0	110.1
23	M	40	Very low	38.2	Very low	175 Å²	175	155.9 Å²	155.9	86%	0.862	80%	0.799	S	S	*	*			trans	157	86.2	146.1	-79.5	-95.7	168.8	0	0	107.7
24	K	43.7	Very low	38.4	Very low	183 Å²	183	156.5 Å²	156.5	80%	0.796	80%	0.804	S	S	*	*				69.5	98.2	95.1	-81.2	-174.3	177	179	0	114.9
25	N	35.5	Very low	38.3	Very low	161 Å²	161	158.2 Å²	158.2	86%	0.861	81%	0.806	S	S	*	*			trans	33.7	109.5	133.6	-69.1	-19	0	0	0	119.4
26	Y	36	Very low	38.4	Very low	239 Å²	239	158.8 Å²	158.8	94%	0.937	81%	0.805	S	S	*	*			trans	-136.3	124.3	140.2	-144.3	-98.3	0	0	0	109.6
27	R	36.4	Very low	38	Very low	241 Å²	241	161.6 Å²	161.6	91%	0.909	81%	0.807	S	S	*	*			trans	-66.4	137.5	-179.2	-79.3	176.3	172.3	-173.6	-3	110.6
28	S	34.3	Very low	38.4	Very low	121 Å²	121	161.8 Å²	161.8	85%	0.846	81%	0.811	S	S	*	*			trans	-146.8	124.3	152	172.2	0	0	0	0	108.6
29	S	36.3	Very low	39.4	Very low	100 Å²	100	164 Å²	164	70%	0.699	81%	0.806	S	S	*	*			trans	-117.3	121.2	177.2	-179.4	0	0	0	0	107.9
30	Q	40.8	Very low	40.1	Very low	152 Å²	152	162.1 Å²	162.1	71%	0.71	80%	0.798	S	S	*	*			trans	96.8	117.9	143	-80.2	-166.1	6.9	0	0	121.8
31	Y	35.6	Very low	41.3	Very low	182 Å²	182	155.4 Å²	155.4	71%	0.714	77%	0.774	S	S	*	*			trans	59.7	127.1	140.2	-73.1	-83.2	0	0	0	118.1
32	H	38.8	Very low	42.6	Very low	142 Å²	142	155.2 Å²	155.2	66%	0.657	77%	0.765	S	S	*	*			cis	-168.7	149	43.4	-119.1	-68.3	0	0	0	111
33	K	40.4	Very low	44.3	Very low	194 Å²	194	154.8 Å²	154.8	84%	0.843	76%	0.757	S	S	*	*			trans	63	112	146.2	-77.9	167.7	179.7	178.1	0	121.3
34	G	35.3	Very low	46.1	Very low	79 Å²	79	150.4 Å²	150.4	81%	0.814	74%	0.74	S	S	*	*				123.3	118.1	127	0	0	0	0	0	119.6
35	K	39.5	Very low	47.6	Very low	201 Å²	201	146.8 Å²	146.8	87%	0.874	73%	0.728	S	S	*	*			trans	81.1	95.4	152.7	-72.1	-179.6	175.1	177.7	0	121.5
36	Q	38.2	Very low	49.7	Very low	171 Å²	171	144.1 Å²	144.1	80%	0.799	71%	0.713	S	S	*	*				57.8	94.5	116.3	-119.2	161.2	-12.1	0	0	120.9
37	Y	34.6	Very low	51.8	Low	215 Å²	215	136.8 Å²	136.8	84%	0.843	69%	0.69	S	S	*	*			trans	37.6	109.7	139.4	-57.8	-80.5	0	0	0	121.4
38	S	45.3	Very low	53.8	Low	103 Å²	103	129.4 Å²	129.4	72%	0.72	67%	0.668	S	S	*	*			trans	-129.6	77	148.4	-176.7	0	0	0	0	109.4
39	F	54.3	Low	55.7	Low	163 Å²	163	128 Å²	128	72%	0.715	65%	0.65	S	S	*	*			trans	-93.3	-5.1	172.4	-114	-91.2	0	0	0	112.7
40	N	58.8	Low	57.6	Low	136 Å²	136	130.3 Å²	130.3	73%	0.727	65%	0.645	S	S	*	*	H	α-helix	trans	-76.3	-24.6	-179.6	-74.3	-20.8	0	0	0	113.2	V44	N40-V44 WeakPolarHBondContact O-CB 3.04Å; N40-V44 WeakPolarHBondContact O-CG2 3.5Å; N40-V44 PolarHBondContact O-N 2.89Å
41	G	63.3	Low	58.9	Low	34 Å²	34	126.7 Å²	126.7	35%	0.351	63%	0.629	S	S	.	*	H	α-helix	trans	-68.6	-40.5	-176.3	0	0	0	0	0	113.9	L45	G41-L45 WeakPolarHBondContact O-CB 3.48Å; G41-L45 PolarHBondContact O-N 3.3Å
42	I	70.7	Confident	60.1	Low	109 Å²	109	122.9 Å²	122.9	56%	0.559	62%	0.621	S	S	*	*	H	α-helix	trans	-74.9	-38.8	-174.7	-61.6	171.9	0	0	0	111	L45 I46	I42-L45 PolarHBondContact O-N 3.13Å; I42-I46 HydrophobicContact CG2-CD1 4Å; I42-I46 WeakPolarHBondContact O-CG1 3.08Å; I42-I46 PolarHBondContact O-N 3.31Å
43	F	72.8	Confident	60.9	Low	149 Å²	149	119.3 Å²	119.3	65%	0.654	61%	0.609	S	S	*	*	H	α-helix	trans	-67.8	-38.9	178.1	-141.6	-89.5	0	0	0	111.6	I46 L47	F43-I46 PolarHBondContact O-N 3.11Å; F43-L47 HydrophobicContact CD1-CD1 3.91Å; F43-L47 HydrophobicContact CE1-CD1 4.03Å; F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 PolarHBondContact O-N 3.39Å
44	V	76.6	Confident	61.5	Low	84 Å²	84	113.6 Å²	113.6	51%	0.509	59%	0.587	S	S	.	*	H	α-helix	trans	-66.2	-37.9	174	172.9	0	0	0	0	111.3	N40 L47 L48	N40-V44 WeakPolarHBondContact O-CB 3.04Å; N40-V44 WeakPolarHBondContact O-CG2 3.5Å; N40-V44 PolarHBondContact O-N 2.89Å; V44-L47 PolarHBondContact O-N 3.2Å; V44-L48 HydrophobicContact CG1-CD1 3.78Å; V44-L48 HydrophobicContact CG1-CG 4.33Å; V44-L48 VanDerWaalsContact O-CB 3.23Å; V44-L48 WeakPolarHBondContact O-CB 3.43Å; V44-L48 VanDerWaalsContact O-CG 3.23Å; V44-L48 WeakPolarHBondContact O-CG 3.47Å; V44-L48 PolarHBondContact O-N 3.04Å
45	L	76.7	Confident	61.7	Low	106 Å²	106	114.6 Å²	114.6	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-65.4	-42	173.8	-101.8	146.3	0	0	0	112.6	G41 I42 L48 I49	G41-L45 WeakPolarHBondContact O-CB 3.48Å; G41-L45 PolarHBondContact O-N 3.3Å; I42-L45 PolarHBondContact O-N 3.13Å; L45-L48 PolarHBondContact O-N 3.25Å; L45-I49 HydrophobicContact CD2-CD1 4.42Å; L45-I49 WeakPolarHBondContact O-CB 3.4Å; L45-I49 WeakPolarHBondContact O-CD1 3.14Å; L45-I49 WeakPolarHBondContact O-CG1 3.27Å; L45-I49 PolarHBondContact O-N 3.35Å
46	I	79.7	Confident	61.7	Low	105 Å²	105	111.9 Å²	111.9	54%	0.538	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-40.2	176.8	-66.6	168.8	0	0	0	110.9	I42 F43 I49 Y50	I42-I46 HydrophobicContact CG2-CD1 4Å; I42-I46 WeakPolarHBondContact O-CG1 3.08Å; I42-I46 PolarHBondContact O-N 3.31Å; F43-I46 PolarHBondContact O-N 3.11Å; I46-I49 PolarHBondContact O-N 2.94Å; I46-Y50 VanDerWaalsContact O-CB 3.23Å; I46-Y50 WeakPolarHBondContact O-CB 3.29Å; I46-Y50 PolarHBondContact O-N 3.18Å
47	L	79.7	Confident	61.6	Low	85 Å²	85	110 Å²	110	45%	0.445	56%	0.558	S	S	.	*	H	α-helix	trans	-66.8	-39.1	174.2	-113.4	142.5	0	0	0	112	F43 V44 Y50 I51	F43-L47 HydrophobicContact CD1-CD1 3.91Å; F43-L47 HydrophobicContact CE1-CD1 4.03Å; F43-L47 WeakPolarHBondContact O-CB 3.39Å; F43-L47 PolarHBondContact O-N 3.39Å; V44-L47 PolarHBondContact O-N 3.2Å; L47-Y50 PolarHBondContact O-N 2.82Å; L47-I51 HydrophobicContact CD2-CD1 3.88Å; L47-I51 HydrophobicContact CD2-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CB 3.27Å; L47-I51 WeakPolarHBondContact O-CB 3.49Å; L47-I51 WeakPolarHBondContact O-CD1 3.05Å; L47-I51 WeakPolarHBondContact O-CG1 3.33Å; L47-I51 PolarHBondContact O-N 3.47Å
48	L	77.6	Confident	61.4	Low	87 Å²	87	105.6 Å²	105.6	46%	0.455	55%	0.549	S	S	.	.	H	α-helix	trans	-65.6	-41.7	173.2	-80	166.5	0	0	0	111.2	V44 L45 Y50 I51 L52	V44-L48 HydrophobicContact CG1-CD1 3.78Å; V44-L48 HydrophobicContact CG1-CG 4.33Å; V44-L48 VanDerWaalsContact O-CB 3.23Å; V44-L48 WeakPolarHBondContact O-CB 3.43Å; V44-L48 VanDerWaalsContact O-CG 3.23Å; V44-L48 WeakPolarHBondContact O-CG 3.47Å; V44-L48 PolarHBondContact O-N 3.04Å; L45-L48 PolarHBondContact O-N 3.25Å; L48-Y50 VanDerWaalsContact C-N 3.34Å; L48-I51 PolarHBondContact O-N 2.88Å; L48-L52 WeakPolarHBondContact O-CA 3.3Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CD1 2.95Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.81Å
49	I	75.7	Confident	60.7	Low	91 Å²	91	104 Å²	104	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-67.1	-36.7	174.8	-68.1	163.1	0	0	0	110.6	L45 I46 L52 T53	L45-I49 HydrophobicContact CD2-CD1 4.42Å; L45-I49 WeakPolarHBondContact O-CB 3.4Å; L45-I49 WeakPolarHBondContact O-CD1 3.14Å; L45-I49 WeakPolarHBondContact O-CG1 3.27Å; L45-I49 PolarHBondContact O-N 3.35Å; I46-I49 PolarHBondContact O-N 2.94Å; I49-L52 PolarHBondContact O-N 3.13Å; I49-T53 HydrophobicContact CG2-CG2 4.29Å; I49-T53 VanDerWaalsContact O-CB 3.28Å; I49-T53 WeakPolarHBondContact O-CB 3.04Å; I49-T53 WeakPolarHBondContact O-CG2 3.08Å; I49-T53 PolarHBondContact O-N 3.45Å; I49-T53 PolarHBondContact O-OG1 3.2Å
50	Y	75	Confident	59.6	Low	149 Å²	149	103 Å²	103	58%	0.584	54%	0.538	S	S	*	.	H	α-helix	trans	-69.5	-40.4	175.5	-171.1	-108.5	0	0	0	111.9	I46 L47 L48 T53 L54	I46-Y50 VanDerWaalsContact O-CB 3.23Å; I46-Y50 WeakPolarHBondContact O-CB 3.29Å; I46-Y50 PolarHBondContact O-N 3.18Å; L47-Y50 PolarHBondContact O-N 2.82Å; L48-Y50 VanDerWaalsContact C-N 3.34Å; Y50-T53 WeakPolarHBondContact CA-OG1 3.02Å; Y50-T53 PolarHBondContact O-OG1 3.47Å; Y50-T53 VanDerWaalsContact O-OG1 3.11Å; Y50-L54 HydrophobicContact CD1-CD1 3.51Å; Y50-L54 HydrophobicContact CE1-CD1 3.23Å; Y50-L54 HydrophobicContact CE1-CG 4.3Å; Y50-L54 HydrophobicContact CE2-CD1 4.39Å; Y50-L54 HydrophobicContact CG-CD1 4.21Å; Y50-L54 WeakPolarHBondContact O-CB 3.33Å; Y50-L54 WeakPolarHBondContact O-CD1 3.23Å; Y50-L54 VanDerWaalsContact O-CG 3.27Å; Y50-L54 WeakPolarHBondContact O-CG 3.46Å; Y50-L54 PolarHBondContact O-N 2.92Å
51	I	69.2	Low	58.4	Low	76 Å²	76	99.5 Å²	99.5	39%	0.39	53%	0.533	S	S	.	.	H	α-helix	trans	-70	-38.9	173.8	-69.1	165.5	0	0	0	110.7	L47 L48 N55	L47-I51 HydrophobicContact CD2-CD1 3.88Å; L47-I51 HydrophobicContact CD2-CG1 4.43Å; L47-I51 VanDerWaalsContact O-CB 3.27Å; L47-I51 WeakPolarHBondContact O-CB 3.49Å; L47-I51 WeakPolarHBondContact O-CD1 3.05Å; L47-I51 WeakPolarHBondContact O-CG1 3.33Å; L47-I51 PolarHBondContact O-N 3.47Å; L48-I51 PolarHBondContact O-N 2.88Å; I51-N55 WeakPolarHBondContact CG2-ND2 3.32Å; I51-N55 WeakPolarHBondContact O-CB 3.04Å; I51-N55 PolarHBondContact O-N 3.41Å; I51-N55 PolarHBondContact O-ND2 2.86Å
52	L	60.3	Low	57.6	Low	102 Å²	102	102.8 Å²	102.8	53%	0.534	54%	0.543	S	S	.	.	H	α-helix	trans	-69.2	-36.6	175.7	-74.6	166	0	0	0	111.3	L48 I49 N55 H56	L48-L52 WeakPolarHBondContact O-CA 3.3Å; L48-L52 WeakPolarHBondContact O-CB 3.32Å; L48-L52 WeakPolarHBondContact O-CD1 2.95Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.81Å; I49-L52 PolarHBondContact O-N 3.13Å; L52-N55 PolarHBondContact O-N 3.02Å; L52-H56 VanDerWaalsContact O-CB 3.25Å; L52-H56 WeakPolarHBondContact O-CB 3.44Å; L52-H56 PolarHBondContact O-N 2.92Å
53	T	55.3	Low	56.9	Low	67 Å²	67	98.7 Å²	98.7	41%	0.411	52%	0.522	S	S	.	.	H	α-helix	trans	-75.7	-35.6	174.3	51.4	0	0	0	0	112.1	I49 Y50 N55 H56 I57	I49-T53 HydrophobicContact CG2-CG2 4.29Å; I49-T53 VanDerWaalsContact O-CB 3.28Å; I49-T53 WeakPolarHBondContact O-CB 3.04Å; I49-T53 WeakPolarHBondContact O-CG2 3.08Å; I49-T53 PolarHBondContact O-N 3.45Å; I49-T53 PolarHBondContact O-OG1 3.2Å; Y50-T53 WeakPolarHBondContact CA-OG1 3.02Å; Y50-T53 PolarHBondContact O-OG1 3.47Å; Y50-T53 VanDerWaalsContact O-OG1 3.11Å; T53-N55 VanDerWaalsContact C-N 3.32Å; T53-N55 PolarHBondContact O-N 2.9Å; T53-H56 PolarHBondContact O-N 3.06Å; T53-I57 WeakPolarHBondContact O-CD1 3.19Å; T53-I57 VanDerWaalsContact O-CG1 3.23Å; T53-I57 WeakPolarHBondContact O-CG1 3.26Å; T53-I57 PolarHBondContact O-N 3.5Å
54	L	53	Low	56.8	Low	74 Å²	74	91.9 Å²	91.9	39%	0.387	49%	0.494	S	S	.	.	H	α-helix	trans	-66	-31.7	169.1	-81.6	165.2	0	0	0	112.8	Y50 N58	Y50-L54 HydrophobicContact CD1-CD1 3.51Å; Y50-L54 HydrophobicContact CE1-CD1 3.23Å; Y50-L54 HydrophobicContact CE1-CG 4.3Å; Y50-L54 HydrophobicContact CE2-CD1 4.39Å; Y50-L54 HydrophobicContact CG-CD1 4.21Å; Y50-L54 WeakPolarHBondContact O-CB 3.33Å; Y50-L54 WeakPolarHBondContact O-CD1 3.23Å; Y50-L54 VanDerWaalsContact O-CG 3.27Å; Y50-L54 WeakPolarHBondContact O-CG 3.46Å; Y50-L54 PolarHBondContact O-N 2.92Å; L54-N58 PolarHBondContact O-ND2 3.08Å
55	N	39.6	Very low	57.4	Low	100 Å²	100	89 Å²	89	54%	0.535	47%	0.474	S	S	.	.	H	α-helix	trans	-82.5	-28.1	173.6	-72.8	-33.5	0	0	0	112.4	I51 L52 T53 N58 A59	I51-N55 WeakPolarHBondContact CG2-ND2 3.32Å; I51-N55 WeakPolarHBondContact O-CB 3.04Å; I51-N55 PolarHBondContact O-N 3.41Å; I51-N55 PolarHBondContact O-ND2 2.86Å; L52-N55 PolarHBondContact O-N 3.02Å; T53-N55 VanDerWaalsContact C-N 3.32Å; T53-N55 PolarHBondContact O-N 2.9Å; N55-N58 PolarHBondContact O-N 2.02Å; N55-A59 PolarHBondContact O-N 3.39Å
56	H	40.1	Very low	58.1	Low	144 Å²	144	84 Å²	84	67%	0.667	45%	0.448	S	S	*	.	H	α-helix	trans	-76.8	-24.8	174.3	-114.1	-82	0	0	0	113.6	L52 T53 N58	L52-H56 VanDerWaalsContact O-CB 3.25Å; L52-H56 WeakPolarHBondContact O-CB 3.44Å; L52-H56 PolarHBondContact O-N 2.92Å; T53-H56 PolarHBondContact O-N 3.06Å; H56-N58 PolarHBondContact O-N 3.21Å
57	I	35.5	Very low	58.8	Low	132 Å²	132	79 Å²	79	68%	0.677	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.8	171.2	-65.9	163.7	0	0	0	111.2	T53	T53-I57 WeakPolarHBondContact O-CD1 3.19Å; T53-I57 VanDerWaalsContact O-CG1 3.23Å; T53-I57 WeakPolarHBondContact O-CG1 3.26Å; T53-I57 PolarHBondContact O-N 3.5Å
58	N	31.3	Very low	59.4	Low	122 Å²	122	75.8 Å²	75.8	65%	0.652	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	10.9	177.9	-70.8	-55	0	0	0	114.2	L54 N55 H56 F60	L54-N58 PolarHBondContact O-ND2 3.08Å; N55-N58 PolarHBondContact O-N 2.02Å; H56-N58 PolarHBondContact O-N 3.21Å; N58-F60 VanDerWaalsContact C-N 3.32Å; N58-F60 PolarHBondContact O-N 3.4Å
59	A	29.6	Very low	60	Low	69 Å²	69	71.7 Å²	71.7	57%	0.57	38%	0.384	S	S	*	.			trans	-83.1	-1.9	178.9	0	0	0	0	0	114.4	N55 G61	N55-A59 PolarHBondContact O-N 3.39Å; A59-G61 PolarHBondContact O-N 2.77Å
60	F	31.4	Very low	60.8	Low	142 Å²	142	67.6 Å²	67.6	62%	0.623	36%	0.364	S	S	*	.	S	Bend	trans	-81.9	99.4	160.4	-73.5	-65.8	0	0	0	108.4	N58 N62	N58-F60 VanDerWaalsContact C-N 3.32Å; N58-F60 PolarHBondContact O-N 3.4Å; F60-N62 PolarHBondContact O-N 3.39Å
61	G	33.4	Very low	61.6	Low	62 Å²	62	64.2 Å²	64.2	64%	0.639	36%	0.356	S	S	*	.			trans	-43.3	116.7	169	0	0	0	0	0	108.7	A59 M63	A59-G61 PolarHBondContact O-N 2.77Å; G61-M63 PolarHBondContact O-N 2.04Å
62	N	46.4	Very low	62.5	Low	104 Å²	104	63.2 Å²	63.2	56%	0.556	35%	0.351	S	S	*	.			trans	-38.6	96.9	-173.9	-161.9	-14.1	0	0	0	110.2	F60 G64	F60-N62 PolarHBondContact O-N 3.39Å; N62-G64 PolarHBondContact O-N 2.03Å; N62-G64 PolarHBondContact OD1-N 3.46Å
63	M	56.9	Low	63.8	Low	23 Å²	23	61.3 Å²	61.3	11%	0.113	35%	0.346	C	S	.	.			trans	-66	10.2	173	-75.5	-164.5	-80.6	0	0	111.2	G61 Y65 N68	G61-M63 PolarHBondContact O-N 2.04Å; M63-Y65 PolarHBondContact O-N 3.08Å; M63-N68 PolarHBondContact O-ND2 3.15Å
64	G	69.9	Low	65.2	Low	6 Å²	6	66.1 Å²	66.1	6%	0.062	36%	0.357	C	S	.	.			trans	-54.6	99.8	170.6	0	0	0	0	0	110.9	N62 G96 R222	N62-G64 PolarHBondContact O-N 2.03Å; N62-G64 PolarHBondContact OD1-N 3.46Å; G64-G96 WeakPolarHBondContact O-CA 2.98Å; G64-R222 VanDerWaalsContact O-CZ 3.24Å; G64-R222 PolarHBondContact O-NH1 3.45Å; G64-R222 PolarHBondContact O-NH2 3.34Å
65	Y	89	Confident	66.8	Low	22 Å²	22	73.1 Å²	73.1	9%	0.086	38%	0.378	C	S	.	.			trans	-109	154.1	158.5	-86.8	-95.8	0	0	0	108.7	M63 W67 N68 T150 R222	M63-Y65 PolarHBondContact O-N 3.08Å; Y65-W67 VanDerWaalsContact CB-NE1 3.32Å; Y65-W67 HydrophobicContact CD1-CD2 4.5Å; Y65-W67 HydrophobicContact CD1-CE3 4.39Å; Y65-W67 AromaticContact CD1-CH2 3.21Å; Y65-W67 HydrophobicContact CD1-CH2 3.21Å; Y65-W67 AromaticContact CD1-CZ2 3.32Å; Y65-W67 HydrophobicContact CD1-CZ2 3.32Å; Y65-W67 AromaticContact CD1-CZ3 3.8Å; Y65-W67 HydrophobicContact CD1-CZ3 3.8Å; Y65-W67 HydrophobicContact CD2-CH2 4.22Å; Y65-W67 AromaticContact CD2-CZ2 3.55Å; Y65-W67 HydrophobicContact CD2-CZ2 3.55Å; Y65-W67 AromaticContact CE1-CH2 3.52Å; Y65-W67 HydrophobicContact CE1-CH2 3.52Å; Y65-W67 AromaticContact CE1-CZ2 3.89Å; Y65-W67 HydrophobicContact CE1-CZ2 3.89Å; Y65-W67 HydrophobicContact CE1-CZ3 4.29Å; Y65-W67 HydrophobicContact CE2-CH2 4.43Å; Y65-W67 HydrophobicContact CE2-CZ2 4.06Å; Y65-W67 HydrophobicContact CG-CD2 4.36Å; Y65-W67 AromaticContact CG-CE2 3.59Å; Y65-W67 AromaticContact CG-CH2 3.61Å; Y65-W67 HydrophobicContact CG-CH2 3.61Å; Y65-W67 AromaticContact CG-CZ2 3.13Å; Y65-W67 HydrophobicContact CG-CZ2 3.13Å; Y65-W67 HydrophobicContact CG-CZ3 4.37Å; Y65-W67 PolarHBondContact O-N 3.27Å; Y65-W67 VanDerWaalsContact O-N 3.12Å; Y65-N68 WeakPolarHBondContact O-CB 3.39Å; Y65-N68 PolarHBondContact O-N 3.05Å; Y65-N68 VanDerWaalsContact O-N 3.07Å; Y65-T150 PolarHBondContact OH-O 3.3Å; Y65-R222 VanDerWaalsContact CE1-NE 3.28Å
66	W	92.4	Very high	68.9	Low	3 Å²	3	71 Å²	71	1%	0.011	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-58.3	-27.1	-176.9	66.6	-91.4	0	0	0	113.7	N68 L69 L97 I115 A119 V168 F218 I219	W66-N68 PolarHBondContact O-N 3.13Å; W66-L69 VanDerWaalsContact O-CB 3.23Å; W66-L69 WeakPolarHBondContact O-CB 3.39Å; W66-L69 VanDerWaalsContact O-CD1 3.29Å; W66-L69 WeakPolarHBondContact O-CD1 3.3Å; W66-L69 WeakPolarHBondContact O-CG 3.24Å; W66-L69 PolarHBondContact O-N 3.16Å; W66-L69 VanDerWaalsContact O-N 3.1Å; W66-L97 HydrophobicContact CB-CD2 3.83Å; W66-I115 HydrophobicContact CE3-CG2 4.03Å; W66-I115 HydrophobicContact CZ3-CG2 4.09Å; W66-A119 HydrophobicContact CZ3-CB 4.07Å; W66-V168 HydrophobicContact CH2-CG2 3.38Å; W66-V168 HydrophobicContact CZ3-CG2 3.32Å; W66-F218 HydrophobicContact CB-CE1 4.03Å; W66-F218 HydrophobicContact CB-CZ 4.38Å; W66-F218 HydrophobicContact CD2-CE1 4.1Å; W66-F218 AromaticContact CE3-CE1 3.97Å; W66-F218 HydrophobicContact CE3-CE1 3.97Å; W66-F218 HydrophobicContact CG-CE1 4.13Å; W66-I219 HydrophobicContact CD2-CG1 4.48Å; W66-I219 HydrophobicContact CH2-CD1 3.76Å; W66-I219 HydrophobicContact CH2-CG1 4.04Å; W66-I219 HydrophobicContact CZ2-CB 4.34Å; W66-I219 HydrophobicContact CZ2-CD1 3.59Å; W66-I219 HydrophobicContact CZ2-CG1 3.61Å; W66-I219 HydrophobicContact CZ2-CG2 3.86Å
67	W	93.3	Very high	71	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-67.9	-15.6	179.3	50.6	60.7	0	0	0	113.3	Y65 L69 G70 A119 F146 T150 H161	Y65-W67 VanDerWaalsContact CB-NE1 3.32Å; Y65-W67 HydrophobicContact CD1-CD2 4.5Å; Y65-W67 HydrophobicContact CD1-CE3 4.39Å; Y65-W67 AromaticContact CD1-CH2 3.21Å; Y65-W67 HydrophobicContact CD1-CH2 3.21Å; Y65-W67 AromaticContact CD1-CZ2 3.32Å; Y65-W67 HydrophobicContact CD1-CZ2 3.32Å; Y65-W67 AromaticContact CD1-CZ3 3.8Å; Y65-W67 HydrophobicContact CD1-CZ3 3.8Å; Y65-W67 HydrophobicContact CD2-CH2 4.22Å; Y65-W67 AromaticContact CD2-CZ2 3.55Å; Y65-W67 HydrophobicContact CD2-CZ2 3.55Å; Y65-W67 AromaticContact CE1-CH2 3.52Å; Y65-W67 HydrophobicContact CE1-CH2 3.52Å; Y65-W67 AromaticContact CE1-CZ2 3.89Å; Y65-W67 HydrophobicContact CE1-CZ2 3.89Å; Y65-W67 HydrophobicContact CE1-CZ3 4.29Å; Y65-W67 HydrophobicContact CE2-CH2 4.43Å; Y65-W67 HydrophobicContact CE2-CZ2 4.06Å; Y65-W67 HydrophobicContact CG-CD2 4.36Å; Y65-W67 AromaticContact CG-CE2 3.59Å; Y65-W67 AromaticContact CG-CH2 3.61Å; Y65-W67 HydrophobicContact CG-CH2 3.61Å; Y65-W67 AromaticContact CG-CZ2 3.13Å; Y65-W67 HydrophobicContact CG-CZ2 3.13Å; Y65-W67 HydrophobicContact CG-CZ3 4.37Å; Y65-W67 PolarHBondContact O-N 3.27Å; Y65-W67 VanDerWaalsContact O-N 3.12Å; W67-L69 PolarHBondContact O-N 2.79Å; W67-L69 VanDerWaalsContact O-N 3.1Å; W67-G70 PolarHBondContact O-N 3.18Å; W67-A119 HydrophobicContact CB-CB 4.27Å; W67-A119 WeakPolarHBondContact O-CB 3.24Å; W67-F146 AromaticContact CD1-CD2 3.91Å; W67-F146 AromaticContact CD1-CE2 3.98Å; W67-F146 HydrophobicContact CD2-CD2 4.07Å; W67-F146 AromaticContact CD2-CE2 3.92Å; W67-F146 HydrophobicContact CD2-CE2 3.92Å; W67-F146 AromaticContact CE2-CD2 3.71Å; W67-F146 HydrophobicContact CE3-CE2 4.49Å; W67-F146 HydrophobicContact CG-CD2 4.22Å; W67-F146 AromaticContact CG-CE2 3.91Å; W67-F146 HydrophobicContact CG-CE2 3.91Å; W67-F146 HydrophobicContact CZ2-CD2 4.22Å; W67-F146 AromaticContact NE1-CD2 3.59Å; W67-T150 HydrophobicContact CH2-CG2 4.14Å; W67-T150 HydrophobicContact CZ2-CG2 3.46Å; W67-T150 VanDerWaalsContact CZ2-CG2 3.46Å; W67-H161 AromaticContact CH2-CE1 3.67Å; W67-H161 AromaticContact CH2-NE2 3.62Å; W67-H161 AromaticContact CZ3-CE1 3.73Å; W67-H161 AromaticContact CZ3-ND1 3.88Å
68	N	91.8	Very high	73.2	Confident	16 Å²	16	61.8 Å²	61.8	9%	0.086	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-63.6	-14.2	172	-64.9	-18.8	0	0	0	111.8	M63 Y65 W66 G70 L71 A143 A145	M63-N68 PolarHBondContact O-ND2 3.15Å; Y65-N68 WeakPolarHBondContact O-CB 3.39Å; Y65-N68 PolarHBondContact O-N 3.05Å; Y65-N68 VanDerWaalsContact O-N 3.07Å; W66-N68 PolarHBondContact O-N 3.13Å; N68-G70 PolarHBondContact O-N 3.18Å; N68-G70 VanDerWaalsContact O-N 3.13Å; N68-L71 HydrophobicContact CB-CD1 4.46Å; N68-L71 WeakPolarHBondContact O-CB 3.44Å; N68-L71 PolarHBondContact O-N 2.81Å; N68-A143 PolarHBondContact ND2-O 2.98Å; N68-A145 PolarHBondContact OD1-N 3.41Å
69	L	91.5	Very high	75.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-51.6	-30.1	164.4	-72.4	170.2	0	0	0	112.8	W66 W67 L71 L72 V94 L97 M112 I115 S116 F218	W66-L69 VanDerWaalsContact O-CB 3.23Å; W66-L69 WeakPolarHBondContact O-CB 3.39Å; W66-L69 VanDerWaalsContact O-CD1 3.29Å; W66-L69 WeakPolarHBondContact O-CD1 3.3Å; W66-L69 WeakPolarHBondContact O-CG 3.24Å; W66-L69 PolarHBondContact O-N 3.16Å; W66-L69 VanDerWaalsContact O-N 3.1Å; W67-L69 PolarHBondContact O-N 2.79Å; W67-L69 VanDerWaalsContact O-N 3.1Å; L69-L71 PolarHBondContact O-N 3.13Å; L69-L72 HydrophobicContact CD2-CD1 3.8Å; L69-L72 PolarHBondContact O-N 3.44Å; L69-V94 HydrophobicContact CD2-CB 4.42Å; L69-V94 HydrophobicContact CD2-CG1 3.76Å; L69-V94 HydrophobicContact CD2-CG2 4.13Å; L69-V94 HydrophobicContact CG-CG1 4.42Å; L69-L97 HydrophobicContact CD1-CD2 4.29Å; L69-M112 HydrophobicContact CD1-CE 3.48Å; L69-M112 VanDerWaalsContact CD1-CE 3.48Å; L69-M112 HydrophobicContact CD2-CE 4.19Å; L69-I115 HydrophobicContact CD1-CG2 3.86Å; L69-S116 WeakPolarHBondContact O-CB 3.01Å; L69-S116 PolarHBondContact O-OG 3.06Å; L69-F218 HydrophobicContact CD1-CZ 4.4Å
70	G	92.5	Very high	77.6	Confident	5 Å²	5	61.1 Å²	61.1	5%	0.052	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-72.3	-13.5	177.4	0	0	0	0	0	114.7	W67 N68 S116	W67-G70 PolarHBondContact O-N 3.18Å; N68-G70 PolarHBondContact O-N 3.18Å; N68-G70 VanDerWaalsContact O-N 3.13Å; G70-S116 WeakPolarHBondContact CA-O 3.49Å
71	L	91.1	Very high	79.6	Confident	79 Å²	79	56.2 Å²	56.2	41%	0.414	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-92.1	-16.2	175.8	-55.6	178	0	0	0	112.4	N68 L69 I123 E142 A145	N68-L71 HydrophobicContact CB-CD1 4.46Å; N68-L71 WeakPolarHBondContact O-CB 3.44Å; N68-L71 PolarHBondContact O-N 2.81Å; L69-L71 PolarHBondContact O-N 3.13Å; L71-I123 HydrophobicContact CD2-CD1 4.17Å; L71-I123 HydrophobicContact CG-CD1 4.46Å; L71-E142 WeakPolarHBondContact CD1-O 3.38Å; L71-A145 HydrophobicContact CD1-CB 4.02Å; L71-A145 HydrophobicContact CD2-CB 4.32Å; L71-A145 HydrophobicContact CG-CB 4.25Å
72	L	88.6	Confident	81.6	Confident	54 Å²	54	58 Å²	58	28%	0.283	31%	0.306	S	S	.	.	S	Bend	trans	-68.7	148.3	-178.3	-61.9	179.6	0	0	0	111.8	L69 T76 I77 L90 V94	L69-L72 HydrophobicContact CD2-CD1 3.8Å; L69-L72 PolarHBondContact O-N 3.44Å; L72-T76 HydrophobicContact CD1-CG2 4.34Å; L72-T76 HydrophobicContact CD2-CG2 4.36Å; L72-I77 HydrophobicContact CB-CD1 3.91Å; L72-I77 HydrophobicContact CB-CG1 3.77Å; L72-I77 HydrophobicContact CD1-CG1 4.32Å; L72-I77 WeakPolarHBondContact O-CD1 3.36Å; L72-L90 HydrophobicContact CD1-CD1 4.07Å; L72-V94 HydrophobicContact CD1-CG1 4.33Å; L72-V94 HydrophobicContact CD1-CG2 3.66Å
73	S	87.8	Confident	83.2	Confident	62 Å²	62	59.4 Å²	59.4	43%	0.434	31%	0.308	S	S	.	.			trans	-67	151.9	172.8	83.4	0	0	0	0	111.3	R75 T76 I77	S73-R75 PolarHBondContact O-N 2.8Å; S73-R75 PolarHBondContact OG-N 2.86Å; S73-T76 WeakPolarHBondContact O-CB 3.4Å; S73-T76 PolarHBondContact O-N 2.86Å; S73-T76 PolarHBondContact OG-N 2.86Å; S73-T76 PolarHBondContact OG-OG1 2.87Å; S73-I77 WeakPolarHBondContact O-CD1 3.41Å; S73-I77 WeakPolarHBondContact O-CG1 3.47Å; S73-I77 PolarHBondContact O-N 3.49Å
74	W	85.2	Confident	83.9	Confident	169 Å²	169	66.8 Å²	66.8	64%	0.64	35%	0.347	S	S	*	.	H	α-helix	trans	-52.3	-39	173.6	-175.2	-99.2	0	0	0	112.3	T76 I77 H78 I117	W74-T76 PolarHBondContact O-N 2.87Å; W74-I77 PolarHBondContact O-N 2.69Å; W74-H78 AromaticContact CD2-CD2 3.48Å; W74-H78 VanDerWaalsContact CD2-CD2 3.48Å; W74-H78 AromaticContact CD2-NE2 3.75Å; W74-H78 AromaticContact CE2-CD2 3.28Å; W74-H78 AromaticContact CE2-NE2 3.42Å; W74-H78 AromaticContact CE3-CD2 3.88Å; W74-H78 AromaticContact CE3-NE2 3.75Å; W74-H78 AromaticContact CG-CD2 4Å; W74-H78 AromaticContact CH2-CD2 3.96Å; W74-H78 AromaticContact CH2-NE2 3.17Å; W74-H78 WeakPolarHBondContact CH2-NE2 3.47Å; W74-H78 AromaticContact CZ2-CD2 3.56Å; W74-H78 AromaticContact CZ2-CE1 3.92Å; W74-H78 AromaticContact CZ2-NE2 3.15Å; W74-H78 WeakPolarHBondContact CZ2-NE2 3.49Å; W74-H78 AromaticContact CZ3-NE2 3.48Å; W74-H78 WeakPolarHBondContact CZ3-NE2 3.48Å; W74-H78 AromaticContact NE1-CD2 3.63Å; W74-H78 PolarHBondContact O-CD2 2.81Å; W74-H78 PolarHBondContact O-N 2.97Å; W74-H78 VanDerWaalsContact O-N 3.14Å; W74-I117 HydrophobicContact CZ3-CD1 4.34Å
75	R	85	Confident	84	Confident	220 Å²	220	74.1 Å²	74.1	83%	0.83	38%	0.383	S	S	*	.	H	α-helix	trans	-63.2	-40.5	178.9	-165.3	-177.4	-140.4	-178.4	6	112.4	S73 Q79	S73-R75 PolarHBondContact O-N 2.8Å; S73-R75 PolarHBondContact OG-N 2.86Å; R75-Q79 PolarHBondContact O-N 3.39Å
76	T	85	Confident	83.4	Confident	57 Å²	57	73.7 Å²	73.7	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-68	-42.8	179.9	-51.2	0	0	0	0	111.1	L72 S73 W74 Q79	L72-T76 HydrophobicContact CD1-CG2 4.34Å; L72-T76 HydrophobicContact CD2-CG2 4.36Å; S73-T76 WeakPolarHBondContact O-CB 3.4Å; S73-T76 PolarHBondContact O-N 2.86Å; S73-T76 PolarHBondContact OG-N 2.86Å; S73-T76 PolarHBondContact OG-OG1 2.87Å; W74-T76 PolarHBondContact O-N 2.87Å; T76-Q79 PolarHBondContact O-N 2.9Å
77	I	83.5	Confident	82.5	Confident	7 Å²	7	77.1 Å²	77.1	4%	0.036	41%	0.407	C	S	.	.	H	α-helix	trans	-67.9	-36.2	-177	-66.7	155	0	0	0	112.1	L72 S73 W74 P113 S116	L72-I77 HydrophobicContact CB-CD1 3.91Å; L72-I77 HydrophobicContact CB-CG1 3.77Å; L72-I77 HydrophobicContact CD1-CG1 4.32Å; L72-I77 WeakPolarHBondContact O-CD1 3.36Å; S73-I77 WeakPolarHBondContact O-CD1 3.41Å; S73-I77 WeakPolarHBondContact O-CG1 3.47Å; S73-I77 PolarHBondContact O-N 3.49Å; W74-I77 PolarHBondContact O-N 2.69Å; I77-P113 VanDerWaalsContact CG2-CA 3.47Å; I77-P113 HydrophobicContact CG2-CB 3.79Å; I77-P113 HydrophobicContact CG2-CG 3.87Å; I77-S116 WeakPolarHBondContact CD1-OG 3.46Å
78	H	82	Confident	81.9	Confident	75 Å²	75	79.7 Å²	79.7	35%	0.347	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	16.2	-178.9	-73.5	-76.4	0	0	0	114.2	W74 S80 P113	W74-H78 AromaticContact CD2-CD2 3.48Å; W74-H78 VanDerWaalsContact CD2-CD2 3.48Å; W74-H78 AromaticContact CD2-NE2 3.75Å; W74-H78 AromaticContact CE2-CD2 3.28Å; W74-H78 AromaticContact CE2-NE2 3.42Å; W74-H78 AromaticContact CE3-CD2 3.88Å; W74-H78 AromaticContact CE3-NE2 3.75Å; W74-H78 AromaticContact CG-CD2 4Å; W74-H78 AromaticContact CH2-CD2 3.96Å; W74-H78 AromaticContact CH2-NE2 3.17Å; W74-H78 WeakPolarHBondContact CH2-NE2 3.47Å; W74-H78 AromaticContact CZ2-CD2 3.56Å; W74-H78 AromaticContact CZ2-CE1 3.92Å; W74-H78 AromaticContact CZ2-NE2 3.15Å; W74-H78 WeakPolarHBondContact CZ2-NE2 3.49Å; W74-H78 AromaticContact CZ3-NE2 3.48Å; W74-H78 WeakPolarHBondContact CZ3-NE2 3.48Å; W74-H78 AromaticContact NE1-CD2 3.63Å; W74-H78 PolarHBondContact O-CD2 2.81Å; W74-H78 PolarHBondContact O-N 2.97Å; W74-H78 VanDerWaalsContact O-N 3.14Å; H78-S80 PolarHBondContact O-N 3.49Å; H78-P113 VanDerWaalsContact CE1-CB 3.44Å; H78-P113 WeakPolarHBondContact CE1-CB 3.35Å; H78-P113 VanDerWaalsContact CE1-CG 3.41Å; H78-P113 WeakPolarHBondContact CE1-CG 3.41Å
79	Q	78.5	Confident	81.3	Confident	81 Å²	81	79.8 Å²	79.8	38%	0.379	42%	0.42	S	S	.	.			trans	-65.3	111.3	178.6	-172.7	169.8	24.2	0	0	110.8	R75 T76 P89	R75-Q79 PolarHBondContact O-N 3.39Å; T76-Q79 PolarHBondContact O-N 2.9Å; Q79-P89 HydrophobicContact CG-CB 4.48Å; Q79-P89 HydrophobicContact CG-CG 4.44Å
80	S	74.1	Confident	81.1	Confident	96 Å²	96	80 Å²	80	67%	0.671	42%	0.421	S	S	*	.			trans	-69.7	143.7	176.5	-59.9	0	0	0	0	111.7	H78	H78-S80 PolarHBondContact O-N 3.49Å
81	P	74.5	Confident	80.9	Confident	38 Å²	38	79.9 Å²	79.9	25%	0.247	42%	0.42	C	S	.	.			trans	-63.2	152.3	168.4	27	-32.7	0	0	0	111	F83 A86 K88	P81-F83 VanDerWaalsContact C-N 3.29Å; P81-F83 PolarHBondContact O-N 2.95Å; P81-A86 HydrophobicContact CB-CB 4.01Å; P81-K88 HydrophobicContact CG-CG 4.46Å
82	A	74.7	Confident	80.5	Confident	101 Å²	101	81.8 Å²	81.8	84%	0.835	43%	0.429	S	S	*	.	S	Bend	trans	-66.5	-29.2	-179.3	0	0	0	0	0	113.4
83	F	80.1	Confident	79.8	Confident	132 Å²	132	87.2 Å²	87.2	58%	0.579	45%	0.446	S	S	*	.	S	Bend	trans	-149.2	161.5	175.6	54.7	-88.9	0	0	0	109.6	P81 L85 A86	P81-F83 VanDerWaalsContact C-N 3.29Å; P81-F83 PolarHBondContact O-N 2.95Å; F83-L85 HydrophobicContact CD2-CB 4.03Å; F83-L85 HydrophobicContact CE2-CB 4.04Å; F83-L85 PolarHBondContact O-N 2.74Å; F83-L85 VanDerWaalsContact O-N 3.11Å; F83-A86 HydrophobicContact CD1-CB 3.81Å; F83-A86 HydrophobicContact CD2-CB 3.82Å; F83-A86 VanDerWaalsContact CD2-N 3.27Å; F83-A86 HydrophobicContact CE1-CB 3.61Å; F83-A86 HydrophobicContact CE2-CB 3.63Å; F83-A86 HydrophobicContact CG-CB 3.91Å; F83-A86 HydrophobicContact CZ-CB 3.51Å; F83-A86 WeakPolarHBondContact O-CB 3.49Å; F83-A86 PolarHBondContact O-N 2.75Å
84	L	70.5	Confident	79.2	Confident	178 Å²	178	85.3 Å²	85.3	93%	0.932	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-33.1	-170.3	-70.5	172.7	0	0	0	114.6
85	L	73.9	Confident	78.8	Confident	160 Å²	160	84.1 Å²	84.1	84%	0.838	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-4.1	-179	-62	175	0	0	0	113.5	F83	F83-L85 HydrophobicContact CD2-CB 4.03Å; F83-L85 HydrophobicContact CE2-CB 4.04Å; F83-L85 PolarHBondContact O-N 2.74Å; F83-L85 VanDerWaalsContact O-N 3.11Å
86	A	74.5	Confident	78.6	Confident	13 Å²	13	74 Å²	74	11%	0.107	40%	0.398	C	S	.	.	S	Bend	trans	-69.1	138.5	179.7	0	0	0	0	0	109.2	P81 F83 K88	P81-A86 HydrophobicContact CB-CB 4.01Å; F83-A86 HydrophobicContact CD1-CB 3.81Å; F83-A86 HydrophobicContact CD2-CB 3.82Å; F83-A86 VanDerWaalsContact CD2-N 3.27Å; F83-A86 HydrophobicContact CE1-CB 3.61Å; F83-A86 HydrophobicContact CE2-CB 3.63Å; F83-A86 HydrophobicContact CG-CB 3.91Å; F83-A86 HydrophobicContact CZ-CB 3.51Å; F83-A86 WeakPolarHBondContact O-CB 3.49Å; F83-A86 PolarHBondContact O-N 2.75Å; A86-K88 PolarHBondContact O-N 2.76Å
87	P	74	Confident	78.8	Confident	76 Å²	76	72.6 Å²	72.6	49%	0.494	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-52.9	132.3	170.4	-25.7	33.9	0	0	0	110.1	P89 L92	P87-P89 VanDerWaalsContact O-CD 3.29Å; P87-P89 WeakPolarHBondContact O-CD 3.33Å; P87-P89 VanDerWaalsContact O-N 3.17Å; P87-L92 HydrophobicContact CB-CD1 3.37Å; P87-L92 HydrophobicContact CB-CG 4.1Å; P87-L92 HydrophobicContact CG-CD1 4.17Å
88	K	82.1	Confident	79.2	Confident	54 Å²	54	73.6 Å²	73.6	24%	0.235	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-67.9	118.6	-175.2	-59	-179.6	-171.5	168.1	0	108.6	P81 A86 L90 C91 Q106 F109	P81-K88 HydrophobicContact CG-CG 4.46Å; A86-K88 PolarHBondContact O-N 2.76Å; K88-L90 PolarHBondContact O-N 2.72Å; K88-L90 VanDerWaalsContact O-N 3.1Å; K88-C91 PolarHBondContact O-N 3.42Å; K88-Q106 VanDerWaalsContact N-OE1 3.1Å; K88-Q106 PolarHBondContact NZ-O 2.7Å; K88-F109 HydrophobicContact CB-CD2 3.64Å; K88-F109 HydrophobicContact CB-CE2 3.58Å; K88-F109 HydrophobicContact CB-CG 4.36Å; K88-F109 HydrophobicContact CB-CZ 4.27Å; K88-F109 HydrophobicContact CD-CB 3.29Å; K88-F109 HydrophobicContact CD-CD1 3.8Å; K88-F109 HydrophobicContact CD-CD2 3.35Å; K88-F109 HydrophobicContact CD-CE1 4.4Å; K88-F109 HydrophobicContact CD-CE2 4.01Å; K88-F109 HydrophobicContact CD-CG 3.21Å; K88-F109 HydrophobicContact CD-CZ 4.49Å; K88-F109 HydrophobicContact CG-CD2 4.09Å; K88-F109 HydrophobicContact CG-CE2 4.32Å; K88-F109 HydrophobicContact CG-CG 4.32Å
89	P	79.2	Confident	79.6	Confident	18 Å²	18	75.8 Å²	75.8	12%	0.117	41%	0.405	C	S	.	.	H	α-helix	trans	-55.1	-37.5	-166.7	-29.7	34.9	0	0	0	113.9	Q79 P87 C91 L92 R93	Q79-P89 HydrophobicContact CG-CB 4.48Å; Q79-P89 HydrophobicContact CG-CG 4.44Å; P87-P89 VanDerWaalsContact O-CD 3.29Å; P87-P89 WeakPolarHBondContact O-CD 3.33Å; P87-P89 VanDerWaalsContact O-N 3.17Å; P89-C91 VanDerWaalsContact C-N 3.32Å; P89-C91 PolarHBondContact O-N 2.76Å; P89-L92 PolarHBondContact O-N 2.82Å; P89-R93 VanDerWaalsContact O-CB 3.27Å; P89-R93 WeakPolarHBondContact O-CB 3.48Å; P89-R93 VanDerWaalsContact O-CG 3.3Å; P89-R93 WeakPolarHBondContact O-CG 3.13Å; P89-R93 PolarHBondContact O-N 3.28Å
90	L	85.4	Confident	80.3	Confident	4 Å²	4	73.4 Å²	73.4	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-55.9	-44.6	177.4	-170.1	72.9	0	0	0	112.4	L72 K88 L92 V94 F109 M112	L72-L90 HydrophobicContact CD1-CD1 4.07Å; K88-L90 PolarHBondContact O-N 2.72Å; K88-L90 VanDerWaalsContact O-N 3.1Å; L90-L92 PolarHBondContact O-N 3.48Å; L90-V94 HydrophobicContact CD1-CG2 3.4Å; L90-V94 HydrophobicContact CG-CG2 3.86Å; L90-V94 VanDerWaalsContact O-CB 3.31Å; L90-V94 WeakPolarHBondContact O-CB 3.4Å; L90-V94 WeakPolarHBondContact O-CG2 2.89Å; L90-V94 PolarHBondContact O-N 3.28Å; L90-V94 VanDerWaalsContact O-N 3.12Å; L90-F109 HydrophobicContact CB-CE2 3.85Å; L90-F109 HydrophobicContact CD2-CE2 4.17Å; L90-M112 HydrophobicContact CD2-CB 3.61Å; L90-M112 HydrophobicContact CD2-CG 4.24Å
91	C	88.6	Confident	81.3	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.027	37%	0.365	C	S	.	.	H	α-helix	trans	-72.2	-19.1	-173.4	-56.4	0	0	0	0	113.5	K88 P89 C105 Q106	K88-C91 PolarHBondContact O-N 3.42Å; P89-C91 VanDerWaalsContact C-N 3.32Å; P89-C91 PolarHBondContact O-N 2.76Å; C91-C105 WeakPolarHBondContact CA-SG 3.37Å; C91-C105 HydrophobicContact CB-CB 3.7Å; C91-C105 WeakPolarHBondContact CB-SG 3.49Å; C91-C105 WeakPolarHBondContact SG-CB 3.41Å; C91-C105 PolarHBondContact SG-O 3.3Å; C91-C105 VanDerWaalsContact SG-O 3.38Å; C91-C105 CovalentContact SG-SG 2.03Å; C91-C105 PolarHBondContact SG-SG 2.91Å; C91-Q106 HydrophobicContact CB-CG 4.1Å; C91-Q106 VanDerWaalsContact CB-NE2 3.33Å; C91-Q106 PolarHBondContact SG-N 3.3Å
92	L	82.4	Confident	82.2	Confident	118 Å²	118	68 Å²	68	62%	0.618	36%	0.361	S	S	*	.	H	α-helix	trans	-99.5	-36.2	177.2	-64.3	-175.6	0	0	0	112.7	P87 P89 L90	P87-L92 HydrophobicContact CB-CD1 3.37Å; P87-L92 HydrophobicContact CB-CG 4.1Å; P87-L92 HydrophobicContact CG-CD1 4.17Å; P89-L92 PolarHBondContact O-N 2.82Å; L90-L92 PolarHBondContact O-N 3.48Å
93	R	74.7	Confident	83.1	Confident	169 Å²	169	68.4 Å²	68.4	64%	0.638	35%	0.346	S	S	*	.	H	α-helix	trans	-89.6	-25.5	-171.1	-67.2	177.4	177.3	170.1	-2.5	113.7	P89 Q95	P89-R93 VanDerWaalsContact O-CB 3.27Å; P89-R93 WeakPolarHBondContact O-CB 3.48Å; P89-R93 VanDerWaalsContact O-CG 3.3Å; P89-R93 WeakPolarHBondContact O-CG 3.13Å; P89-R93 PolarHBondContact O-N 3.28Å; R93-Q95 PolarHBondContact O-N 2.79Å; R93-Q95 VanDerWaalsContact O-N 3.12Å
94	V	75.6	Confident	83.7	Confident	21 Å²	21	64.1 Å²	64.1	13%	0.127	33%	0.329	C	S	.	.	S	Bend	trans	-71	113.3	-177.8	173.7	0	0	0	0	109.5	L69 L72 L90 G96 L97	L69-V94 HydrophobicContact CD2-CB 4.42Å; L69-V94 HydrophobicContact CD2-CG1 3.76Å; L69-V94 HydrophobicContact CD2-CG2 4.13Å; L69-V94 HydrophobicContact CG-CG1 4.42Å; L72-V94 HydrophobicContact CD1-CG1 4.33Å; L72-V94 HydrophobicContact CD1-CG2 3.66Å; L90-V94 HydrophobicContact CD1-CG2 3.4Å; L90-V94 HydrophobicContact CG-CG2 3.86Å; L90-V94 VanDerWaalsContact O-CB 3.31Å; L90-V94 WeakPolarHBondContact O-CB 3.4Å; L90-V94 WeakPolarHBondContact O-CG2 2.89Å; L90-V94 PolarHBondContact O-N 3.28Å; L90-V94 VanDerWaalsContact O-N 3.12Å; V94-G96 PolarHBondContact O-N 2.85Å; V94-L97 HydrophobicContact CG1-CG 4.37Å
95	Q	76.6	Confident	84.8	Confident	145 Å²	145	55.7 Å²	55.7	68%	0.678	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	133.6	169.8	-63.4	-176	2.3	0	0	109.6	R93	R93-Q95 PolarHBondContact O-N 2.79Å; R93-Q95 VanDerWaalsContact O-N 3.12Å
96	G	79.7	Confident	85.7	Confident	8 Å²	8	50.6 Å²	50.6	8%	0.082	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.6	-6.5	174.2	0	0	0	0	0	116.9	G64 V94 R222	G64-G96 WeakPolarHBondContact O-CA 2.98Å; V94-G96 PolarHBondContact O-N 2.85Å; G96-R222 PolarHBondContact O-NH1 2.9Å
97	L	89.9	Confident	86.5	Confident	26 Å²	26	59 Å²	59	14%	0.136	29%	0.285	C	S	.	.			trans	-78.9	131.1	162.1	-62.9	-174.6	0	0	0	109.5	W66 L69 V94 Q101 C105 M112 F218	W66-L97 HydrophobicContact CB-CD2 3.83Å; L69-L97 HydrophobicContact CD1-CD2 4.29Å; V94-L97 HydrophobicContact CG1-CG 4.37Å; L97-Q101 HydrophobicContact CB-CB 4.15Å; L97-Q101 HydrophobicContact CD2-CB 4.12Å; L97-C105 HydrophobicContact CD1-CB 4.23Å; L97-M112 HydrophobicContact CD1-CE 4.08Å; L97-F218 HydrophobicContact CD2-CZ 3.84Å
98	T	91.7	Very high	87.5	Confident	28 Å²	28	58.4 Å²	58.4	17%	0.172	27%	0.274	C	S	.	.			trans	-75.2	172.8	170.7	73.4	0	0	0	0	111.7	S100 Q101 A102 R222 E225	T98-S100 VanDerWaalsContact C-N 3.33Å; T98-S100 PolarHBondContact O-N 3.23Å; T98-Q101 VanDerWaalsContact N-OE1 3.14Å; T98-Q101 PolarHBondContact O-N 3.31Å; T98-Q101 VanDerWaalsContact O-N 3.17Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.37Å; T98-Q101 PolarHBondContact OG1-N 2.73Å; T98-A102 WeakPolarHBondContact O-CB 3.39Å; T98-A102 PolarHBondContact O-N 3.24Å; T98-R222 HydrophobicContact CG2-CB 3.85Å; T98-R222 HydrophobicContact CG2-CG 3.63Å; T98-E225 WeakPolarHBondContact CB-OE2 3.3Å; T98-E225 PolarHBondContact OG1-OE2 3Å
99	H	91.7	Very high	87.9	Confident	122 Å²	122	57.4 Å²	57.4	57%	0.565	27%	0.269	S	S	*	.	H	α-helix	trans	-58.9	-46.6	180	-179.8	80.9	0	0	0	111.2	Q101 A102 Q103 E225	H99-Q101 VanDerWaalsContact C-N 3.34Å; H99-Q101 PolarHBondContact O-N 2.96Å; H99-A102 PolarHBondContact O-N 2.68Å; H99-Q103 PolarHBondContact CD2-NE2 2Å; H99-Q103 PolarHBondContact NE2-NE2 2.56Å; H99-Q103 WeakPolarHBondContact O-CG 2.96Å; H99-Q103 PolarHBondContact O-N 3.19Å; H99-Q103 VanDerWaalsContact O-N 3.07Å; H99-E225 WeakPolarHBondContact CB-OE1 3.44Å; H99-E225 PolarHBondContact N-OE1 3.32Å
100	S	93.4	Very high	88.5	Confident	30 Å²	30	58.9 Å²	58.9	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-35.3	177.8	-58.6	0	0	0	0	112.7	T98 Q103 L104 V221 E225	T98-S100 VanDerWaalsContact C-N 3.33Å; T98-S100 PolarHBondContact O-N 3.23Å; S100-Q103 PolarHBondContact O-N 2.97Å; S100-L104 PolarHBondContact O-N 2.91Å; S100-V221 VanDerWaalsContact CB-CG2 3.43Å; S100-E225 PolarHBondContact N-OE2 3.48Å; S100-E225 PolarHBondContact OG-OE2 3.08Å
101	Q	94.6	Very high	89	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.4	-37.7	174.2	-68.1	-176.9	-52.2	0	0	112.2	L97 T98 H99 Q103 L104 C105 F218 V221	L97-Q101 HydrophobicContact CB-CB 4.15Å; L97-Q101 HydrophobicContact CD2-CB 4.12Å; T98-Q101 VanDerWaalsContact N-OE1 3.14Å; T98-Q101 PolarHBondContact O-N 3.31Å; T98-Q101 VanDerWaalsContact O-N 3.17Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.37Å; T98-Q101 PolarHBondContact OG1-N 2.73Å; H99-Q101 VanDerWaalsContact C-N 3.34Å; H99-Q101 PolarHBondContact O-N 2.96Å; Q101-Q103 VanDerWaalsContact C-N 3.34Å; Q101-Q103 PolarHBondContact O-N 2.77Å; Q101-L104 PolarHBondContact O-N 3.19Å; Q101-C105 WeakPolarHBondContact O-CB 3.2Å; Q101-C105 PolarHBondContact O-N 3.34Å; Q101-F218 HydrophobicContact CB-CE2 4.26Å; Q101-F218 PolarHBondContact NE2-O 3.36Å; Q101-V221 HydrophobicContact CG-CG1 3.52Å
102	A	92.9	Very high	89.2	Confident	21 Å²	21	58.6 Å²	58.6	17%	0.174	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-39.4	175.7	0	0	0	0	0	111.5	T98 H99 C105 Q106	T98-A102 WeakPolarHBondContact O-CB 3.39Å; T98-A102 PolarHBondContact O-N 3.24Å; H99-A102 PolarHBondContact O-N 2.68Å; A102-C105 WeakPolarHBondContact O-CB 3.37Å; A102-C105 PolarHBondContact O-N 2.63Å; A102-Q106 WeakPolarHBondContact O-CG 3.36Å; A102-Q106 PolarHBondContact O-N 3.09Å
103	Q	93.1	Very high	89.7	Confident	110 Å²	110	53.7 Å²	53.7	51%	0.514	25%	0.25	S	C	.	.	H	α-helix	trans	-61.4	-45.6	172.9	-68.9	179.9	-8.5	0	0	112.2	H99 S100 Q101 C105 Q106 R107	H99-Q103 PolarHBondContact CD2-NE2 2Å; H99-Q103 PolarHBondContact NE2-NE2 2.56Å; H99-Q103 WeakPolarHBondContact O-CG 2.96Å; H99-Q103 PolarHBondContact O-N 3.19Å; H99-Q103 VanDerWaalsContact O-N 3.07Å; S100-Q103 PolarHBondContact O-N 2.97Å; Q101-Q103 VanDerWaalsContact C-N 3.34Å; Q101-Q103 PolarHBondContact O-N 2.77Å; Q103-C105 VanDerWaalsContact C-N 3.31Å; Q103-C105 PolarHBondContact O-N 3.03Å; Q103-Q106 PolarHBondContact O-N 3.25Å; Q103-R107 PolarHBondContact O-N 3.48Å; Q103-R107 VanDerWaalsContact O-N 3.13Å
104	L	94.2	Very high	90.7	Very high	42 Å²	42	46 Å²	46	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-40.3	174.6	-71.5	174.6	0	0	0	111.6	S100 Q101 R107 Y108 F218 V221	S100-L104 PolarHBondContact O-N 2.91Å; Q101-L104 PolarHBondContact O-N 3.19Å; L104-R107 PolarHBondContact O-N 3.48Å; L104-Y108 HydrophobicContact CD2-CD2 4.39Å; L104-Y108 HydrophobicContact CD2-CE2 4.45Å; L104-Y108 WeakPolarHBondContact O-CB 3.38Å; L104-Y108 PolarHBondContact O-N 2.93Å; L104-F218 HydrophobicContact CB-CD2 4.16Å; L104-F218 HydrophobicContact CD1-CB 4.4Å; L104-F218 HydrophobicContact CD1-CD2 4.24Å; L104-V221 HydrophobicContact CD1-CG1 4.12Å
105	C	93.6	Very high	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-44	175.6	179.1	0	0	0	0	112	C91 L97 Q101 A102 Q103 R107 Y108 F109 M112	C91-C105 WeakPolarHBondContact CA-SG 3.37Å; C91-C105 HydrophobicContact CB-CB 3.7Å; C91-C105 WeakPolarHBondContact CB-SG 3.49Å; C91-C105 WeakPolarHBondContact SG-CB 3.41Å; C91-C105 PolarHBondContact SG-O 3.3Å; C91-C105 VanDerWaalsContact SG-O 3.38Å; C91-C105 CovalentContact SG-SG 2.03Å; C91-C105 PolarHBondContact SG-SG 2.91Å; L97-C105 HydrophobicContact CD1-CB 4.23Å; Q101-C105 WeakPolarHBondContact O-CB 3.2Å; Q101-C105 PolarHBondContact O-N 3.34Å; A102-C105 WeakPolarHBondContact O-CB 3.37Å; A102-C105 PolarHBondContact O-N 2.63Å; Q103-C105 VanDerWaalsContact C-N 3.31Å; Q103-C105 PolarHBondContact O-N 3.03Å; C105-R107 VanDerWaalsContact C-N 3.35Å; C105-R107 PolarHBondContact O-N 2.9Å; C105-Y108 CarbonylContact O-C 3.55Å; C105-F109 WeakPolarHBondContact O-CA 3.46Å; C105-F109 WeakPolarHBondContact O-CB 3.38Å; C105-F109 PolarHBondContact O-N 2.83Å; C105-M112 HydrophobicContact CB-CE 4.12Å; C105-M112 HydrophobicContact CB-CG 4.26Å; C105-M112 HydrophobicContact CB-SD 3.75Å; C105-M112 VanDerWaalsContact SG-CG 3.5Å; C105-M112 VanDerWaalsContact SG-SD 3.63Å
106	Q	91.3	Very high	92.6	Very high	53 Å²	53	38.4 Å²	38.4	25%	0.248	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-44.9	177.3	-69.4	-65.8	-9.6	0	0	111.1	K88 C91 A102 Q103	K88-Q106 VanDerWaalsContact N-OE1 3.1Å; K88-Q106 PolarHBondContact NZ-O 2.7Å; C91-Q106 HydrophobicContact CB-CG 4.1Å; C91-Q106 VanDerWaalsContact CB-NE2 3.33Å; C91-Q106 PolarHBondContact SG-N 3.3Å; A102-Q106 WeakPolarHBondContact O-CG 3.36Å; A102-Q106 PolarHBondContact O-N 3.09Å; Q103-Q106 PolarHBondContact O-N 3.25Å
107	R	92.2	Very high	93.4	Very high	189 Å²	189	41.3 Å²	41.3	71%	0.713	20%	0.198	S	C	*	.	H	α-helix	trans	-70.1	-42	-178.9	-173.5	173.7	-179.4	173.4	3.1	113.3	Q103 L104 C105	Q103-R107 PolarHBondContact O-N 3.48Å; Q103-R107 VanDerWaalsContact O-N 3.13Å; L104-R107 PolarHBondContact O-N 3.48Å; C105-R107 VanDerWaalsContact C-N 3.35Å; C105-R107 PolarHBondContact O-N 2.9Å
108	Y	93.8	Very high	93.8	Very high	64 Å²	64	40.1 Å²	40.1	25%	0.251	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	47.5	-173.4	-65.2	-77.3	0	0	0	111.5	L104 C105 D110 H111 F214	L104-Y108 HydrophobicContact CD2-CD2 4.39Å; L104-Y108 HydrophobicContact CD2-CE2 4.45Å; L104-Y108 WeakPolarHBondContact O-CB 3.38Å; L104-Y108 PolarHBondContact O-N 2.93Å; C105-Y108 CarbonylContact O-C 3.55Å; Y108-D110 VanDerWaalsContact C-N 3.27Å; Y108-D110 PolarHBondContact O-N 2.92Å; Y108-H111 AromaticContact CD1-CE1 3.77Å; Y108-H111 VanDerWaalsContact O-CB 3.24Å; Y108-H111 WeakPolarHBondContact O-CB 3.27Å; Y108-H111 PolarHBondContact O-N 3.03Å; Y108-F214 AromaticContact CD1-CE2 3.9Å; Y108-F214 HydrophobicContact CD1-CE2 3.9Å; Y108-F214 AromaticContact CD2-CE2 3.84Å; Y108-F214 HydrophobicContact CD2-CE2 3.84Å; Y108-F214 HydrophobicContact CD2-CZ 4.45Å; Y108-F214 HydrophobicContact CE1-CE2 4.45Å; Y108-F214 HydrophobicContact CE2-CE2 4.4Å; Y108-F214 AromaticContact CG-CE2 3.57Å; Y108-F214 HydrophobicContact CG-CE2 3.57Å; Y108-F214 HydrophobicContact CG-CZ 4.12Å
109	F	91.3	Very high	94.1	Very high	34 Å²	34	38.8 Å²	38.8	15%	0.149	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-34	-174.5	-177.8	-105.5	0	0	0	114.1	K88 L90 C105 H111 M112 P113	K88-F109 HydrophobicContact CB-CD2 3.64Å; K88-F109 HydrophobicContact CB-CE2 3.58Å; K88-F109 HydrophobicContact CB-CG 4.36Å; K88-F109 HydrophobicContact CB-CZ 4.27Å; K88-F109 HydrophobicContact CD-CB 3.29Å; K88-F109 HydrophobicContact CD-CD1 3.8Å; K88-F109 HydrophobicContact CD-CD2 3.35Å; K88-F109 HydrophobicContact CD-CE1 4.4Å; K88-F109 HydrophobicContact CD-CE2 4.01Å; K88-F109 HydrophobicContact CD-CG 3.21Å; K88-F109 HydrophobicContact CD-CZ 4.49Å; K88-F109 HydrophobicContact CG-CD2 4.09Å; K88-F109 HydrophobicContact CG-CE2 4.32Å; K88-F109 HydrophobicContact CG-CG 4.32Å; L90-F109 HydrophobicContact CB-CE2 3.85Å; L90-F109 HydrophobicContact CD2-CE2 4.17Å; C105-F109 WeakPolarHBondContact O-CA 3.46Å; C105-F109 WeakPolarHBondContact O-CB 3.38Å; C105-F109 PolarHBondContact O-N 2.83Å; F109-H111 PolarHBondContact O-N 3.25Å; F109-H111 VanDerWaalsContact O-N 3.13Å; F109-M112 HydrophobicContact CD2-CG 4.46Å; F109-M112 WeakPolarHBondContact O-CB 3.47Å; F109-M112 PolarHBondContact O-N 2.81Å; F109-P113 WeakPolarHBondContact O-CD 3.49Å
110	D	91.9	Very high	94.3	Very high	49 Å²	49	39.3 Å²	39.3	26%	0.262	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.5	173.4	63.2	-35.2	0	0	0	112.5	Y108 L181	Y108-D110 VanDerWaalsContact C-N 3.27Å; Y108-D110 PolarHBondContact O-N 2.92Å; D110-L181 HydrophobicContact CB-CD2 4.39Å; D110-L181 VanDerWaalsContact O-CD2 3.26Å; D110-L181 WeakPolarHBondContact O-CD2 3.45Å
111	H	95.3	Very high	94.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-80.9	-23.2	176.4	-62.6	56.6	0	0	0	113	Y108 F109 V114 I115 L172 S183 Y210 F214	Y108-H111 AromaticContact CD1-CE1 3.77Å; Y108-H111 VanDerWaalsContact O-CB 3.24Å; Y108-H111 WeakPolarHBondContact O-CB 3.27Å; Y108-H111 PolarHBondContact O-N 3.03Å; F109-H111 PolarHBondContact O-N 3.25Å; F109-H111 VanDerWaalsContact O-N 3.13Å; H111-V114 CarbonylContact O-C 3.51Å; H111-V114 WeakPolarHBondContact O-CA 3.39Å; H111-V114 WeakPolarHBondContact O-CB 3.38Å; H111-V114 PolarHBondContact O-N 3.29Å; H111-I115 HydrophobicContact CB-CD1 4.2Å; H111-I115 WeakPolarHBondContact O-CG1 3.05Å; H111-I115 PolarHBondContact O-N 3.32Å; H111-L172 HydrophobicContact CB-CD2 4.44Å; H111-S183 PolarHBondContact CE1-OG 3.31Å; H111-S183 PolarHBondContact NE2-OG 3.37Å; H111-Y210 AromaticContact NE2-CE1 3.79Å; H111-Y210 AromaticContact NE2-CZ 3.63Å; H111-Y210 PolarHBondContact NE2-OH 3.21Å; H111-F214 HydrophobicContact CB-CE1 3.9Å; H111-F214 HydrophobicContact CB-CE2 4.46Å; H111-F214 HydrophobicContact CB-CZ 3.66Å; H111-F214 AromaticContact CD2-CD1 3.97Å; H111-F214 AromaticContact CD2-CD2 3.73Å; H111-F214 AromaticContact CD2-CE1 3.68Å; H111-F214 AromaticContact CD2-CE2 3.43Å; H111-F214 VanDerWaalsContact CD2-CE2 3.43Å; H111-F214 WeakPolarHBondContact CD2-CE2 3.32Å; H111-F214 AromaticContact CD2-CG 3.99Å; H111-F214 AromaticContact CD2-CZ 3.4Å; H111-F214 WeakPolarHBondContact CD2-CZ 3.35Å; H111-F214 AromaticContact CG-CE2 3.85Å; H111-F214 AromaticContact CG-CZ 3.53Å; H111-F214 AromaticContact NE2-CD2 3.94Å; H111-F214 AromaticContact NE2-CE2 3.79Å
112	M	93.5	Very high	94.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-40	-171.6	-60.2	-59.5	-59	0	0	113.2	L69 L90 L97 C105 F109 V114 I115 S116 F218	L69-M112 HydrophobicContact CD1-CE 3.48Å; L69-M112 VanDerWaalsContact CD1-CE 3.48Å; L69-M112 HydrophobicContact CD2-CE 4.19Å; L90-M112 HydrophobicContact CD2-CB 3.61Å; L90-M112 HydrophobicContact CD2-CG 4.24Å; L97-M112 HydrophobicContact CD1-CE 4.08Å; C105-M112 HydrophobicContact CB-CE 4.12Å; C105-M112 HydrophobicContact CB-CG 4.26Å; C105-M112 HydrophobicContact CB-SD 3.75Å; C105-M112 VanDerWaalsContact SG-CG 3.5Å; C105-M112 VanDerWaalsContact SG-SD 3.63Å; F109-M112 HydrophobicContact CD2-CG 4.46Å; F109-M112 WeakPolarHBondContact O-CB 3.47Å; F109-M112 PolarHBondContact O-N 2.81Å; M112-V114 VanDerWaalsContact C-N 3.3Å; M112-V114 PolarHBondContact O-N 2.91Å; M112-I115 PolarHBondContact O-N 2.81Å; M112-I115 HydrophobicContact SD-CD1 3.74Å; M112-S116 WeakPolarHBondContact O-CB 3.39Å; M112-S116 PolarHBondContact O-N 2.03Å; M112-F218 HydrophobicContact CE-CE2 4.3Å; M112-F218 HydrophobicContact CE-CZ 4.04Å; M112-F218 HydrophobicContact SD-CE2 4.05Å; M112-F218 HydrophobicContact SD-CZ 4.28Å
113	P	93.2	Very high	94.9	Very high	16 Å²	16	39.7 Å²	39.7	10%	0.104	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-40.3	169.8	-24.5	34.1	0	0	0	113.8	I77 H78 F109 S116 I117	I77-P113 VanDerWaalsContact CG2-CA 3.47Å; I77-P113 HydrophobicContact CG2-CB 3.79Å; I77-P113 HydrophobicContact CG2-CG 3.87Å; H78-P113 VanDerWaalsContact CE1-CB 3.44Å; H78-P113 WeakPolarHBondContact CE1-CB 3.35Å; H78-P113 VanDerWaalsContact CE1-CG 3.41Å; H78-P113 WeakPolarHBondContact CE1-CG 3.41Å; F109-P113 WeakPolarHBondContact O-CD 3.49Å; P113-S116 PolarHBondContact O-N 3.06Å; P113-I117 WeakPolarHBondContact O-CG1 3.33Å; P113-I117 PolarHBondContact O-N 3.02Å
114	V	96.4	Very high	95.1	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.048	18%	0.183	C	C	.	.	H	α-helix	trans	-70.7	-38.6	179.2	-175.6	0	0	0	0	111.5	H111 M112 S116 I117 G118 A171 L172 S175 L181	H111-V114 CarbonylContact O-C 3.51Å; H111-V114 WeakPolarHBondContact O-CA 3.39Å; H111-V114 WeakPolarHBondContact O-CB 3.38Å; H111-V114 PolarHBondContact O-N 3.29Å; M112-V114 VanDerWaalsContact C-N 3.3Å; M112-V114 PolarHBondContact O-N 2.91Å; V114-S116 VanDerWaalsContact C-N 3.34Å; V114-I117 PolarHBondContact O-N 2.97Å; V114-G118 PolarHBondContact O-N 2.81Å; V114-A171 VanDerWaalsContact CG1-C 3.45Å; V114-A171 HydrophobicContact CG1-CB 3.88Å; V114-A171 WeakPolarHBondContact CG1-O 3.49Å; V114-A171 WeakPolarHBondContact O-CB 3.38Å; V114-L172 HydrophobicContact CB-CD2 4.18Å; V114-L172 HydrophobicContact CG1-CD2 3.81Å; V114-L172 HydrophobicContact CG1-CG 4.16Å; V114-S175 VanDerWaalsContact CG1-OG 3.24Å; V114-S175 WeakPolarHBondContact CG1-OG 3.13Å; V114-L181 HydrophobicContact CG2-CD1 4.49Å; V114-L181 HydrophobicContact CG2-CD2 3.94Å; V114-L181 HydrophobicContact CG2-CG 4.38Å
115	I	96.4	Very high	95.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-43.8	172.7	-68.9	165.2	0	0	0	110.2	W66 L69 H111 M112 G118 A119 V168 F214 F218	W66-I115 HydrophobicContact CE3-CG2 4.03Å; W66-I115 HydrophobicContact CZ3-CG2 4.09Å; L69-I115 HydrophobicContact CD1-CG2 3.86Å; H111-I115 HydrophobicContact CB-CD1 4.2Å; H111-I115 WeakPolarHBondContact O-CG1 3.05Å; H111-I115 PolarHBondContact O-N 3.32Å; M112-I115 PolarHBondContact O-N 2.81Å; M112-I115 HydrophobicContact SD-CD1 3.74Å; I115-G118 PolarHBondContact O-N 3.27Å; I115-A119 WeakPolarHBondContact O-CB 3.27Å; I115-A119 PolarHBondContact O-N 2.88Å; I115-V168 HydrophobicContact CG1-CG1 4.33Å; I115-V168 HydrophobicContact CG2-CG2 4.28Å; I115-F214 HydrophobicContact CD1-CE1 3.8Å; I115-F214 HydrophobicContact CD1-CZ 4.47Å; I115-F214 HydrophobicContact CG1-CE1 4.4Å; I115-F218 HydrophobicContact CD1-CD1 3.98Å; I115-F218 HydrophobicContact CD1-CD2 4.13Å; I115-F218 HydrophobicContact CD1-CE1 3.97Å; I115-F218 HydrophobicContact CD1-CE2 4.12Å; I115-F218 HydrophobicContact CD1-CG 4.06Å; I115-F218 HydrophobicContact CD1-CZ 4.04Å; I115-F218 HydrophobicContact CG2-CD1 4.39Å; I115-F218 HydrophobicContact CG2-CE1 3.85Å; I115-F218 HydrophobicContact CG2-CZ 4.43Å
116	S	94.8	Very high	95.5	Very high	5 Å²	5	39.4 Å²	39.4	4%	0.035	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-45.8	176	172.1	0	0	0	0	111.7	L69 G70 I77 M112 P113 V114 G118 A119 K120	L69-S116 WeakPolarHBondContact O-CB 3.01Å; L69-S116 PolarHBondContact O-OG 3.06Å; G70-S116 WeakPolarHBondContact CA-O 3.49Å; I77-S116 WeakPolarHBondContact CD1-OG 3.46Å; M112-S116 WeakPolarHBondContact O-CB 3.39Å; M112-S116 PolarHBondContact O-N 2.03Å; P113-S116 PolarHBondContact O-N 3.06Å; V114-S116 VanDerWaalsContact C-N 3.34Å; S116-G118 VanDerWaalsContact C-N 3.32Å; S116-G118 PolarHBondContact O-N 3.46Å; S116-A119 PolarHBondContact O-N 3.45Å; S116-K120 WeakPolarHBondContact O-CB 3.19Å; S116-K120 PolarHBondContact O-N 2.96Å
117	I	96.6	Very high	95.7	Very high	70 Å²	70	40.4 Å²	40.4	36%	0.359	18%	0.178	S	C	.	.	H	α-helix	trans	-57.9	-45.8	174.1	-70.1	160	0	0	0	110.7	W74 P113 V114 K120 L121 A171	W74-I117 HydrophobicContact CZ3-CD1 4.34Å; P113-I117 WeakPolarHBondContact O-CG1 3.33Å; P113-I117 PolarHBondContact O-N 3.02Å; V114-I117 PolarHBondContact O-N 2.97Å; I117-K120 PolarHBondContact O-N 3.24Å; I117-L121 VanDerWaalsContact O-CB 3.28Å; I117-L121 WeakPolarHBondContact O-CB 3.38Å; I117-L121 PolarHBondContact O-N 3.07Å; I117-A171 HydrophobicContact CG2-CB 4.32Å
118	G	98.3	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-40.5	178.1	0	0	0	0	0	113.3	V114 I115 S116 L121 G122 G167	V114-G118 PolarHBondContact O-N 2.81Å; I115-G118 PolarHBondContact O-N 3.27Å; S116-G118 VanDerWaalsContact C-N 3.32Å; S116-G118 PolarHBondContact O-N 3.46Å; G118-L121 PolarHBondContact O-N 2.81Å; G118-G122 PolarHBondContact O-N 3.47Å; G118-G167 VanDerWaalsContact CA-C 3.48Å; G118-G167 VanDerWaalsContact CA-O 3.24Å; G118-G167 WeakPolarHBondContact CA-O 3.42Å; G118-G167 CarbonylContact O-C 3.54Å; G118-G167 VanDerWaalsContact O-CA 3.32Å; G118-G167 WeakPolarHBondContact O-CA 3.46Å
119	A	97.1	Very high	96.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-48	174.4	0	0	0	0	0	111.1	W66 W67 I115 S116 L121 G122 I123	W66-A119 HydrophobicContact CZ3-CB 4.07Å; W67-A119 HydrophobicContact CB-CB 4.27Å; W67-A119 WeakPolarHBondContact O-CB 3.24Å; I115-A119 WeakPolarHBondContact O-CB 3.27Å; I115-A119 PolarHBondContact O-N 2.88Å; S116-A119 PolarHBondContact O-N 3.45Å; A119-L121 VanDerWaalsContact C-N 3.31Å; A119-L121 PolarHBondContact O-N 3.12Å; A119-G122 PolarHBondContact O-N 3.11Å; A119-G122 VanDerWaalsContact O-N 3.12Å; A119-I123 WeakPolarHBondContact O-CD1 3.18Å; A119-I123 VanDerWaalsContact O-CG1 3.25Å; A119-I123 WeakPolarHBondContact O-CG1 3.28Å; A119-I123 PolarHBondContact O-N 3.18Å
120	K	96.2	Very high	96.3	Very high	134 Å²	134	34.1 Å²	34.1	58%	0.583	15%	0.154	S	C	*	.	H	α-helix	trans	-58.5	-42.8	176.5	-174.2	171.2	-176.5	170.6	0	111.9	S116 I117 I123 Y124	S116-K120 WeakPolarHBondContact O-CB 3.19Å; S116-K120 PolarHBondContact O-N 2.96Å; I117-K120 PolarHBondContact O-N 3.24Å; K120-I123 PolarHBondContact O-N 3.26Å; K120-Y124 WeakPolarHBondContact O-CB 3.34Å; K120-Y124 PolarHBondContact O-N 3.12Å
121	L	98	Very high	96.4	Very high	50 Å²	50	38.2 Å²	38.2	26%	0.262	17%	0.165	S	C	.	.	H	α-helix	trans	-60.7	-44	175.5	179.5	61.6	0	0	0	111.4	I117 G118 A119 E125 H170 F281	I117-L121 VanDerWaalsContact O-CB 3.28Å; I117-L121 WeakPolarHBondContact O-CB 3.38Å; I117-L121 PolarHBondContact O-N 3.07Å; G118-L121 PolarHBondContact O-N 2.81Å; A119-L121 VanDerWaalsContact C-N 3.31Å; A119-L121 PolarHBondContact O-N 3.12Å; L121-E125 WeakPolarHBondContact O-CB 3.36Å; L121-E125 PolarHBondContact O-N 3.32Å; L121-H170 HydrophobicContact CD2-CB 4.48Å; L121-F281 HydrophobicContact CD1-CB 4.08Å; L121-F281 HydrophobicContact CD1-CD1 3.57Å; L121-F281 HydrophobicContact CD1-CE1 4.19Å; L121-F281 HydrophobicContact CD1-CG 3.9Å; L121-F281 HydrophobicContact CD2-CB 4.08Å; L121-F281 HydrophobicContact CD2-CD1 3.94Å; L121-F281 HydrophobicContact CD2-CD2 3.73Å; L121-F281 HydrophobicContact CD2-CE1 4.28Å; L121-F281 HydrophobicContact CD2-CE2 4.13Å; L121-F281 HydrophobicContact CD2-CG 3.64Å; L121-F281 HydrophobicContact CD2-CZ 4.37Å; L121-F281 HydrophobicContact CG-CB 4.33Å; L121-F281 HydrophobicContact CG-CD1 3.43Å; L121-F281 VanDerWaalsContact CG-CD1 3.43Å; L121-F281 HydrophobicContact CG-CD2 4.14Å; L121-F281 HydrophobicContact CG-CE1 3.63Å; L121-F281 HydrophobicContact CG-CE2 4.34Å; L121-F281 HydrophobicContact CG-CG 3.7Å; L121-F281 HydrophobicContact CG-CZ 4.09Å; L121-F281 WeakPolarHBondContact O-CE1 3.45Å
122	G	98.3	Very high	96.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-44.2	175.9	0	0	0	0	0	113.5	G118 A119 C126	G118-G122 PolarHBondContact O-N 3.47Å; A119-G122 PolarHBondContact O-N 3.11Å; A119-G122 VanDerWaalsContact O-N 3.12Å; G122-C126 WeakPolarHBondContact O-CB 3.1Å; G122-C126 PolarHBondContact O-N 2.89Å
123	I	96.6	Very high	96.2	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-50.8	178.3	-64.8	161.4	0	0	0	110.5	L71 A119 K120 E125 C126 Q127 A145 F146	L71-I123 HydrophobicContact CD2-CD1 4.17Å; L71-I123 HydrophobicContact CG-CD1 4.46Å; A119-I123 WeakPolarHBondContact O-CD1 3.18Å; A119-I123 VanDerWaalsContact O-CG1 3.25Å; A119-I123 WeakPolarHBondContact O-CG1 3.28Å; A119-I123 PolarHBondContact O-N 3.18Å; K120-I123 PolarHBondContact O-N 3.26Å; I123-E125 VanDerWaalsContact C-N 3.35Å; I123-E125 PolarHBondContact O-N 3.04Å; I123-C126 WeakPolarHBondContact O-CB 3.2Å; I123-C126 PolarHBondContact O-N 3.07Å; I123-Q127 WeakPolarHBondContact O-CG 3.49Å; I123-Q127 PolarHBondContact O-N 2.74Å; I123-A145 HydrophobicContact CD1-CB 3.41Å; I123-A145 VanDerWaalsContact CD1-CB 3.41Å; I123-A145 HydrophobicContact CG1-CB 3.77Å; I123-A145 HydrophobicContact CG2-CB 4.5Å; I123-F146 HydrophobicContact CG1-CE1 4.22Å; I123-F146 HydrophobicContact CG1-CE2 4.4Å; I123-F146 HydrophobicContact CG1-CZ 3.83Å
124	Y	97.3	Very high	96.2	Very high	143 Å²	143	43.3 Å²	43.3	56%	0.561	19%	0.186	S	C	*	.	H	α-helix	trans	-60.7	-44.2	-179.8	176.8	-99.1	0	0	0	112	K120 C126 Q127 R128	K120-Y124 WeakPolarHBondContact O-CB 3.34Å; K120-Y124 PolarHBondContact O-N 3.12Å; Y124-C126 VanDerWaalsContact C-N 3.32Å; Y124-C126 PolarHBondContact O-N 3.21Å; Y124-Q127 PolarHBondContact O-N 2.94Å; Y124-R128 WeakPolarHBondContact O-CB 3.14Å; Y124-R128 PolarHBondContact O-N 3.03Å
125	E	98.5	Very high	96.1	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.014	19%	0.185	C	C	.	.	H	α-helix	trans	-67.6	-34.7	178.2	-171.7	59.5	-159.4	0	0	111.7	L121 I123 R128 Q129 I163 F281 T282	L121-E125 WeakPolarHBondContact O-CB 3.36Å; L121-E125 PolarHBondContact O-N 3.32Å; I123-E125 VanDerWaalsContact C-N 3.35Å; I123-E125 PolarHBondContact O-N 3.04Å; E125-R128 PolarHBondContact O-N 3.21Å; E125-Q129 HydrophobicContact CG-CG 4.26Å; E125-Q129 WeakPolarHBondContact O-CB 3.19Å; E125-Q129 VanDerWaalsContact O-CG 3.22Å; E125-Q129 WeakPolarHBondContact O-CG 3.36Å; E125-Q129 PolarHBondContact O-N 2.87Å; E125-Q129 PolarHBondContact OE1-NE2 2.91Å; E125-I163 HydrophobicContact CB-CD1 4.42Å; E125-I163 HydrophobicContact CB-CG1 4.46Å; E125-I163 HydrophobicContact CG-CD1 4.14Å; E125-F281 HydrophobicContact CB-CD1 3.71Å; E125-F281 HydrophobicContact CB-CE1 3.48Å; E125-F281 VanDerWaalsContact CB-CE1 3.48Å; E125-F281 HydrophobicContact CG-CD1 3.8Å; E125-F281 HydrophobicContact CG-CE1 3.8Å; E125-T282 WeakPolarHBondContact OE1-CA 3.49Å
126	C	98	Very high	95.9	Very high	0 Å²	0	45 Å²	45	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-51.5	173.7	-170.3	0	0	0	0	111.6	G122 I123 Y124 R128 Q129 F130 C137 F146 F159 I163	G122-C126 WeakPolarHBondContact O-CB 3.1Å; G122-C126 PolarHBondContact O-N 2.89Å; I123-C126 WeakPolarHBondContact O-CB 3.2Å; I123-C126 PolarHBondContact O-N 3.07Å; Y124-C126 VanDerWaalsContact C-N 3.32Å; Y124-C126 PolarHBondContact O-N 3.21Å; C126-R128 PolarHBondContact O-N 3.39Å; C126-Q129 PolarHBondContact O-N 3.44Å; C126-Q129 VanDerWaalsContact O-N 3.16Å; C126-F130 WeakPolarHBondContact O-CB 3.41Å; C126-F130 WeakPolarHBondContact O-CD2 3.31Å; C126-F130 PolarHBondContact O-N 3.17Å; C126-C137 HydrophobicContact CB-CB 3.93Å; C126-C137 WeakPolarHBondContact CB-SG 3.39Å; C126-C137 WeakPolarHBondContact SG-CB 3.35Å; C126-C137 CovalentContact SG-SG 2.01Å; C126-C137 PolarHBondContact SG-SG 2.97Å; C126-F146 HydrophobicContact CB-CE1 4.06Å; C126-F159 HydrophobicContact CB-CE1 3.95Å; C126-F159 VanDerWaalsContact SG-CE1 3.52Å; C126-I163 HydrophobicContact CB-CG2 4.05Å
127	Q	96.5	Very high	95.9	Very high	75 Å²	75	44.8 Å²	44.8	35%	0.35	19%	0.192	S	C	.	.	H	α-helix	trans	-57.3	-39.7	175.7	-69.7	170.8	-10.9	0	0	111.8	I123 Y124 R131 C137	I123-Q127 WeakPolarHBondContact O-CG 3.49Å; I123-Q127 PolarHBondContact O-N 2.74Å; Y124-Q127 PolarHBondContact O-N 2.94Å; Q127-R131 WeakPolarHBondContact O-CA 3.33Å; Q127-R131 WeakPolarHBondContact O-CB 3.22Å; Q127-R131 PolarHBondContact O-N 3.44Å; Q127-C137 HydrophobicContact CG-CB 4.36Å; Q127-C137 VanDerWaalsContact CG-O 3.28Å; Q127-C137 WeakPolarHBondContact CG-O 3.17Å
128	R	96.8	Very high	95.5	Very high	137 Å²	137	43.2 Å²	43.2	52%	0.517	19%	0.188	S	C	.	.	H	α-helix	trans	-64.3	-47.7	175.8	-176.1	-176.9	179.5	165.1	3.8	112.5	Y124 E125 C126 F130	Y124-R128 WeakPolarHBondContact O-CB 3.14Å; Y124-R128 PolarHBondContact O-N 3.03Å; E125-R128 PolarHBondContact O-N 3.21Å; C126-R128 PolarHBondContact O-N 3.39Å; R128-F130 VanDerWaalsContact C-N 3.29Å; R128-F130 PolarHBondContact O-N 3.43Å
129	Q	96.9	Very high	94.7	Very high	18 Å²	18	44.6 Å²	44.6	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-67.1	-31	-177.5	-73.5	-59.1	-28.8	0	0	112.6	E125 C126 F159 R289	E125-Q129 HydrophobicContact CG-CG 4.26Å; E125-Q129 WeakPolarHBondContact O-CB 3.19Å; E125-Q129 VanDerWaalsContact O-CG 3.22Å; E125-Q129 WeakPolarHBondContact O-CG 3.36Å; E125-Q129 PolarHBondContact O-N 2.87Å; E125-Q129 PolarHBondContact OE1-NE2 2.91Å; C126-Q129 PolarHBondContact O-N 3.44Å; C126-Q129 VanDerWaalsContact O-N 3.16Å; Q129-F159 HydrophobicContact CB-CZ 4.43Å; Q129-R289 WeakPolarHBondContact O-CD 3.5Å; Q129-R289 PolarHBondContact O-NH1 2.99Å; Q129-R289 VanDerWaalsContact OE1-CD 3.24Å
130	F	95.5	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-104.8	2.9	-176.1	-76.6	-98	0	0	0	114.5	C126 R128 F132 R133 W135 N136 C137 F159 Y292	C126-F130 WeakPolarHBondContact O-CB 3.41Å; C126-F130 WeakPolarHBondContact O-CD2 3.31Å; C126-F130 PolarHBondContact O-N 3.17Å; R128-F130 VanDerWaalsContact C-N 3.29Å; R128-F130 PolarHBondContact O-N 3.43Å; F130-F132 PolarHBondContact O-N 2.76Å; F130-R133 HydrophobicContact CB-CB 4.4Å; F130-R133 HydrophobicContact CD1-CB 3.9Å; F130-R133 HydrophobicContact CD1-CG 3.98Å; F130-R133 HydrophobicContact CG-CG 4.48Å; F130-R133 WeakPolarHBondContact O-CB 3.37Å; F130-R133 PolarHBondContact O-N 3.28Å; F130-W135 WeakPolarHBondContact CB-O 3.43Å; F130-W135 AromaticContact CD1-CE3 3.58Å; F130-W135 HydrophobicContact CD1-CE3 3.58Å; F130-W135 AromaticContact CD1-CZ3 3.95Å; F130-W135 HydrophobicContact CD1-CZ3 3.95Å; F130-W135 WeakPolarHBondContact CD1-O 3.44Å; F130-W135 HydrophobicContact CD2-CZ3 4.32Å; F130-W135 AromaticContact CE1-CE3 3.79Å; F130-W135 HydrophobicContact CE1-CE3 3.79Å; F130-W135 AromaticContact CE1-CZ3 3.94Å; F130-W135 HydrophobicContact CE1-CZ3 3.94Å; F130-W135 HydrophobicContact CE2-CZ3 4.34Å; F130-W135 HydrophobicContact CG-CE3 4.08Å; F130-W135 HydrophobicContact CG-CZ3 4.14Å; F130-W135 HydrophobicContact CZ-CE3 4.45Å; F130-W135 HydrophobicContact CZ-CZ3 4.14Å; F130-N136 WeakPolarHBondContact O-CA 3.49Å; F130-C137 HydrophobicContact CB-CB 4.14Å; F130-F159 HydrophobicContact CD2-CD1 4.24Å; F130-F159 AromaticContact CD2-CE1 4Å; F130-F159 HydrophobicContact CD2-CE1 4Å; F130-F159 HydrophobicContact CD2-CZ 4.4Å; F130-F159 AromaticContact CE2-CD1 3.45Å; F130-F159 HydrophobicContact CE2-CD1 3.45Å; F130-F159 VanDerWaalsContact CE2-CD1 3.45Å; F130-F159 AromaticContact CE2-CD2 4Å; F130-F159 HydrophobicContact CE2-CD2 4Å; F130-F159 AromaticContact CE2-CE1 3.46Å; F130-F159 HydrophobicContact CE2-CE1 3.46Å; F130-F159 VanDerWaalsContact CE2-CE1 3.46Å; F130-F159 AromaticContact CE2-CE2 3.97Å; F130-F159 HydrophobicContact CE2-CE2 3.97Å; F130-F159 AromaticContact CE2-CG 3.74Å; F130-F159 HydrophobicContact CE2-CG 3.74Å; F130-F159 AromaticContact CE2-CZ 3.72Å; F130-F159 HydrophobicContact CE2-CZ 3.72Å; F130-F159 HydrophobicContact CZ-CB 4.41Å; F130-F159 HydrophobicContact CZ-CD1 4.07Å; F130-F159 HydrophobicContact CZ-CD2 4.3Å; F130-F159 HydrophobicContact CZ-CE1 4.47Å; F130-F159 AromaticContact CZ-CG 3.99Å; F130-F159 HydrophobicContact CZ-CG 3.99Å; F130-Y292 HydrophobicContact CE1-CD1 4.09Å; F130-Y292 HydrophobicContact CE1-CD2 4.34Å; F130-Y292 AromaticContact CE1-CE1 3.69Å; F130-Y292 HydrophobicContact CE1-CE1 3.69Å; F130-Y292 AromaticContact CE1-CE2 3.94Å; F130-Y292 HydrophobicContact CE1-CE2 3.94Å; F130-Y292 HydrophobicContact CE1-CG 4.42Å; F130-Y292 AromaticContact CE1-CZ 3.62Å; F130-Y292 AromaticContact CZ-CD1 3.77Å; F130-Y292 HydrophobicContact CZ-CD1 3.77Å; F130-Y292 AromaticContact CZ-CD2 3.87Å; F130-Y292 HydrophobicContact CZ-CD2 3.87Å; F130-Y292 AromaticContact CZ-CE1 3.88Å; F130-Y292 HydrophobicContact CZ-CE1 3.88Å; F130-Y292 AromaticContact CZ-CE2 3.94Å; F130-Y292 HydrophobicContact CZ-CE2 3.94Å; F130-Y292 AromaticContact CZ-CG 3.79Å; F130-Y292 HydrophobicContact CZ-CG 3.79Å; F130-Y292 AromaticContact CZ-CZ 3.97Å
131	R	93.6	Very high	92.7	Very high	134 Å²	134	46.8 Å²	46.8	51%	0.506	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.2	-38.3	-177.1	179.2	174.8	175.5	163.9	-1.4	114.3	Q127 R346 E347	Q127-R131 WeakPolarHBondContact O-CA 3.33Å; Q127-R131 WeakPolarHBondContact O-CB 3.22Å; Q127-R131 PolarHBondContact O-N 3.44Å; R131-R346 PolarHBondContact O-NH2 2.96Å; R131-E347 IonicContact CZ-OE2 2.77Å; R131-E347 IonicContact NH2-OE2 2.92Å; R131-E347 PolarHBondContact NH2-OE2 2.78Å
132	F	93	Very high	91.6	Very high	52 Å²	52	53.1 Å²	53.1	23%	0.228	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	35.3	-178.8	-54.9	-71.8	0	0	0	112.9	F130 L349 Q355 A356	F130-F132 PolarHBondContact O-N 2.76Å; F132-L349 HydrophobicContact CD1-CG 4.34Å; F132-L349 HydrophobicContact CD2-CD1 4.32Å; F132-L349 HydrophobicContact CE1-CD2 4.28Å; F132-L349 HydrophobicContact CE1-CG 4.18Å; F132-L349 HydrophobicContact CE2-CD1 4.25Å; F132-L349 HydrophobicContact CG-CD1 4.49Å; F132-L349 HydrophobicContact CZ-CD1 4.37Å; F132-L349 HydrophobicContact CZ-CD2 4.27Å; F132-L349 HydrophobicContact CZ-CG 4.37Å; F132-Q355 CarbonylContact O-C 3.59Å; F132-A356 HydrophobicContact CB-CB 3.47Å; F132-A356 VanDerWaalsContact CB-CB 3.47Å; F132-A356 HydrophobicContact CG-CB 4.19Å; F132-A356 WeakPolarHBondContact O-CA 3.27Å
133	R	93.1	Very high	90.6	Very high	26 Å²	26	56.2 Å²	56.2	10%	0.098	27%	0.269	C	S	.	.	S	Bend	trans	-115.9	155.6	171.8	-62.5	-76.5	-177.5	127.6	5.8	108.9	F130 W135 D293 R346 Q355	F130-R133 HydrophobicContact CB-CB 4.4Å; F130-R133 HydrophobicContact CD1-CB 3.9Å; F130-R133 HydrophobicContact CD1-CG 3.98Å; F130-R133 HydrophobicContact CG-CG 4.48Å; F130-R133 WeakPolarHBondContact O-CB 3.37Å; F130-R133 PolarHBondContact O-N 3.28Å; R133-W135 VanDerWaalsContact C-N 3.33Å; R133-W135 CarbonylContact O-C 3.42Å; R133-W135 PolarHBondContact O-N 3.39Å; R133-D293 IonicContact CZ-OD1 2.81Å; R133-D293 IonicContact NH1-OD1 3.36Å; R133-D293 PolarHBondContact NH1-OD1 2.98Å; R133-D293 IonicContact NH2-OD1 3.5Å; R133-D293 PolarHBondContact NH2-OD1 3.12Å; R133-D293 IonicContact NH2-OD2 3.72Å; R133-D293 PolarHBondContact NH2-OD2 3.35Å; R133-D293 VanDerWaalsContact NH2-OD2 3.09Å; R133-R346 PolarHBondContact O-NH1 3.18Å; R133-R346 PolarHBondContact O-NH2 2.89Å; R133-Q355 VanDerWaalsContact CZ-OE1 3.28Å; R133-Q355 VanDerWaalsContact NH1-NE2 3.12Å
134	H	93.1	Very high	90.1	Very high	46 Å²	46	56 Å²	56	21%	0.213	27%	0.268	C	S	.	.	S	Bend	trans	-56.9	-43.4	-176.3	-61.1	106.2	0	0	0	113.1	Y331 T343 R346 T360 L361 C363	H134-Y331 HydrophobicContact CB-CG 4.47Å; H134-T343 HydrophobicContact CB-CG2 4.08Å; H134-R346 PolarHBondContact O-NH1 2.66Å; H134-T360 PolarHBondContact NE2-O 3.3Å; H134-L361 PolarHBondContact CD2-O 3.39Å; H134-C363 PolarHBondContact NE2-SG 3.17Å
135	W	93.2	Very high	89.7	Confident	11 Å²	11	49.4 Å²	49.4	4%	0.042	24%	0.243	C	C	.	.	S	Bend	trans	-87.2	120.3	161.4	178.7	69.7	0	0	0	109.5	F130 R133 C137 V149 E156 Y331	F130-W135 WeakPolarHBondContact CB-O 3.43Å; F130-W135 AromaticContact CD1-CE3 3.58Å; F130-W135 HydrophobicContact CD1-CE3 3.58Å; F130-W135 AromaticContact CD1-CZ3 3.95Å; F130-W135 HydrophobicContact CD1-CZ3 3.95Å; F130-W135 WeakPolarHBondContact CD1-O 3.44Å; F130-W135 HydrophobicContact CD2-CZ3 4.32Å; F130-W135 AromaticContact CE1-CE3 3.79Å; F130-W135 HydrophobicContact CE1-CE3 3.79Å; F130-W135 AromaticContact CE1-CZ3 3.94Å; F130-W135 HydrophobicContact CE1-CZ3 3.94Å; F130-W135 HydrophobicContact CE2-CZ3 4.34Å; F130-W135 HydrophobicContact CG-CE3 4.08Å; F130-W135 HydrophobicContact CG-CZ3 4.14Å; F130-W135 HydrophobicContact CZ-CE3 4.45Å; F130-W135 HydrophobicContact CZ-CZ3 4.14Å; R133-W135 VanDerWaalsContact C-N 3.33Å; R133-W135 CarbonylContact O-C 3.42Å; R133-W135 PolarHBondContact O-N 3.39Å; W135-C137 HydrophobicContact CE3-CB 4.33Å; W135-C137 HydrophobicContact CH2-CB 3.71Å; W135-C137 WeakPolarHBondContact CH2-SG 3.38Å; W135-C137 HydrophobicContact CZ2-CB 3.84Å; W135-C137 HydrophobicContact CZ3-CB 3.96Å; W135-V149 HydrophobicContact CZ2-CB 4.49Å; W135-V149 HydrophobicContact CZ2-CG1 3.73Å; W135-V149 HydrophobicContact CZ2-CG2 4.46Å; W135-E156 HydrophobicContact CB-CG 4.09Å; W135-E156 HydrophobicContact CD2-CB 3.84Å; W135-E156 HydrophobicContact CD2-CG 3.56Å; W135-E156 HydrophobicContact CE3-CB 3.57Å; W135-E156 HydrophobicContact CE3-CG 3.27Å; W135-E156 HydrophobicContact CG-CG 3.95Å; W135-E156 HydrophobicContact CH2-CB 3.97Å; W135-E156 HydrophobicContact CZ2-CB 4.26Å; W135-E156 HydrophobicContact CZ3-CB 3.63Å; W135-E156 HydrophobicContact CZ3-CG 3.84Å; W135-Y331 HydrophobicContact CB-CD1 3.94Å; W135-Y331 HydrophobicContact CB-CD2 3.94Å; W135-Y331 HydrophobicContact CB-CE1 3.85Å; W135-Y331 HydrophobicContact CB-CE2 3.84Å; W135-Y331 HydrophobicContact CB-CG 4Å; W135-Y331 AromaticContact CD1-CE1 3.73Å; W135-Y331 HydrophobicContact CG-CD1 4.46Å; W135-Y331 HydrophobicContact CG-CE1 4.02Å
136	N	93	Very high	89.3	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.182	24%	0.243	C	C	.	.			trans	-98.5	8.4	-175.2	69.3	-15.7	0	0	0	114.1	F130 S138	F130-N136 WeakPolarHBondContact O-CA 3.49Å; N136-S138 VanDerWaalsContact CG-OG 3.23Å; N136-S138 PolarHBondContact ND2-OG 2.72Å; N136-S138 PolarHBondContact O-N 2.66Å; N136-S138 PolarHBondContact OD1-N 3.2Å; N136-S138 PolarHBondContact OD1-OG 2.87Å
137	C	93.6	Very high	88.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	61.3	25.4	-175.2	-158.9	0	0	0	0	115.3	C126 Q127 F130 W135 F146	C126-C137 HydrophobicContact CB-CB 3.93Å; C126-C137 WeakPolarHBondContact CB-SG 3.39Å; C126-C137 WeakPolarHBondContact SG-CB 3.35Å; C126-C137 CovalentContact SG-SG 2.01Å; C126-C137 PolarHBondContact SG-SG 2.97Å; Q127-C137 HydrophobicContact CG-CB 4.36Å; Q127-C137 VanDerWaalsContact CG-O 3.28Å; Q127-C137 WeakPolarHBondContact CG-O 3.17Å; F130-C137 HydrophobicContact CB-CB 4.14Å; W135-C137 HydrophobicContact CE3-CB 4.33Å; W135-C137 HydrophobicContact CH2-CB 3.71Å; W135-C137 WeakPolarHBondContact CH2-SG 3.38Å; W135-C137 HydrophobicContact CZ2-CB 3.84Å; W135-C137 HydrophobicContact CZ3-CB 3.96Å; C137-F146 WeakPolarHBondContact SG-CD1 3.39Å; C137-F146 WeakPolarHBondContact SG-CE1 3.36Å
138	S	88.3	Confident	88.3	Confident	37 Å²	37	46.9 Å²	46.9	26%	0.259	23%	0.233	S	C	.	.			trans	-103.1	165.2	165.3	70.9	0	0	0	0	111.6	N136	N136-S138 VanDerWaalsContact CG-OG 3.23Å; N136-S138 PolarHBondContact ND2-OG 2.72Å; N136-S138 PolarHBondContact O-N 2.66Å; N136-S138 PolarHBondContact OD1-N 3.2Å; N136-S138 PolarHBondContact OD1-OG 2.87Å
139	S	82.3	Confident	87.9	Confident	28 Å²	28	40.8 Å²	40.8	20%	0.196	21%	0.212	C	C	.	.			trans	-128	136.8	175	169	0	0	0	0	107.8	N141 S144 G147	S139-N141 PolarHBondContact O-N 3.16Å; S139-N141 PolarHBondContact OG-N 3.45Å; S139-N141 PolarHBondContact OG-O 3.32Å; S139-S144 WeakPolarHBondContact CB-O 2.98Å; S139-S144 PolarHBondContact OG-O 2.94Å; S139-S144 VanDerWaalsContact OG-O 3.12Å; S139-G147 WeakPolarHBondContact OG-CA 3.41Å
140	D	76.1	Confident	87.4	Confident	111 Å²	111	40.1 Å²	40.1	59%	0.594	21%	0.209	S	C	*	.	S	Bend	trans	-69.3	-21.1	174.5	-61.3	-21	0	0	0	111.2
141	N	75.5	Confident	87	Confident	69 Å²	69	44.3 Å²	44.3	37%	0.369	23%	0.231	S	C	.	.	S	Bend	trans	-90.8	110.6	172.1	-174	-14.7	0	0	0	110.2	S139 A143 S144	S139-N141 PolarHBondContact O-N 3.16Å; S139-N141 PolarHBondContact OG-N 3.45Å; S139-N141 PolarHBondContact OG-O 3.32Å; N141-A143 PolarHBondContact O-N 3.29Å; N141-A143 VanDerWaalsContact OD1-CB 3.24Å; N141-A143 WeakPolarHBondContact OD1-CB 3.28Å; N141-A143 PolarHBondContact OD1-N 3.32Å; N141-S144 PolarHBondContact O-N 3Å
142	E	74.3	Confident	86.8	Confident	183 Å²	183	40.1 Å²	40.1	86%	0.855	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.7	177.5	-63.4	-171.3	168.1	0	0	113.8	L71	L71-E142 WeakPolarHBondContact CD1-O 3.38Å
143	A	77.3	Confident	86.9	Confident	66 Å²	66	37.6 Å²	37.6	55%	0.545	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-12.3	177.6	0	0	0	0	0	114	N68 N141	N68-A143 PolarHBondContact ND2-O 2.98Å; N141-A143 PolarHBondContact O-N 3.29Å; N141-A143 VanDerWaalsContact OD1-CB 3.24Å; N141-A143 WeakPolarHBondContact OD1-CB 3.28Å; N141-A143 PolarHBondContact OD1-N 3.32Å
144	S	86.6	Confident	87.1	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.021	21%	0.205	C	C	.	.			trans	-123.7	121.6	-178.5	-174.8	0	0	0	0	111.1	S139 N141 F146 G147	S139-S144 WeakPolarHBondContact CB-O 2.98Å; S139-S144 PolarHBondContact OG-O 2.94Å; S139-S144 VanDerWaalsContact OG-O 3.12Å; N141-S144 PolarHBondContact O-N 3Å; S144-F146 VanDerWaalsContact C-N 3.3Å; S144-F146 PolarHBondContact O-N 3.12Å; S144-G147 VanDerWaalsContact OG-CA 3.3Å; S144-G147 WeakPolarHBondContact OG-CA 3.29Å; S144-G147 PolarHBondContact OG-N 2.93Å
145	A	88.2	Confident	87.3	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	21%	0.207	C	C	.	.	S	Bend	trans	-64.4	-34.3	-174	0	0	0	0	0	113.9	N68 L71 I123	N68-A145 PolarHBondContact OD1-N 3.41Å; L71-A145 HydrophobicContact CD1-CB 4.02Å; L71-A145 HydrophobicContact CD2-CB 4.32Å; L71-A145 HydrophobicContact CG-CB 4.25Å; I123-A145 HydrophobicContact CD1-CB 3.41Å; I123-A145 VanDerWaalsContact CD1-CB 3.41Å; I123-A145 HydrophobicContact CG1-CB 3.77Å; I123-A145 HydrophobicContact CG2-CB 4.5Å
146	F	90.5	Very high	87.4	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	21%	0.206	C	C	.	.	S	Bend	trans	-121.6	-5.2	-177.1	-57.6	-59.5	0	0	0	112.7	W67 I123 C126 C137 S144 V149 T150 A160 S164	W67-F146 AromaticContact CD1-CD2 3.91Å; W67-F146 AromaticContact CD1-CE2 3.98Å; W67-F146 HydrophobicContact CD2-CD2 4.07Å; W67-F146 AromaticContact CD2-CE2 3.92Å; W67-F146 HydrophobicContact CD2-CE2 3.92Å; W67-F146 AromaticContact CE2-CD2 3.71Å; W67-F146 HydrophobicContact CE3-CE2 4.49Å; W67-F146 HydrophobicContact CG-CD2 4.22Å; W67-F146 AromaticContact CG-CE2 3.91Å; W67-F146 HydrophobicContact CG-CE2 3.91Å; W67-F146 HydrophobicContact CZ2-CD2 4.22Å; W67-F146 AromaticContact NE1-CD2 3.59Å; I123-F146 HydrophobicContact CG1-CE1 4.22Å; I123-F146 HydrophobicContact CG1-CE2 4.4Å; I123-F146 HydrophobicContact CG1-CZ 3.83Å; C126-F146 HydrophobicContact CB-CE1 4.06Å; C137-F146 WeakPolarHBondContact SG-CD1 3.39Å; C137-F146 WeakPolarHBondContact SG-CE1 3.36Å; S144-F146 VanDerWaalsContact C-N 3.3Å; S144-F146 PolarHBondContact O-N 3.12Å; F146-V149 HydrophobicContact CB-CG1 3.97Å; F146-V149 WeakPolarHBondContact O-CG1 2.98Å; F146-T150 HydrophobicContact CB-CG2 3.58Å; F146-T150 HydrophobicContact CD2-CG2 4.18Å; F146-T150 HydrophobicContact CG-CG2 4.32Å; F146-A160 HydrophobicContact CD1-CB 4.22Å; F146-A160 HydrophobicContact CD2-CB 3.96Å; F146-A160 HydrophobicContact CE1-CB 4.35Å; F146-A160 HydrophobicContact CE2-CB 4.1Å; F146-A160 HydrophobicContact CG-CB 4.02Å; F146-A160 HydrophobicContact CZ-CB 4.29Å; F146-S164 VanDerWaalsContact CE2-OG 3.24Å; F146-S164 WeakPolarHBondContact CE2-OG 3.41Å; F146-S164 WeakPolarHBondContact CZ-OG 3.44Å
147	G	86.9	Confident	87.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	66.4	-152.5	178.7	0	0	0	0	0	113.7	S139 S144 V149 T150	S139-G147 WeakPolarHBondContact OG-CA 3.41Å; S144-G147 VanDerWaalsContact OG-CA 3.3Å; S144-G147 WeakPolarHBondContact OG-CA 3.29Å; S144-G147 PolarHBondContact OG-N 2.93Å; G147-V149 PolarHBondContact O-N 3.18Å; G147-T150 PolarHBondContact O-OG1 2.85Å
148	P	86.6	Confident	87.8	Confident	24 Å²	24	35.7 Å²	35.7	16%	0.156	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-65.4	-18.8	-173.4	-14.9	23.2	0	0	0	114.8	T150 L151 T338 Q339	P148-T150 PolarHBondContact O-N 2.91Å; P148-L151 VanDerWaalsContact O-CB 3.3Å; P148-L151 WeakPolarHBondContact O-CB 3.45Å; P148-L151 PolarHBondContact O-N 2.9Å; P148-T338 VanDerWaalsContact CB-O 3.29Å; P148-T338 WeakPolarHBondContact CB-O 3.4Å; P148-T338 WeakPolarHBondContact CG-O 2.89Å; P148-Q339 HydrophobicContact CB-CB 4.33Å; P148-Q339 HydrophobicContact CG-CB 3.33Å; P148-Q339 HydrophobicContact CG-CG 4.41Å
149	V	88.4	Confident	88.2	Confident	10 Å²	10	33.9 Å²	33.9	6%	0.061	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-55.1	-31.2	-178.6	78.9	0	0	0	0	111.7	W135 F146 G147 L151 T152 E156 A157	W135-V149 HydrophobicContact CZ2-CB 4.49Å; W135-V149 HydrophobicContact CZ2-CG1 3.73Å; W135-V149 HydrophobicContact CZ2-CG2 4.46Å; F146-V149 HydrophobicContact CB-CG1 3.97Å; F146-V149 WeakPolarHBondContact O-CG1 2.98Å; G147-V149 PolarHBondContact O-N 3.18Å; V149-L151 PolarHBondContact O-N 3.37Å; V149-T152 PolarHBondContact O-N 3.16Å; V149-T152 VanDerWaalsContact O-N 3.07Å; V149-T152 PolarHBondContact O-OG1 3.21Å; V149-E156 HydrophobicContact CG2-CB 3.43Å; V149-E156 VanDerWaalsContact CG2-CB 3.43Å; V149-E156 HydrophobicContact CG2-CG 4.38Å; V149-A157 WeakPolarHBondContact O-CB 3.42Å
150	T	86.9	Confident	89	Confident	4 Å²	4	32.6 Å²	32.6	3%	0.025	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-69.6	-10.4	179	62	0	0	0	0	114.2	Y65 W67 F146 G147 P148	Y65-T150 PolarHBondContact OH-O 3.3Å; W67-T150 HydrophobicContact CH2-CG2 4.14Å; W67-T150 HydrophobicContact CZ2-CG2 3.46Å; W67-T150 VanDerWaalsContact CZ2-CG2 3.46Å; F146-T150 HydrophobicContact CB-CG2 3.58Å; F146-T150 HydrophobicContact CD2-CG2 4.18Å; F146-T150 HydrophobicContact CG-CG2 4.32Å; G147-T150 PolarHBondContact O-OG1 2.85Å; P148-T150 PolarHBondContact O-N 2.91Å
151	L	86.6	Confident	90	Very high	87 Å²	87	27.3 Å²	27.3	46%	0.455	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-90.3	-16.9	174.4	-55.8	177.7	0	0	0	112.1	P148 V149 R237	P148-L151 VanDerWaalsContact O-CB 3.3Å; P148-L151 WeakPolarHBondContact O-CB 3.45Å; P148-L151 PolarHBondContact O-N 2.9Å; V149-L151 PolarHBondContact O-N 3.37Å; L151-R237 PolarHBondContact O-NH1 2.66Å
152	T	90.4	Very high	91.1	Very high	46 Å²	46	24 Å²	24	28%	0.282	13%	0.131	S	C	.	.	S	Bend	trans	-91.3	161.7	-178.9	73.6	0	0	0	0	111.9	V149 S154 A157	V149-T152 PolarHBondContact O-N 3.16Å; V149-T152 VanDerWaalsContact O-N 3.07Å; V149-T152 PolarHBondContact O-OG1 3.21Å; T152-S154 VanDerWaalsContact C-N 3.28Å; T152-S154 WeakPolarHBondContact OG1-CB 3.48Å; T152-S154 PolarHBondContact OG1-N 3.48Å; T152-S154 PolarHBondContact OG1-OG 2.83Å; T152-A157 WeakPolarHBondContact O-CB 3.22Å
153	G	95.1	Very high	92.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.09	C	C	.	.			trans	-90	27.1	168.4	0	0	0	0	0	113.9	Y324 L325 D326	G153-Y324 CarbonylContact O-C 3.52Å; G153-L325 PolarHBondContact O-N 3.37Å; G153-D326 WeakPolarHBondContact CA-OD2 3.13Å; G153-D326 PolarHBondContact N-OD2 3.03Å; G153-D326 PolarHBondContact O-N 3.34Å
154	S	96.3	Very high	93.3	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.014	6%	0.064	C	C	.	.	S	Bend	trans	-76.3	169.8	-172.1	63.6	0	0	0	0	114.1	T152 E156 A157 G158	T152-S154 VanDerWaalsContact C-N 3.28Å; T152-S154 WeakPolarHBondContact OG1-CB 3.48Å; T152-S154 PolarHBondContact OG1-N 3.48Å; T152-S154 PolarHBondContact OG1-OG 2.83Å; S154-E156 VanDerWaalsContact C-N 3.26Å; S154-E156 VanDerWaalsContact CB-OE2 3.31Å; S154-E156 WeakPolarHBondContact CB-OE2 3.45Å; S154-E156 PolarHBondContact O-N 3.3Å; S154-E156 PolarHBondContact OG-OE2 3.15Å; S154-A157 PolarHBondContact O-N 3.38Å; S154-A157 PolarHBondContact OG-N 3.48Å; S154-G158 PolarHBondContact O-N 2.81Å; S154-G158 VanDerWaalsContact O-N 3.12Å
155	R	97.1	Very high	93.8	Very high	67 Å²	67	12 Å²	12	25%	0.253	6%	0.063	S	C	.	.	H	α-helix	trans	-61.8	-38.3	174.2	-65.4	-177.1	-174.2	-156.1	3.5	111.5	G158 F159 Y292 A295 Y324	R155-G158 PolarHBondContact O-N 3.19Å; R155-G158 VanDerWaalsContact O-N 3.17Å; R155-F159 PolarHBondContact O-N 3.18Å; R155-Y292 HydrophobicContact CB-CD2 3.79Å; R155-Y292 HydrophobicContact CB-CE2 3.39Å; R155-Y292 WeakPolarHBondContact O-CD2 3.36Å; R155-A295 HydrophobicContact CG-CB 4.13Å; R155-Y324 HydrophobicContact CG-CD1 3.51Å; R155-Y324 HydrophobicContact CG-CD2 4.03Å; R155-Y324 HydrophobicContact CG-CE1 3.83Å; R155-Y324 HydrophobicContact CG-CE2 4.3Å; R155-Y324 HydrophobicContact CG-CG 3.59Å; R155-Y324 VanDerWaalsContact NE-CE1 3.27Å; R155-Y324 PolarHBondContact NH2-OH 2.93Å
156	E	96.2	Very high	94.3	Very high	6 Å²	6	11.9 Å²	11.9	3%	0.028	6%	0.061	C	C	.	.	H	α-helix	trans	-63.4	-44.4	179.7	-66.6	70.1	-147.9	0	0	110.7	W135 V149 S154 G158 F159 A160 Y292 S328 Y331	W135-E156 HydrophobicContact CB-CG 4.09Å; W135-E156 HydrophobicContact CD2-CB 3.84Å; W135-E156 HydrophobicContact CD2-CG 3.56Å; W135-E156 HydrophobicContact CE3-CB 3.57Å; W135-E156 HydrophobicContact CE3-CG 3.27Å; W135-E156 HydrophobicContact CG-CG 3.95Å; W135-E156 HydrophobicContact CH2-CB 3.97Å; W135-E156 HydrophobicContact CZ2-CB 4.26Å; W135-E156 HydrophobicContact CZ3-CB 3.63Å; W135-E156 HydrophobicContact CZ3-CG 3.84Å; V149-E156 HydrophobicContact CG2-CB 3.43Å; V149-E156 VanDerWaalsContact CG2-CB 3.43Å; V149-E156 HydrophobicContact CG2-CG 4.38Å; S154-E156 VanDerWaalsContact C-N 3.26Å; S154-E156 VanDerWaalsContact CB-OE2 3.31Å; S154-E156 WeakPolarHBondContact CB-OE2 3.45Å; S154-E156 PolarHBondContact O-N 3.3Å; S154-E156 PolarHBondContact OG-OE2 3.15Å; E156-G158 VanDerWaalsContact C-N 3.3Å; E156-G158 PolarHBondContact O-N 3.32Å; E156-F159 PolarHBondContact O-N 3.28Å; E156-A160 WeakPolarHBondContact O-CB 3.45Å; E156-A160 PolarHBondContact O-N 3.47Å; E156-Y292 HydrophobicContact CG-CE2 4.19Å; E156-Y292 PolarHBondContact OE1-OH 3.34Å; E156-S328 VanDerWaalsContact CD-OG 3.29Å; E156-S328 PolarHBondContact OE1-OG 2.81Å; E156-S328 WeakPolarHBondContact OE2-CB 3.18Å; E156-S328 PolarHBondContact OE2-OG 3.38Å; E156-Y331 HydrophobicContact CG-CE2 4.34Å
157	A	96.1	Very high	94.7	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.008	6%	0.061	C	C	.	.	H	α-helix	trans	-58.9	-44.5	172.6	0	0	0	0	0	110.9	V149 T152 S154 F159 A160 H161	V149-A157 WeakPolarHBondContact O-CB 3.42Å; T152-A157 WeakPolarHBondContact O-CB 3.22Å; S154-A157 PolarHBondContact O-N 3.38Å; S154-A157 PolarHBondContact OG-N 3.48Å; A157-F159 PolarHBondContact O-N 3.48Å; A157-A160 PolarHBondContact O-N 3.43Å; A157-H161 PolarHBondContact O-CD2 2.84Å; A157-H161 VanDerWaalsContact O-CD2 3.28Å; A157-H161 PolarHBondContact O-N 2.84Å
158	G	97.7	Very high	95.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-60.5	-42.4	176.9	0	0	0	0	0	113.6	S154 R155 E156 A162 N244	S154-G158 PolarHBondContact O-N 2.81Å; S154-G158 VanDerWaalsContact O-N 3.12Å; R155-G158 PolarHBondContact O-N 3.19Å; R155-G158 VanDerWaalsContact O-N 3.17Å; E156-G158 VanDerWaalsContact C-N 3.3Å; E156-G158 PolarHBondContact O-N 3.32Å; G158-A162 PolarHBondContact O-N 3Å; G158-A162 VanDerWaalsContact O-N 3.14Å; G158-N244 WeakPolarHBondContact CA-ND2 3.28Å; G158-N244 WeakPolarHBondContact O-CB 3.38Å
159	F	98.1	Very high	95.9	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-64.7	-44.7	173.9	-178.1	-87.9	0	0	0	112.2	C126 Q129 F130 R155 E156 A157 H161 A162 I163 L288 R289 Y292 I322	C126-F159 HydrophobicContact CB-CE1 3.95Å; C126-F159 VanDerWaalsContact SG-CE1 3.52Å; Q129-F159 HydrophobicContact CB-CZ 4.43Å; F130-F159 HydrophobicContact CD2-CD1 4.24Å; F130-F159 AromaticContact CD2-CE1 4Å; F130-F159 HydrophobicContact CD2-CE1 4Å; F130-F159 HydrophobicContact CD2-CZ 4.4Å; F130-F159 AromaticContact CE2-CD1 3.45Å; F130-F159 HydrophobicContact CE2-CD1 3.45Å; F130-F159 VanDerWaalsContact CE2-CD1 3.45Å; F130-F159 AromaticContact CE2-CD2 4Å; F130-F159 HydrophobicContact CE2-CD2 4Å; F130-F159 AromaticContact CE2-CE1 3.46Å; F130-F159 HydrophobicContact CE2-CE1 3.46Å; F130-F159 VanDerWaalsContact CE2-CE1 3.46Å; F130-F159 AromaticContact CE2-CE2 3.97Å; F130-F159 HydrophobicContact CE2-CE2 3.97Å; F130-F159 AromaticContact CE2-CG 3.74Å; F130-F159 HydrophobicContact CE2-CG 3.74Å; F130-F159 AromaticContact CE2-CZ 3.72Å; F130-F159 HydrophobicContact CE2-CZ 3.72Å; F130-F159 HydrophobicContact CZ-CB 4.41Å; F130-F159 HydrophobicContact CZ-CD1 4.07Å; F130-F159 HydrophobicContact CZ-CD2 4.3Å; F130-F159 HydrophobicContact CZ-CE1 4.47Å; F130-F159 AromaticContact CZ-CG 3.99Å; F130-F159 HydrophobicContact CZ-CG 3.99Å; R155-F159 PolarHBondContact O-N 3.18Å; E156-F159 PolarHBondContact O-N 3.28Å; A157-F159 PolarHBondContact O-N 3.48Å; F159-H161 VanDerWaalsContact C-N 3.34Å; F159-H161 PolarHBondContact O-N 2.93Å; F159-A162 PolarHBondContact O-N 3.43Å; F159-A162 VanDerWaalsContact O-N 3.11Å; F159-I163 HydrophobicContact CD1-CB 4.33Å; F159-I163 HydrophobicContact CD1-CG2 4.02Å; F159-I163 HydrophobicContact CE1-CB 3.8Å; F159-I163 HydrophobicContact CE1-CG1 4.16Å; F159-I163 HydrophobicContact CE1-CG2 3.72Å; F159-I163 HydrophobicContact CZ-CB 4.04Å; F159-I163 HydrophobicContact CZ-CD1 4.34Å; F159-I163 HydrophobicContact CZ-CG1 4.18Å; F159-I163 HydrophobicContact CZ-CG2 4.46Å; F159-I163 WeakPolarHBondContact O-CG2 3.44Å; F159-I163 PolarHBondContact O-N 3.4Å; F159-L288 HydrophobicContact CD2-CB 4.21Å; F159-L288 HydrophobicContact CE2-CB 3.64Å; F159-L288 HydrophobicContact CZ-CB 4.46Å; F159-R289 HydrophobicContact CE2-CB 4.32Å; F159-Y292 HydrophobicContact CB-CD2 3.92Å; F159-Y292 HydrophobicContact CB-CG 4.46Å; F159-I322 HydrophobicContact CB-CD1 4.34Å; F159-I322 HydrophobicContact CD2-CD1 4.02Å
160	A	97.4	Very high	96.4	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-56.3	-46.6	178.5	0	0	0	0	0	111.7	F146 E156 A157 A162 I163 S164	F146-A160 HydrophobicContact CD1-CB 4.22Å; F146-A160 HydrophobicContact CD2-CB 3.96Å; F146-A160 HydrophobicContact CE1-CB 4.35Å; F146-A160 HydrophobicContact CE2-CB 4.1Å; F146-A160 HydrophobicContact CG-CB 4.02Å; F146-A160 HydrophobicContact CZ-CB 4.29Å; E156-A160 WeakPolarHBondContact O-CB 3.45Å; E156-A160 PolarHBondContact O-N 3.47Å; A157-A160 PolarHBondContact O-N 3.43Å; A160-A162 PolarHBondContact O-N 3.03Å; A160-I163 WeakPolarHBondContact O-CG2 3.11Å; A160-S164 VanDerWaalsContact O-CB 3.28Å; A160-S164 WeakPolarHBondContact O-CB 3.47Å; A160-S164 PolarHBondContact O-N 3.01Å; A160-S164 PolarHBondContact O-OG 3.5Å
161	H	97.9	Very high	96.9	Very high	1 Å²	1	11.5 Å²	11.5	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-59.3	-45.9	174	-87	-86.3	0	0	0	112.7	W67 A157 F159 A165 E223 N241 N244 N245	W67-H161 AromaticContact CH2-CE1 3.67Å; W67-H161 AromaticContact CH2-NE2 3.62Å; W67-H161 AromaticContact CZ3-CE1 3.73Å; W67-H161 AromaticContact CZ3-ND1 3.88Å; A157-H161 PolarHBondContact O-CD2 2.84Å; A157-H161 VanDerWaalsContact O-CD2 3.28Å; A157-H161 PolarHBondContact O-N 2.84Å; F159-H161 VanDerWaalsContact C-N 3.34Å; F159-H161 PolarHBondContact O-N 2.93Å; H161-A165 WeakPolarHBondContact O-CB 3.48Å; H161-A165 PolarHBondContact O-N 3.44Å; H161-A165 VanDerWaalsContact O-N 3.08Å; H161-E223 IonicContact CE1-OE1 3.96Å; H161-N241 VanDerWaalsContact NE2-CG 3.33Å; H161-N241 PolarHBondContact NE2-ND2 2.9Å; H161-N241 PolarHBondContact NE2-OD1 3.26Å; H161-N244 HydrophobicContact CB-CB 3.91Å; H161-N245 WeakPolarHBondContact CB-OD1 3.26Å; H161-N245 PolarHBondContact ND1-OD1 3.14Å; H161-N245 PolarHBondContact O-OD1 3.27Å
162	A	98.6	Very high	97.5	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-65.2	-50	-179.5	0	0	0	0	0	112.4	G158 F159 A160 S164 A165 A166 N244 G248 L288 I322	G158-A162 PolarHBondContact O-N 3Å; G158-A162 VanDerWaalsContact O-N 3.14Å; F159-A162 PolarHBondContact O-N 3.43Å; F159-A162 VanDerWaalsContact O-N 3.11Å; A160-A162 PolarHBondContact O-N 3.03Å; A162-S164 PolarHBondContact O-N 3.26Å; A162-A165 PolarHBondContact O-N 3.28Å; A162-A166 WeakPolarHBondContact O-CB 3.49Å; A162-A166 PolarHBondContact O-N 3.07Å; A162-N244 VanDerWaalsContact CA-O 3.3Å; A162-N244 WeakPolarHBondContact CA-O 3.28Å; A162-N244 WeakPolarHBondContact CB-O 3.47Å; A162-G248 WeakPolarHBondContact O-CA 3.17Å; A162-L288 HydrophobicContact CB-CD1 4.36Å; A162-L288 HydrophobicContact CB-CD2 4.12Å; A162-I322 HydrophobicContact CB-CD1 4.28Å; A162-I322 HydrophobicContact CB-CG1 4.43Å
163	I	98.6	Very high	97.9	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-68.5	-36	-176.5	-164.6	63.5	0	0	0	111.9	E125 C126 F159 A160 A166 G167 F281 L288	E125-I163 HydrophobicContact CB-CD1 4.42Å; E125-I163 HydrophobicContact CB-CG1 4.46Å; E125-I163 HydrophobicContact CG-CD1 4.14Å; C126-I163 HydrophobicContact CB-CG2 4.05Å; F159-I163 HydrophobicContact CD1-CB 4.33Å; F159-I163 HydrophobicContact CD1-CG2 4.02Å; F159-I163 HydrophobicContact CE1-CB 3.8Å; F159-I163 HydrophobicContact CE1-CG1 4.16Å; F159-I163 HydrophobicContact CE1-CG2 3.72Å; F159-I163 HydrophobicContact CZ-CB 4.04Å; F159-I163 HydrophobicContact CZ-CD1 4.34Å; F159-I163 HydrophobicContact CZ-CG1 4.18Å; F159-I163 HydrophobicContact CZ-CG2 4.46Å; F159-I163 WeakPolarHBondContact O-CG2 3.44Å; F159-I163 PolarHBondContact O-N 3.4Å; A160-I163 WeakPolarHBondContact O-CG2 3.11Å; I163-A166 PolarHBondContact O-N 2.88Å; I163-G167 PolarHBondContact O-N 3.07Å; I163-F281 HydrophobicContact CD1-CE1 3.88Å; I163-F281 HydrophobicContact CD1-CZ 3.79Å; I163-F281 HydrophobicContact CG1-CE1 4.36Å; I163-F281 HydrophobicContact CG1-CZ 4.32Å; I163-L288 HydrophobicContact CB-CD1 4.34Å; I163-L288 HydrophobicContact CD1-CD1 3.74Å
164	S	98.3	Very high	98.1	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-65.8	-44.4	174	-66.9	0	0	0	0	112	F146 A160 A162 A166 G167 V168	F146-S164 VanDerWaalsContact CE2-OG 3.24Å; F146-S164 WeakPolarHBondContact CE2-OG 3.41Å; F146-S164 WeakPolarHBondContact CZ-OG 3.44Å; A160-S164 VanDerWaalsContact O-CB 3.28Å; A160-S164 WeakPolarHBondContact O-CB 3.47Å; A160-S164 PolarHBondContact O-N 3.01Å; A160-S164 PolarHBondContact O-OG 3.5Å; A162-S164 PolarHBondContact O-N 3.26Å; S164-A166 VanDerWaalsContact C-N 3.34Å; S164-A166 PolarHBondContact O-N 3.29Å; S164-G167 PolarHBondContact O-N 2.84Å; S164-V168 PolarHBondContact O-N 2.84Å; S164-V168 VanDerWaalsContact O-N 3.15Å
165	A	98.7	Very high	98.2	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-64.9	-39	176.4	0	0	0	0	0	112.2	H161 A162 V169 I219 N245 R249	H161-A165 WeakPolarHBondContact O-CB 3.48Å; H161-A165 PolarHBondContact O-N 3.44Å; H161-A165 VanDerWaalsContact O-N 3.08Å; A162-A165 PolarHBondContact O-N 3.28Å; A165-V169 WeakPolarHBondContact O-CG2 3.46Å; A165-V169 PolarHBondContact O-N 2.88Å; A165-V169 VanDerWaalsContact O-N 3.15Å; A165-I219 HydrophobicContact CB-CD1 3.94Å; A165-N245 HydrophobicContact CB-CB 4.22Å; A165-N245 WeakPolarHBondContact CB-O 3.25Å; A165-R249 HydrophobicContact CB-CG 4.13Å
166	A	98.9	Very high	98.2	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-61.8	-44.6	173.8	0	0	0	0	0	111.7	A162 I163 S164 V168 V169 H170 G248 V252 F281 I284 L288	A162-A166 WeakPolarHBondContact O-CB 3.49Å; A162-A166 PolarHBondContact O-N 3.07Å; I163-A166 PolarHBondContact O-N 2.88Å; S164-A166 VanDerWaalsContact C-N 3.34Å; S164-A166 PolarHBondContact O-N 3.29Å; A166-V168 PolarHBondContact O-N 2.95Å; A166-V169 PolarHBondContact O-N 2.94Å; A166-H170 WeakPolarHBondContact O-CB 3.46Å; A166-H170 PolarHBondContact O-N 3.03Å; A166-G248 WeakPolarHBondContact CB-O 3.37Å; A166-V252 HydrophobicContact CB-CG2 3.75Å; A166-V252 WeakPolarHBondContact O-CG2 3.23Å; A166-F281 HydrophobicContact CB-CE2 4.2Å; A166-F281 HydrophobicContact CB-CZ 4.41Å; A166-I284 HydrophobicContact CB-CG2 4.05Å; A166-L288 HydrophobicContact CB-CD1 3.97Å
167	G	98.8	Very high	98.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.3	-44.7	178.5	0	0	0	0	0	112.8	G118 I163 S164 H170 A171	G118-G167 VanDerWaalsContact CA-C 3.48Å; G118-G167 VanDerWaalsContact CA-O 3.24Å; G118-G167 WeakPolarHBondContact CA-O 3.42Å; G118-G167 CarbonylContact O-C 3.54Å; G118-G167 VanDerWaalsContact O-CA 3.32Å; G118-G167 WeakPolarHBondContact O-CA 3.46Å; I163-G167 PolarHBondContact O-N 3.07Å; S164-G167 PolarHBondContact O-N 2.84Å; G167-H170 PolarHBondContact O-N 3.2Å; G167-A171 WeakPolarHBondContact O-CB 3.37Å; G167-A171 PolarHBondContact O-N 3.04Å
168	V	98.7	Very high	98.4	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.9	-44.8	176.8	174.3	0	0	0	0	112.1	W66 I115 S164 A166 H170 A171 L172 A215 I219	W66-V168 HydrophobicContact CH2-CG2 3.38Å; W66-V168 HydrophobicContact CZ3-CG2 3.32Å; I115-V168 HydrophobicContact CG1-CG1 4.33Å; I115-V168 HydrophobicContact CG2-CG2 4.28Å; S164-V168 PolarHBondContact O-N 2.84Å; S164-V168 VanDerWaalsContact O-N 3.15Å; A166-V168 PolarHBondContact O-N 2.95Å; V168-H170 VanDerWaalsContact C-N 3.31Å; V168-H170 PolarHBondContact O-N 2.87Å; V168-A171 PolarHBondContact O-N 3.39Å; V168-L172 HydrophobicContact CG1-CD1 3.58Å; V168-L172 HydrophobicContact CG1-CG 4.24Å; V168-L172 WeakPolarHBondContact O-CB 3.39Å; V168-L172 VanDerWaalsContact O-CG 3.28Å; V168-L172 WeakPolarHBondContact O-CG 3.33Å; V168-L172 PolarHBondContact O-N 2.01Å; V168-A215 HydrophobicContact CB-CB 4.49Å; V168-A215 HydrophobicContact CG1-CB 3.84Å; V168-I219 HydrophobicContact CB-CD1 4.1Å; V168-I219 HydrophobicContact CG1-CD1 4.32Å; V168-I219 HydrophobicContact CG2-CD1 4.22Å
169	V	98.9	Very high	98.3	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.2	-41.7	176.8	173.9	0	0	0	0	111	A165 A166 A173 I208 A211 A215 R249 V252	A165-V169 WeakPolarHBondContact O-CG2 3.46Å; A165-V169 PolarHBondContact O-N 2.88Å; A165-V169 VanDerWaalsContact O-N 3.15Å; A166-V169 PolarHBondContact O-N 2.94Å; V169-A173 WeakPolarHBondContact O-CB 3.01Å; V169-A173 PolarHBondContact O-N 2.94Å; V169-I208 HydrophobicContact CG1-CG2 4.19Å; V169-A211 HydrophobicContact CG1-CB 4Å; V169-A211 VanDerWaalsContact O-CB 3.29Å; V169-A211 WeakPolarHBondContact O-CB 3.44Å; V169-A215 HydrophobicContact CG2-CB 3.49Å; V169-A215 VanDerWaalsContact CG2-CB 3.49Å; V169-R249 HydrophobicContact CG2-CB 4.02Å; V169-R249 HydrophobicContact CG2-CG 3.62Å; V169-V252 HydrophobicContact CB-CB 4.43Å; V169-V252 HydrophobicContact CB-CG2 4.14Å; V169-V252 HydrophobicContact CG1-CB 3.93Å; V169-V252 HydrophobicContact CG1-CG1 3.81Å; V169-V252 HydrophobicContact CG1-CG2 4.19Å
170	H	98.8	Very high	98.2	Very high	25 Å²	25	22.8 Å²	22.8	12%	0.116	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-50.8	179	-165.7	-79.9	0	0	0	111.7	L121 A166 G167 V168 A173 R174 L278 S279 F281	L121-H170 HydrophobicContact CD2-CB 4.48Å; A166-H170 WeakPolarHBondContact O-CB 3.46Å; A166-H170 PolarHBondContact O-N 3.03Å; G167-H170 PolarHBondContact O-N 3.2Å; V168-H170 VanDerWaalsContact C-N 3.31Å; V168-H170 PolarHBondContact O-N 2.87Å; H170-A173 PolarHBondContact O-N 3.04Å; H170-R174 PolarHBondContact O-N 3.32Å; H170-R174 VanDerWaalsContact O-N 3.12Å; H170-L278 WeakPolarHBondContact O-CD1 3.32Å; H170-S279 PolarHBondContact NE2-O 2.98Å; H170-F281 HydrophobicContact CB-CD2 3.89Å; H170-F281 HydrophobicContact CB-CE2 4.04Å; H170-F281 AromaticContact CD2-CD2 3.75Å; H170-F281 AromaticContact CG-CD2 3.72Å
171	A	98.7	Very high	98.1	Very high	7 Å²	7	23 Å²	23	6%	0.058	11%	0.113	C	C	.	.	H	α-helix	trans	-64.1	-43.3	-179.5	0	0	0	0	0	113	V114 I117 G167 V168 S175	V114-A171 VanDerWaalsContact CG1-C 3.45Å; V114-A171 HydrophobicContact CG1-CB 3.88Å; V114-A171 WeakPolarHBondContact CG1-O 3.49Å; V114-A171 WeakPolarHBondContact O-CB 3.38Å; I117-A171 HydrophobicContact CG2-CB 4.32Å; G167-A171 WeakPolarHBondContact O-CB 3.37Å; G167-A171 PolarHBondContact O-N 3.04Å; V168-A171 PolarHBondContact O-N 3.39Å; A171-S175 VanDerWaalsContact O-CB 3.27Å; A171-S175 WeakPolarHBondContact O-CB 3.35Å; A171-S175 PolarHBondContact O-N 3.5Å; A171-S175 PolarHBondContact O-OG 3.43Å
172	L	98.7	Very high	97.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-46.6	177.2	-74	170.5	0	0	0	111.7	H111 V114 V168 R174 S175 C176 L181 A211 F214 A215	H111-L172 HydrophobicContact CB-CD2 4.44Å; V114-L172 HydrophobicContact CB-CD2 4.18Å; V114-L172 HydrophobicContact CG1-CD2 3.81Å; V114-L172 HydrophobicContact CG1-CG 4.16Å; V168-L172 HydrophobicContact CG1-CD1 3.58Å; V168-L172 HydrophobicContact CG1-CG 4.24Å; V168-L172 WeakPolarHBondContact O-CB 3.39Å; V168-L172 VanDerWaalsContact O-CG 3.28Å; V168-L172 WeakPolarHBondContact O-CG 3.33Å; V168-L172 PolarHBondContact O-N 2.01Å; L172-R174 VanDerWaalsContact C-N 3.3Å; L172-R174 PolarHBondContact O-N 3.27Å; L172-S175 PolarHBondContact O-N 3.46Å; L172-C176 PolarHBondContact O-N 3.47Å; L172-C176 PolarHBondContact O-SG 3.18Å; L172-L181 HydrophobicContact CD2-CD1 3.82Å; L172-A211 HydrophobicContact CB-CB 3.63Å; L172-F214 HydrophobicContact CD1-CB 4.25Å; L172-F214 HydrophobicContact CD1-CD1 3.55Å; L172-F214 HydrophobicContact CD1-CE1 4.36Å; L172-F214 HydrophobicContact CD1-CG 4.26Å; L172-F214 HydrophobicContact CD2-CD1 4.37Å; L172-A215 HydrophobicContact CD1-CB 4.45Å
173	A	98.7	Very high	97.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62	-40.3	-178.2	0	0	0	0	0	111.8	V169 H170 K177 D206 N207 I208 A211 L278	V169-A173 WeakPolarHBondContact O-CB 3.01Å; V169-A173 PolarHBondContact O-N 2.94Å; H170-A173 PolarHBondContact O-N 3.04Å; A173-K177 PolarHBondContact O-N 3.29Å; A173-D206 HydrophobicContact CB-CB 4.42Å; A173-N207 PolarHBondContact O-N 3.5Å; A173-N207 VanDerWaalsContact O-N 3.15Å; A173-I208 HydrophobicContact CB-CG1 4.17Å; A173-A211 HydrophobicContact CB-CB 3.67Å; A173-L278 HydrophobicContact CB-CD1 3.96Å; A173-L278 HydrophobicContact CB-CD2 4.22Å; A173-L278 HydrophobicContact CB-CG 4.43Å
174	R	98.5	Very high	97.7	Very high	73 Å²	73	37.2 Å²	37.2	28%	0.275	18%	0.18	S	C	.	.	H	α-helix	trans	-66.4	-45.4	173.6	178.2	51.9	52.2	122.9	11.6	112.1	H170 L172 C176 K177 E178 D206 L278	H170-R174 PolarHBondContact O-N 3.32Å; H170-R174 VanDerWaalsContact O-N 3.12Å; L172-R174 VanDerWaalsContact C-N 3.3Å; L172-R174 PolarHBondContact O-N 3.27Å; R174-C176 VanDerWaalsContact C-N 3.28Å; R174-C176 PolarHBondContact O-N 2.96Å; R174-K177 WeakPolarHBondContact O-CB 3.45Å; R174-K177 PolarHBondContact O-N 2.98Å; R174-K177 VanDerWaalsContact O-N 3.08Å; R174-E178 WeakPolarHBondContact CD-OE1 3.46Å; R174-E178 WeakPolarHBondContact O-CG 3.3Å; R174-E178 PolarHBondContact O-N 3.04Å; R174-D206 WeakPolarHBondContact CA-OD1 3.39Å; R174-D206 IonicContact CZ-OD1 3.78Å; R174-D206 IonicContact CZ-OD2 2.8Å; R174-D206 IonicContact NE-OD1 3.11Å; R174-D206 PolarHBondContact NE-OD1 3.19Å; R174-D206 IonicContact NE-OD2 2.74Å; R174-D206 IonicContact NH2-OD1 2.85Å; R174-D206 PolarHBondContact NH2-OD1 3.06Å; R174-D206 IonicContact NH2-OD2 3.08Å; R174-D206 PolarHBondContact NH2-OD2 3.07Å; R174-D206 VanDerWaalsContact NH2-OD2 3.12Å; R174-L278 HydrophobicContact CB-CD1 4.05Å
175	S	98.4	Very high	97.6	Very high	5 Å²	5	38.9 Å²	38.9	4%	0.035	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-31.2	-178.5	-66.1	0	0	0	0	112.6	V114 A171 L172 E178 A179 R180	V114-S175 VanDerWaalsContact CG1-OG 3.24Å; V114-S175 WeakPolarHBondContact CG1-OG 3.13Å; A171-S175 VanDerWaalsContact O-CB 3.27Å; A171-S175 WeakPolarHBondContact O-CB 3.35Å; A171-S175 PolarHBondContact O-N 3.5Å; A171-S175 PolarHBondContact O-OG 3.43Å; L172-S175 PolarHBondContact O-N 3.46Å; S175-E178 PolarHBondContact O-N 3.48Å; S175-A179 PolarHBondContact O-N 3.34Å; S175-R180 PolarHBondContact O-N 2.77Å
176	C	98.4	Very high	97.6	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.014	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-42.2	170.2	-66.9	0	0	0	0	112.9	L172 R174 E178 A179 C184 G185 N207 Y210	L172-C176 PolarHBondContact O-N 3.47Å; L172-C176 PolarHBondContact O-SG 3.18Å; R174-C176 VanDerWaalsContact C-N 3.28Å; R174-C176 PolarHBondContact O-N 2.96Å; C176-E178 VanDerWaalsContact C-N 3.27Å; C176-E178 PolarHBondContact O-N 3.5Å; C176-A179 PolarHBondContact O-N 2.92Å; C176-C184 WeakPolarHBondContact CA-SG 3.37Å; C176-C184 HydrophobicContact CB-CB 3.84Å; C176-C184 WeakPolarHBondContact CB-SG 3.32Å; C176-C184 WeakPolarHBondContact SG-CB 3.38Å; C176-C184 CovalentContact SG-SG 2.03Å; C176-C184 PolarHBondContact SG-SG 2.99Å; C176-G185 WeakPolarHBondContact CB-O 3.25Å; C176-G185 CarbonylContact O-C 3.53Å; C176-N207 HydrophobicContact CB-CB 3.74Å; C176-Y210 WeakPolarHBondContact SG-CD1 3.37Å
177	K	97.7	Very high	97.5	Very high	50 Å²	50	42.7 Å²	42.7	22%	0.217	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-35.1	175.5	167.4	178.4	175.5	163.9	0	111.9	A173 R174 A179 C204 D206 Q277	A173-K177 PolarHBondContact O-N 3.29Å; R174-K177 WeakPolarHBondContact O-CB 3.45Å; R174-K177 PolarHBondContact O-N 2.98Å; R174-K177 VanDerWaalsContact O-N 3.08Å; K177-A179 VanDerWaalsContact C-N 3.27Å; K177-A179 PolarHBondContact O-N 3.49Å; K177-C204 WeakPolarHBondContact CD-O 3.44Å; K177-C204 WeakPolarHBondContact CE-O 3.3Å; K177-C204 PolarHBondContact NZ-O 2.78Å; K177-C204 PolarHBondContact O-SG 3.01Å; K177-C204 VanDerWaalsContact O-SG 3.38Å; K177-D206 WeakPolarHBondContact CD-OD1 3.35Å; K177-Q277 VanDerWaalsContact NZ-OE1 3.08Å
178	E	97.3	Very high	97.3	Very high	81 Å²	81	52 Å²	52	38%	0.379	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6.9	-179.9	-66.4	172.6	169.5	0	0	113.5	R174 S175 C176 R180	R174-E178 WeakPolarHBondContact CD-OE1 3.46Å; R174-E178 WeakPolarHBondContact O-CG 3.3Å; R174-E178 PolarHBondContact O-N 3.04Å; S175-E178 PolarHBondContact O-N 3.48Å; C176-E178 VanDerWaalsContact C-N 3.27Å; C176-E178 PolarHBondContact O-N 3.5Å; E178-R180 HydrophobicContact CB-CG 4.04Å; E178-R180 PolarHBondContact O-N 3.39Å; E178-R180 IonicContact OE2-CZ 2.68Å; E178-R180 IonicContact OE2-NE 3.19Å; E178-R180 PolarHBondContact OE2-NE 2.82Å; E178-R180 VanDerWaalsContact OE2-NE 3.11Å; E178-R180 IonicContact OE2-NH1 3.09Å; E178-R180 PolarHBondContact OE2-NH1 3.4Å; E178-R180 VanDerWaalsContact OE2-NH1 3.08Å; E178-R180 IonicContact OE2-NH2 3.07Å; E178-R180 PolarHBondContact OE2-NH2 2.69Å
179	A	96.5	Very high	97.1	Very high	84 Å²	84	54.1 Å²	54.1	69%	0.694	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	32.6	-177.6	0	0	0	0	0	114.2	S175 C176 K177	S175-A179 PolarHBondContact O-N 3.34Å; C176-A179 PolarHBondContact O-N 2.92Å; K177-A179 VanDerWaalsContact C-N 3.27Å; K177-A179 PolarHBondContact O-N 3.49Å
180	R	95.9	Very high	96.9	Very high	151 Å²	151	61 Å²	61	57%	0.57	32%	0.319	S	S	*	.			trans	-83	-12.3	178	-67.7	-176.7	179.3	164.3	7.1	114	S175 E178	S175-R180 PolarHBondContact O-N 2.77Å; E178-R180 HydrophobicContact CB-CG 4.04Å; E178-R180 PolarHBondContact O-N 3.39Å; E178-R180 IonicContact OE2-CZ 2.68Å; E178-R180 IonicContact OE2-NE 3.19Å; E178-R180 PolarHBondContact OE2-NE 2.82Å; E178-R180 VanDerWaalsContact OE2-NE 3.11Å; E178-R180 IonicContact OE2-NH1 3.09Å; E178-R180 PolarHBondContact OE2-NH1 3.4Å; E178-R180 VanDerWaalsContact OE2-NH1 3.08Å; E178-R180 IonicContact OE2-NH2 3.07Å; E178-R180 PolarHBondContact OE2-NH2 2.69Å
181	L	95.8	Very high	96.8	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	33%	0.328	C	S	.	.			trans	-123.9	132.1	-177.6	-63.3	174.4	0	0	0	108.6	D110 V114 L172 S183 C184	D110-L181 HydrophobicContact CB-CD2 4.39Å; D110-L181 VanDerWaalsContact O-CD2 3.26Å; D110-L181 WeakPolarHBondContact O-CD2 3.45Å; V114-L181 HydrophobicContact CG2-CD1 4.49Å; V114-L181 HydrophobicContact CG2-CD2 3.94Å; V114-L181 HydrophobicContact CG2-CG 4.38Å; L172-L181 HydrophobicContact CD2-CD1 3.82Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 2.95Å; L181-C184 VanDerWaalsContact O-O 3.11Å
182	Y	93.9	Very high	96.6	Very high	223 Å²	223	65.7 Å²	65.7	88%	0.875	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-25	-176.1	-64.6	-78.7	0	0	0	113.4
183	S	95	Very high	96.4	Very high	56 Å²	56	73.6 Å²	73.6	39%	0.392	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-3.5	-172	59.4	0	0	0	0	114.5	H111 L181 Y210	H111-S183 PolarHBondContact CE1-OG 3.31Å; H111-S183 PolarHBondContact NE2-OG 3.37Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 2.95Å; S183-Y210 PolarHBondContact OG-OH 2.89Å
184	C	97.4	Very high	96.1	Very high	21 Å²	21	83 Å²	83	14%	0.142	43%	0.426	C	S	.	.			trans	-143.8	162.2	179.5	63.2	0	0	0	0	111.9	C176 L181 Y210	C176-C184 WeakPolarHBondContact CA-SG 3.37Å; C176-C184 HydrophobicContact CB-CB 3.84Å; C176-C184 WeakPolarHBondContact CB-SG 3.32Å; C176-C184 WeakPolarHBondContact SG-CB 3.38Å; C176-C184 CovalentContact SG-SG 2.03Å; C176-C184 PolarHBondContact SG-SG 2.99Å; L181-C184 VanDerWaalsContact O-O 3.11Å; C184-Y210 HydrophobicContact CB-CD1 3.59Å; C184-Y210 HydrophobicContact CB-CD2 3.75Å; C184-Y210 HydrophobicContact CB-CE1 3.77Å; C184-Y210 HydrophobicContact CB-CE2 3.94Å; C184-Y210 HydrophobicContact CB-CG 3.6Å
185	G	97.1	Very high	95.9	Very high	35 Å²	35	80.2 Å²	80.2	36%	0.361	42%	0.416	S	S	.	.			trans	-139.1	-153.2	172.9	0	0	0	0	0	110.6	C176 N207	C176-G185 WeakPolarHBondContact CB-O 3.25Å; C176-G185 CarbonylContact O-C 3.53Å; G185-N207 WeakPolarHBondContact O-CB 3.4Å; G185-N207 PolarHBondContact O-ND2 3.05Å
186	C	97.3	Very high	95.6	Very high	52 Å²	52	84.4 Å²	84.4	35%	0.351	44%	0.435	S	S	.	.	S	Bend	trans	-55.4	157.6	179.5	-50.7	0	0	0	0	113.5	K188 C204 N207	C186-K188 PolarHBondContact O-N 3.04Å; C186-C204 HydrophobicContact CB-CB 3.97Å; C186-C204 WeakPolarHBondContact CB-SG 3.07Å; C186-C204 VanDerWaalsContact SG-CA 3.56Å; C186-C204 WeakPolarHBondContact SG-CB 3.47Å; C186-C204 CovalentContact SG-SG 2.03Å; C186-C204 PolarHBondContact SG-SG 3.35Å; C186-N207 PolarHBondContact O-ND2 2.68Å
187	S	97.1	Very high	95.4	Very high	27 Å²	27	95.4 Å²	95.4	19%	0.189	48%	0.476	C	S	.	.			trans	-51.8	135.1	171.8	-171.8	0	0	0	0	111.5	A189 G205 D206 T276	S187-A189 VanDerWaalsContact OG-CB 3.31Å; S187-A189 WeakPolarHBondContact OG-CB 3.23Å; S187-A189 PolarHBondContact OG-N 3.06Å; S187-G205 PolarHBondContact N-O 3.32Å; S187-D206 WeakPolarHBondContact CB-O 3.24Å; S187-T276 PolarHBondContact OG-OG1 3.12Å
188	K	94.8	Very high	95.1	Very high	195 Å²	195	98.5 Å²	98.5	85%	0.848	50%	0.496	S	S	*	.			trans	-106.7	22.7	168.3	-58.4	-174.3	179.5	-173.6	0	111.3	C186	C186-K188 PolarHBondContact O-N 3.04Å
189	A	94.6	Very high	94.9	Very high	46 Å²	46	97.3 Å²	97.3	38%	0.38	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-66	143.5	178.2	0	0	0	0	0	110.3	S187 W201	S187-A189 VanDerWaalsContact OG-CB 3.31Å; S187-A189 WeakPolarHBondContact OG-CB 3.23Å; S187-A189 PolarHBondContact OG-N 3.06Å; A189-W201 PolarHBondContact O-NE1 3.32Å
190	D	94.7	Very high	94.8	Very high	145 Å²	145	97.2 Å²	97.2	78%	0.775	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-64.4	155.4	177.1	-58	-49.1	0	0	0	111.1	P192	D190-P192 WeakPolarHBondContact O-CD 3.44Å
191	R	95.5	Very high	94.9	Very high	82 Å²	82	93.1 Å²	93.1	31%	0.309	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-60.4	128.5	172.5	176.8	-168.7	179.9	89.9	4.2	109	D193 L195 H196 R197 W199 W201	R191-D193 PolarHBondContact O-N 2.96Å; R191-L195 HydrophobicContact CG-CB 4.49Å; R191-L195 HydrophobicContact CG-CD2 4.19Å; R191-L195 PolarHBondContact NH2-O 2.83Å; R191-H196 VanDerWaalsContact NH2-C 3.34Å; R191-H196 PolarHBondContact NH2-O 3.35Å; R191-R197 PolarHBondContact NH2-O 3.42Å; R191-W199 PolarHBondContact NH1-O 3.06Å; R191-W199 PolarHBondContact NH2-O 2.94Å; R191-W201 HydrophobicContact CB-CB 3.93Å; R191-W201 HydrophobicContact CB-CD2 4.33Å; R191-W201 HydrophobicContact CB-CG 3.79Å; R191-W201 HydrophobicContact CG-CB 3.9Å; R191-W201 HydrophobicContact CG-CG 4.15Å
192	P	95.3	Very high	94.8	Very high	47 Å²	47	94 Å²	94	31%	0.305	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-64.5	134.8	173.8	-23.4	35.7	0	0	0	112	D190 Q194 L195 W201 V258	D190-P192 WeakPolarHBondContact O-CD 3.44Å; P192-Q194 PolarHBondContact O-N 3.24Å; P192-L195 HydrophobicContact CB-CB 4.48Å; P192-L195 WeakPolarHBondContact O-CB 3.28Å; P192-L195 PolarHBondContact O-N 3.2Å; P192-W201 HydrophobicContact CG-CH2 4.24Å; P192-W201 HydrophobicContact CG-CZ3 4.24Å; P192-V258 HydrophobicContact CB-CG2 4.5Å; P192-V258 HydrophobicContact CG-CG2 3.71Å
193	D	94	Very high	94.8	Very high	167 Å²	167	86.4 Å²	86.4	89%	0.893	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.7	-178	-60.1	-40.1	0	0	0	113.2	R191 L195	R191-D193 PolarHBondContact O-N 2.96Å; D193-L195 PolarHBondContact O-N 3.25Å
194	Q	93.6	Very high	94.9	Very high	196 Å²	196	85.6 Å²	85.6	92%	0.916	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-5.5	-179.8	-61.8	176.1	-2.3	0	0	113.2	P192 H196	P192-Q194 PolarHBondContact O-N 3.24Å; Q194-H196 PolarHBondContact O-N 3.08Å
195	L	93.6	Very high	94.9	Very high	15 Å²	15	84.7 Å²	84.7	8%	0.079	45%	0.447	C	S	.	.	S	Bend	trans	-75.1	123.1	-179.3	-170	65.3	0	0	0	110.6	R191 P192 D193 R197 W199 W201 V258 C274	R191-L195 HydrophobicContact CG-CB 4.49Å; R191-L195 HydrophobicContact CG-CD2 4.19Å; R191-L195 PolarHBondContact NH2-O 2.83Å; P192-L195 HydrophobicContact CB-CB 4.48Å; P192-L195 WeakPolarHBondContact O-CB 3.28Å; P192-L195 PolarHBondContact O-N 3.2Å; D193-L195 PolarHBondContact O-N 3.25Å; L195-R197 PolarHBondContact O-N 2.64Å; L195-W199 HydrophobicContact CD1-CD2 4.4Å; L195-W199 HydrophobicContact CD1-CE3 3.42Å; L195-W199 VanDerWaalsContact CD1-CE3 3.42Å; L195-W199 HydrophobicContact CD1-CZ3 3.79Å; L195-W199 HydrophobicContact CG-CE3 4.29Å; L195-W201 HydrophobicContact CD2-CE3 3.8Å; L195-W201 HydrophobicContact CD2-CZ3 4.46Å; L195-V258 HydrophobicContact CD1-CG1 3.89Å; L195-C274 HydrophobicContact CD1-CB 4.45Å; L195-C274 HydrophobicContact CD2-CB 4.13Å
196	H	92.9	Very high	94.9	Very high	94 Å²	94	83 Å²	83	44%	0.435	43%	0.43	S	S	.	.			trans	-44.6	126.8	179.6	-172.6	-75.4	0	0	0	112.5	R191 Q194 D198 W199	R191-H196 VanDerWaalsContact NH2-C 3.34Å; R191-H196 PolarHBondContact NH2-O 3.35Å; Q194-H196 PolarHBondContact O-N 3.08Å; H196-D198 VanDerWaalsContact C-N 3.25Å; H196-D198 IonicContact CE1-OD2 3.15Å; H196-D198 PolarHBondContact CE1-OD2 3.09Å; H196-D198 VanDerWaalsContact CE1-OD2 3.28Å; H196-D198 PolarHBondContact ND1-N 3.16Å; H196-D198 IonicContact ND1-OD2 3.95Å; H196-D198 PolarHBondContact O-N 3.28Å; H196-D198 VanDerWaalsContact O-N 3.09Å; H196-W199 HydrophobicContact CB-CD2 3.67Å; H196-W199 HydrophobicContact CB-CE3 4.3Å; H196-W199 HydrophobicContact CB-CG 3.95Å; H196-W199 HydrophobicContact CB-CH2 4.21Å; H196-W199 HydrophobicContact CB-CZ2 3.52Å; H196-W199 AromaticContact CG-CE2 3.73Å; H196-W199 AromaticContact CG-NE1 3.48Å; H196-W199 AromaticContact ND1-CD1 3.73Å; H196-W199 AromaticContact ND1-NE1 3.53Å; H196-W199 PolarHBondContact O-N 2.8Å
197	R	92.5	Very high	95	Very high	232 Å²	232	81.3 Å²	81.3	88%	0.875	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-42.6	-168.1	-65.3	-177.8	179.3	-172.9	-0.2	113.4	R191 L195 W199	R191-R197 PolarHBondContact NH2-O 3.42Å; L195-R197 PolarHBondContact O-N 2.64Å; R197-W199 VanDerWaalsContact C-N 3.3Å; R197-W199 PolarHBondContact O-N 2.56Å
198	D	91.4	Very high	95	Very high	116 Å²	116	80.3 Å²	80.3	62%	0.62	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-15.4	-177.4	-54.5	-13.6	0	0	0	114.9	H196	H196-D198 VanDerWaalsContact C-N 3.25Å; H196-D198 IonicContact CE1-OD2 3.15Å; H196-D198 PolarHBondContact CE1-OD2 3.09Å; H196-D198 VanDerWaalsContact CE1-OD2 3.28Å; H196-D198 PolarHBondContact ND1-N 3.16Å; H196-D198 IonicContact ND1-OD2 3.95Å; H196-D198 PolarHBondContact O-N 3.28Å; H196-D198 VanDerWaalsContact O-N 3.09Å
199	W	93.9	Very high	95.2	Very high	55 Å²	55	73.4 Å²	73.4	21%	0.208	39%	0.389	C	S	.	.	S	Bend	trans	-80.8	136	179.8	-55.6	-1.3	0	0	0	109.2	R191 L195 H196 R197 R272	R191-W199 PolarHBondContact NH1-O 3.06Å; R191-W199 PolarHBondContact NH2-O 2.94Å; L195-W199 HydrophobicContact CD1-CD2 4.4Å; L195-W199 HydrophobicContact CD1-CE3 3.42Å; L195-W199 VanDerWaalsContact CD1-CE3 3.42Å; L195-W199 HydrophobicContact CD1-CZ3 3.79Å; L195-W199 HydrophobicContact CG-CE3 4.29Å; H196-W199 HydrophobicContact CB-CD2 3.67Å; H196-W199 HydrophobicContact CB-CE3 4.3Å; H196-W199 HydrophobicContact CB-CG 3.95Å; H196-W199 HydrophobicContact CB-CH2 4.21Å; H196-W199 HydrophobicContact CB-CZ2 3.52Å; H196-W199 AromaticContact CG-CE2 3.73Å; H196-W199 AromaticContact CG-NE1 3.48Å; H196-W199 AromaticContact ND1-CD1 3.73Å; H196-W199 AromaticContact ND1-NE1 3.53Å; H196-W199 PolarHBondContact O-N 2.8Å; R197-W199 VanDerWaalsContact C-N 3.3Å; R197-W199 PolarHBondContact O-N 2.56Å; W199-R272 HydrophobicContact CB-CG 3.91Å; W199-R272 VanDerWaalsContact CD2-CD 3.42Å; W199-R272 HydrophobicContact CD2-CG 3.83Å; W199-R272 VanDerWaalsContact CD2-CZ 3.49Å; W199-R272 HydrophobicContact CE3-CG 4.37Å; W199-R272 HydrophobicContact CG-CG 3.51Å; W199-R272 VanDerWaalsContact CZ2-NH1 3.33Å; W199-R272 VanDerWaalsContact CZ3-NH1 3.35Å; W199-R272 VanDerWaalsContact NE1-NE 3.15Å
200	I	95	Very high	95.4	Very high	83 Å²	83	72.5 Å²	72.5	43%	0.426	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	128.9	-176.9	-60.2	169.8	0	0	0	109	L271 R272 T273 C274	I200-L271 HydrophobicContact CD1-CD1 4.09Å; I200-R272 PolarHBondContact N-O 3.34Å; I200-T273 HydrophobicContact CB-CG2 4.44Å; I200-T273 HydrophobicContact CG2-CG2 4.32Å; I200-T273 CarbonylContact O-C 3.5Å; I200-T273 VanDerWaalsContact O-CA 3.32Å; I200-T273 WeakPolarHBondContact O-CA 3.21Å; I200-C274 PolarHBondContact O-N 3.46Å
201	W	96.7	Very high	95.5	Very high	64 Å²	64	65.6 Å²	65.6	24%	0.242	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	115.9	167.1	-175.8	-113.1	0	0	0	108.6	A189 R191 P192 L195 V258 C274 W275 T276	A189-W201 PolarHBondContact O-NE1 3.32Å; R191-W201 HydrophobicContact CB-CB 3.93Å; R191-W201 HydrophobicContact CB-CD2 4.33Å; R191-W201 HydrophobicContact CB-CG 3.79Å; R191-W201 HydrophobicContact CG-CB 3.9Å; R191-W201 HydrophobicContact CG-CG 4.15Å; P192-W201 HydrophobicContact CG-CH2 4.24Å; P192-W201 HydrophobicContact CG-CZ3 4.24Å; L195-W201 HydrophobicContact CD2-CE3 3.8Å; L195-W201 HydrophobicContact CD2-CZ3 4.46Å; W201-V258 HydrophobicContact CZ3-CG1 4.11Å; W201-V258 HydrophobicContact CZ3-CG2 4.11Å; W201-C274 HydrophobicContact CE3-CB 4.27Å; W201-C274 VanDerWaalsContact CE3-O 3.24Å; W201-C274 HydrophobicContact CZ3-CB 4.5Å; W201-W275 VanDerWaalsContact CH2-C 3.47Å; W201-T276 VanDerWaalsContact CH2-N 3.25Å; W201-T276 WeakPolarHBondContact CH2-OG1 3.1Å; W201-T276 WeakPolarHBondContact CZ2-OG1 3.37Å
202	G	94.2	Very high	95.7	Very high	24 Å²	24	63.9 Å²	63.9	25%	0.247	33%	0.333	C	S	.	.			trans	174.2	-165.6	-174.2	0	0	0	0	0	113.2	T273 C274 W275	G202-T273 VanDerWaalsContact C-CG2 3.46Å; G202-C274 PolarHBondContact N-O 3.26Å; G202-C274 CarbonylContact O-C 3.5Å; G202-W275 WeakPolarHBondContact O-CB 3.06Å
203	G	93.7	Very high	95.8	Very high	63 Å²	63	69.1 Å²	69.1	65%	0.649	35%	0.347	S	S	*	.	S	Bend	trans	74.7	-166.8	-168.6	0	0	0	0	0	112.1
204	C	96.9	Very high	96	Very high	39 Å²	39	62.1 Å²	62.1	26%	0.264	31%	0.308	S	S	.	.			trans	-106.1	98.3	-177.3	-165.6	0	0	0	0	111.8	K177 C186	K177-C204 WeakPolarHBondContact CD-O 3.44Å; K177-C204 WeakPolarHBondContact CE-O 3.3Å; K177-C204 PolarHBondContact NZ-O 2.78Å; K177-C204 PolarHBondContact O-SG 3.01Å; K177-C204 VanDerWaalsContact O-SG 3.38Å; C186-C204 HydrophobicContact CB-CB 3.97Å; C186-C204 WeakPolarHBondContact CB-SG 3.07Å; C186-C204 VanDerWaalsContact SG-CA 3.56Å; C186-C204 WeakPolarHBondContact SG-CB 3.47Å; C186-C204 CovalentContact SG-SG 2.03Å; C186-C204 PolarHBondContact SG-SG 3.35Å
205	G	97.5	Very high	96.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.021	27%	0.265	C	S	.	.			trans	-82.4	159.1	174.8	0	0	0	0	0	113.7	S187 N207 T276	S187-G205 PolarHBondContact N-O 3.32Å; G205-N207 PolarHBondContact O-N 3.44Å; G205-T276 CarbonylContact C-O 3.58Å; G205-T276 WeakPolarHBondContact CA-O 3.49Å
206	D	98.5	Very high	96.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.282	C	S	.	.			trans	-63.3	127.1	173.7	-69.1	-64.6	0	0	0	110.8	A173 R174 K177 S187 I208 T276 Q277 L278	A173-D206 HydrophobicContact CB-CB 4.42Å; R174-D206 WeakPolarHBondContact CA-OD1 3.39Å; R174-D206 IonicContact CZ-OD1 3.78Å; R174-D206 IonicContact CZ-OD2 2.8Å; R174-D206 IonicContact NE-OD1 3.11Å; R174-D206 PolarHBondContact NE-OD1 3.19Å; R174-D206 IonicContact NE-OD2 2.74Å; R174-D206 IonicContact NH2-OD1 2.85Å; R174-D206 PolarHBondContact NH2-OD1 3.06Å; R174-D206 IonicContact NH2-OD2 3.08Å; R174-D206 PolarHBondContact NH2-OD2 3.07Å; R174-D206 VanDerWaalsContact NH2-OD2 3.12Å; K177-D206 WeakPolarHBondContact CD-OD1 3.35Å; S187-D206 WeakPolarHBondContact CB-O 3.24Å; D206-I208 HydrophobicContact CB-CG1 4.44Å; D206-I208 PolarHBondContact O-N 3.24Å; D206-T276 PolarHBondContact N-O 3.41Å; D206-Q277 WeakPolarHBondContact OD2-CA 3.36Å; D206-Q277 PolarHBondContact OD2-NE2 3.1Å; D206-L278 HydrophobicContact CB-CD1 3.92Å; D206-L278 HydrophobicContact CB-CG 3.64Å; D206-L278 PolarHBondContact OD2-N 3.34Å
207	N	98.3	Very high	96.7	Very high	16 Å²	16	54.8 Å²	54.8	9%	0.086	28%	0.281	C	S	.	.			trans	-87.7	72.8	-173.5	-165.1	-18.9	0	0	0	112.6	A173 C176 G185 C186 G205 A209 Y210 A211	A173-N207 PolarHBondContact O-N 3.5Å; A173-N207 VanDerWaalsContact O-N 3.15Å; C176-N207 HydrophobicContact CB-CB 3.74Å; G185-N207 WeakPolarHBondContact O-CB 3.4Å; G185-N207 PolarHBondContact O-ND2 3.05Å; C186-N207 PolarHBondContact O-ND2 2.68Å; G205-N207 PolarHBondContact O-N 3.44Å; N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.23Å; N207-Y210 PolarHBondContact O-N 3.27Å; N207-Y210 VanDerWaalsContact OD1-CB 3.32Å; N207-Y210 WeakPolarHBondContact OD1-CB 3.15Å; N207-Y210 PolarHBondContact OD1-N 3.35Å; N207-Y210 VanDerWaalsContact OD1-N 3.11Å; N207-A211 WeakPolarHBondContact O-CB 3.37Å; N207-A211 PolarHBondContact O-N 3.03Å; N207-A211 VanDerWaalsContact O-N 3.16Å
208	I	98.2	Very high	97	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-35	-175.8	-50.4	178.2	0	0	0	111.6	V169 A173 D206 A211 Y212 V252 Y253 A256 T276 L278	V169-I208 HydrophobicContact CG1-CG2 4.19Å; A173-I208 HydrophobicContact CB-CG1 4.17Å; D206-I208 HydrophobicContact CB-CG1 4.44Å; D206-I208 PolarHBondContact O-N 3.24Å; I208-A211 PolarHBondContact O-N 3.39Å; I208-Y212 VanDerWaalsContact O-CB 3.27Å; I208-Y212 WeakPolarHBondContact O-CB 3.33Å; I208-Y212 PolarHBondContact O-N 3.29Å; I208-V252 HydrophobicContact CG2-CG1 4.46Å; I208-Y253 HydrophobicContact CG2-CD2 3.93Å; I208-A256 HydrophobicContact CD1-CB 3.32Å; I208-T276 HydrophobicContact CD1-CG2 3.93Å; I208-L278 HydrophobicContact CD1-CD2 3.85Å; I208-L278 HydrophobicContact CG1-CD2 3.89Å
209	A	97.8	Very high	97.3	Very high	50 Å²	50	38.3 Å²	38.3	41%	0.413	21%	0.211	S	C	.	.	H	α-helix	trans	-64.7	-45.2	-179.6	0	0	0	0	0	112.2	N207 R213	N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.23Å; A209-R213 WeakPolarHBondContact O-CG 3.08Å; A209-R213 PolarHBondContact O-N 3.11Å
210	Y	98.3	Very high	97.4	Very high	27 Å²	27	36 Å²	36	11%	0.106	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-52.5	173	176.5	-92.6	0	0	0	110.9	H111 C176 S183 C184 N207 Y212 R213 F214	H111-Y210 AromaticContact NE2-CE1 3.79Å; H111-Y210 AromaticContact NE2-CZ 3.63Å; H111-Y210 PolarHBondContact NE2-OH 3.21Å; C176-Y210 WeakPolarHBondContact SG-CD1 3.37Å; S183-Y210 PolarHBondContact OG-OH 2.89Å; C184-Y210 HydrophobicContact CB-CD1 3.59Å; C184-Y210 HydrophobicContact CB-CD2 3.75Å; C184-Y210 HydrophobicContact CB-CE1 3.77Å; C184-Y210 HydrophobicContact CB-CE2 3.94Å; C184-Y210 HydrophobicContact CB-CG 3.6Å; N207-Y210 PolarHBondContact O-N 3.27Å; N207-Y210 VanDerWaalsContact OD1-CB 3.32Å; N207-Y210 WeakPolarHBondContact OD1-CB 3.15Å; N207-Y210 PolarHBondContact OD1-N 3.35Å; N207-Y210 VanDerWaalsContact OD1-N 3.11Å; Y210-Y212 VanDerWaalsContact C-N 3.33Å; Y210-Y212 PolarHBondContact O-N 3.06Å; Y210-R213 PolarHBondContact O-N 3.42Å; Y210-R213 VanDerWaalsContact O-N 3.12Å; Y210-F214 HydrophobicContact CE1-CB 4.21Å; Y210-F214 PolarHBondContact O-N 2.92Å
211	A	98.6	Very high	97.5	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.3	-43.2	-177.1	0	0	0	0	0	112.6	V169 L172 A173 N207 I208 R213 F214 A215	V169-A211 HydrophobicContact CG1-CB 4Å; V169-A211 VanDerWaalsContact O-CB 3.29Å; V169-A211 WeakPolarHBondContact O-CB 3.44Å; L172-A211 HydrophobicContact CB-CB 3.63Å; A173-A211 HydrophobicContact CB-CB 3.67Å; N207-A211 WeakPolarHBondContact O-CB 3.37Å; N207-A211 PolarHBondContact O-N 3.03Å; N207-A211 VanDerWaalsContact O-N 3.16Å; I208-A211 PolarHBondContact O-N 3.39Å; A211-R213 PolarHBondContact O-N 2.82Å; A211-F214 PolarHBondContact O-N 3.17Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 2.9Å
212	Y	98.4	Very high	97.4	Very high	46 Å²	46	33.2 Å²	33.2	18%	0.18	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-46.9	176.2	-173.1	-73.8	0	0	0	111.4	I208 Y210 K216 R249 L250	I208-Y212 VanDerWaalsContact O-CB 3.27Å; I208-Y212 WeakPolarHBondContact O-CB 3.33Å; I208-Y212 PolarHBondContact O-N 3.29Å; Y210-Y212 VanDerWaalsContact C-N 3.33Å; Y210-Y212 PolarHBondContact O-N 3.06Å; Y212-K216 HydrophobicContact CE1-CD 4.46Å; Y212-K216 VanDerWaalsContact O-CB 3.25Å; Y212-K216 WeakPolarHBondContact O-CB 3.47Å; Y212-K216 PolarHBondContact O-N 3.26Å; Y212-R249 HydrophobicContact CD2-CB 3.52Å; Y212-R249 HydrophobicContact CD2-CG 4.45Å; Y212-R249 HydrophobicContact CE2-CB 3.28Å; Y212-R249 HydrophobicContact CE2-CG 4.36Å; Y212-R249 HydrophobicContact CG-CB 4.41Å; Y212-L250 HydrophobicContact CE2-CD2 3.95Å; Y212-L250 HydrophobicContact CE2-CG 4.23Å
213	R	98.2	Very high	97.4	Very high	157 Å²	157	33 Å²	33	59%	0.592	18%	0.183	S	C	*	.	H	α-helix	trans	-65.2	-46.3	-179.7	-70.7	-169.4	-54.9	-100.1	2.4	111.7	A209 Y210 A211 K216 A217	A209-R213 WeakPolarHBondContact O-CG 3.08Å; A209-R213 PolarHBondContact O-N 3.11Å; Y210-R213 PolarHBondContact O-N 3.42Å; Y210-R213 VanDerWaalsContact O-N 3.12Å; A211-R213 PolarHBondContact O-N 2.82Å; R213-K216 WeakPolarHBondContact O-CB 3.32Å; R213-K216 PolarHBondContact O-N 3.33Å; R213-A217 PolarHBondContact O-N 3.48Å
214	F	98.3	Very high	97.4	Very high	19 Å²	19	35.4 Å²	35.4	8%	0.083	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-48.9	179.9	-172.8	-83.1	0	0	0	111.4	Y108 H111 I115 L172 Y210 A211 K216 A217 F218	Y108-F214 AromaticContact CD1-CE2 3.9Å; Y108-F214 HydrophobicContact CD1-CE2 3.9Å; Y108-F214 AromaticContact CD2-CE2 3.84Å; Y108-F214 HydrophobicContact CD2-CE2 3.84Å; Y108-F214 HydrophobicContact CD2-CZ 4.45Å; Y108-F214 HydrophobicContact CE1-CE2 4.45Å; Y108-F214 HydrophobicContact CE2-CE2 4.4Å; Y108-F214 AromaticContact CG-CE2 3.57Å; Y108-F214 HydrophobicContact CG-CE2 3.57Å; Y108-F214 HydrophobicContact CG-CZ 4.12Å; H111-F214 HydrophobicContact CB-CE1 3.9Å; H111-F214 HydrophobicContact CB-CE2 4.46Å; H111-F214 HydrophobicContact CB-CZ 3.66Å; H111-F214 AromaticContact CD2-CD1 3.97Å; H111-F214 AromaticContact CD2-CD2 3.73Å; H111-F214 AromaticContact CD2-CE1 3.68Å; H111-F214 AromaticContact CD2-CE2 3.43Å; H111-F214 VanDerWaalsContact CD2-CE2 3.43Å; H111-F214 WeakPolarHBondContact CD2-CE2 3.32Å; H111-F214 AromaticContact CD2-CG 3.99Å; H111-F214 AromaticContact CD2-CZ 3.4Å; H111-F214 WeakPolarHBondContact CD2-CZ 3.35Å; H111-F214 AromaticContact CG-CE2 3.85Å; H111-F214 AromaticContact CG-CZ 3.53Å; H111-F214 AromaticContact NE2-CD2 3.94Å; H111-F214 AromaticContact NE2-CE2 3.79Å; I115-F214 HydrophobicContact CD1-CE1 3.8Å; I115-F214 HydrophobicContact CD1-CZ 4.47Å; I115-F214 HydrophobicContact CG1-CE1 4.4Å; L172-F214 HydrophobicContact CD1-CB 4.25Å; L172-F214 HydrophobicContact CD1-CD1 3.55Å; L172-F214 HydrophobicContact CD1-CE1 4.36Å; L172-F214 HydrophobicContact CD1-CG 4.26Å; L172-F214 HydrophobicContact CD2-CD1 4.37Å; Y210-F214 HydrophobicContact CE1-CB 4.21Å; Y210-F214 PolarHBondContact O-N 2.92Å; A211-F214 PolarHBondContact O-N 3.17Å; F214-K216 PolarHBondContact O-N 3.47Å; F214-A217 PolarHBondContact O-N 2.88Å; F214-F218 HydrophobicContact CE1-CB 4.19Å; F214-F218 PolarHBondContact O-N 2.92Å
215	A	98.4	Very high	97.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.1	-37.8	176.5	0	0	0	0	0	111.4	V168 V169 L172 A211 F218 I219	V168-A215 HydrophobicContact CB-CB 4.49Å; V168-A215 HydrophobicContact CG1-CB 3.84Å; V169-A215 HydrophobicContact CG2-CB 3.49Å; V169-A215 VanDerWaalsContact CG2-CB 3.49Å; L172-A215 HydrophobicContact CD1-CB 4.45Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 2.9Å; A215-F218 PolarHBondContact O-N 3.09Å; A215-I219 HydrophobicContact CB-CD1 4.18Å; A215-I219 WeakPolarHBondContact O-CB 3.49Å; A215-I219 VanDerWaalsContact O-CG1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.48Å; A215-I219 PolarHBondContact O-N 3.36Å
216	K	98.5	Very high	96.9	Very high	100 Å²	100	43.7 Å²	43.7	44%	0.435	21%	0.207	S	C	.	.	H	α-helix	trans	-61.5	-46.1	172.2	-177.5	-176.3	175.7	-161.7	0	113.3	Y212 R213 F214 D220	Y212-K216 HydrophobicContact CE1-CD 4.46Å; Y212-K216 VanDerWaalsContact O-CB 3.25Å; Y212-K216 WeakPolarHBondContact O-CB 3.47Å; Y212-K216 PolarHBondContact O-N 3.26Å; R213-K216 WeakPolarHBondContact O-CB 3.32Å; R213-K216 PolarHBondContact O-N 3.33Å; F214-K216 PolarHBondContact O-N 3.47Å; K216-D220 WeakPolarHBondContact CG-OD2 3.43Å; K216-D220 VanDerWaalsContact O-CB 3.24Å; K216-D220 WeakPolarHBondContact O-CB 3.2Å; K216-D220 PolarHBondContact O-N 2.91Å
217	A	98	Very high	96.7	Very high	52 Å²	52	49.4 Å²	49.4	43%	0.43	25%	0.248	S	C	.	.	H	α-helix	trans	-63.8	-42.2	177.8	0	0	0	0	0	111.9	R213 F214 V221	R213-A217 PolarHBondContact O-N 3.48Å; F214-A217 PolarHBondContact O-N 2.88Å; A217-V221 VanDerWaalsContact O-CB 3.3Å; A217-V221 WeakPolarHBondContact O-CB 3.38Å; A217-V221 WeakPolarHBondContact O-CG1 3.25Å
218	F	97.6	Very high	96.5	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-79.7	-41.2	-175	-177.2	-96.4	0	0	0	114.4	W66 L69 L97 Q101 L104 M112 I115 F214 A215 V221	W66-F218 HydrophobicContact CB-CE1 4.03Å; W66-F218 HydrophobicContact CB-CZ 4.38Å; W66-F218 HydrophobicContact CD2-CE1 4.1Å; W66-F218 AromaticContact CE3-CE1 3.97Å; W66-F218 HydrophobicContact CE3-CE1 3.97Å; W66-F218 HydrophobicContact CG-CE1 4.13Å; L69-F218 HydrophobicContact CD1-CZ 4.4Å; L97-F218 HydrophobicContact CD2-CZ 3.84Å; Q101-F218 HydrophobicContact CB-CE2 4.26Å; Q101-F218 PolarHBondContact NE2-O 3.36Å; L104-F218 HydrophobicContact CB-CD2 4.16Å; L104-F218 HydrophobicContact CD1-CB 4.4Å; L104-F218 HydrophobicContact CD1-CD2 4.24Å; M112-F218 HydrophobicContact CE-CE2 4.3Å; M112-F218 HydrophobicContact CE-CZ 4.04Å; M112-F218 HydrophobicContact SD-CE2 4.05Å; M112-F218 HydrophobicContact SD-CZ 4.28Å; I115-F218 HydrophobicContact CD1-CD1 3.98Å; I115-F218 HydrophobicContact CD1-CD2 4.13Å; I115-F218 HydrophobicContact CD1-CE1 3.97Å; I115-F218 HydrophobicContact CD1-CE2 4.12Å; I115-F218 HydrophobicContact CD1-CG 4.06Å; I115-F218 HydrophobicContact CD1-CZ 4.04Å; I115-F218 HydrophobicContact CG2-CD1 4.39Å; I115-F218 HydrophobicContact CG2-CE1 3.85Å; I115-F218 HydrophobicContact CG2-CZ 4.43Å; F214-F218 HydrophobicContact CE1-CB 4.19Å; F214-F218 PolarHBondContact O-N 2.92Å; A215-F218 PolarHBondContact O-N 3.09Å; F218-V221 WeakPolarHBondContact O-CG1 3.34Å
219	I	97.5	Very high	96.5	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-81.7	-47.7	-174.9	-60.7	175.2	0	0	0	110.5	W66 A165 V168 A215 V221 N245	W66-I219 HydrophobicContact CD2-CG1 4.48Å; W66-I219 HydrophobicContact CH2-CD1 3.76Å; W66-I219 HydrophobicContact CH2-CG1 4.04Å; W66-I219 HydrophobicContact CZ2-CB 4.34Å; W66-I219 HydrophobicContact CZ2-CD1 3.59Å; W66-I219 HydrophobicContact CZ2-CG1 3.61Å; W66-I219 HydrophobicContact CZ2-CG2 3.86Å; A165-I219 HydrophobicContact CB-CD1 3.94Å; V168-I219 HydrophobicContact CB-CD1 4.1Å; V168-I219 HydrophobicContact CG1-CD1 4.32Å; V168-I219 HydrophobicContact CG2-CD1 4.22Å; A215-I219 HydrophobicContact CB-CD1 4.18Å; A215-I219 WeakPolarHBondContact O-CB 3.49Å; A215-I219 VanDerWaalsContact O-CG1 3.23Å; A215-I219 WeakPolarHBondContact O-CG1 3.48Å; A215-I219 PolarHBondContact O-N 3.36Å; I219-V221 VanDerWaalsContact C-N 3.28Å; I219-V221 PolarHBondContact O-N 3.49Å; I219-N245 HydrophobicContact CG2-CB 4.44Å; I219-N245 WeakPolarHBondContact CG2-ND2 3.39Å
220	D	97.6	Very high	96.4	Very high	7 Å²	7	62.5 Å²	62.5	4%	0.037	30%	0.298	C	S	.	.	H	α-helix	trans	-76.4	-15	-172.3	-62.6	1.5	0	0	0	112.5	K216 R222 E223 K224 L242 N245 R249	K216-D220 WeakPolarHBondContact CG-OD2 3.43Å; K216-D220 VanDerWaalsContact O-CB 3.24Å; K216-D220 WeakPolarHBondContact O-CB 3.2Å; K216-D220 PolarHBondContact O-N 2.91Å; D220-R222 VanDerWaalsContact C-N 3.33Å; D220-R222 PolarHBondContact O-N 3Å; D220-E223 PolarHBondContact O-N 3.48Å; D220-K224 WeakPolarHBondContact O-CG 3.46Å; D220-K224 PolarHBondContact O-N 3.37Å; D220-L242 HydrophobicContact CB-CD2 3.48Å; D220-L242 VanDerWaalsContact CB-CD2 3.48Å; D220-N245 PolarHBondContact OD1-ND2 3.41Å; D220-R249 VanDerWaalsContact CG-NH1 3.26Å; D220-R249 IonicContact OD1-CZ 2.86Å; D220-R249 IonicContact OD1-NH1 3.49Å; D220-R249 PolarHBondContact OD1-NH1 2.57Å; D220-R249 IonicContact OD1-NH2 3.68Å; D220-R249 IonicContact OD2-CZ 3.84Å; D220-R249 IonicContact OD2-NH1 3.12Å; D220-R249 PolarHBondContact OD2-NH1 3.05Å; D220-R249 VanDerWaalsContact OD2-NH1 3.15Å; D220-R249 IonicContact OD2-NH2 2.73Å; D220-R249 PolarHBondContact OD2-NH2 3.12Å
221	V	96.3	Very high	96.3	Very high	35 Å²	35	66.1 Å²	66.1	21%	0.212	32%	0.315	C	S	.	.	H	α-helix	trans	-66.5	-35.4	-179.2	73.3	0	0	0	0	112	S100 Q101 L104 A217 F218 I219 E223 K224 E225	S100-V221 VanDerWaalsContact CB-CG2 3.43Å; Q101-V221 HydrophobicContact CG-CG1 3.52Å; L104-V221 HydrophobicContact CD1-CG1 4.12Å; A217-V221 VanDerWaalsContact O-CB 3.3Å; A217-V221 WeakPolarHBondContact O-CB 3.38Å; A217-V221 WeakPolarHBondContact O-CG1 3.25Å; F218-V221 WeakPolarHBondContact O-CG1 3.34Å; I219-V221 VanDerWaalsContact C-N 3.28Å; I219-V221 PolarHBondContact O-N 3.49Å; V221-E223 VanDerWaalsContact C-N 3.34Å; V221-E223 PolarHBondContact O-N 3.11Å; V221-K224 CarbonylContact O-C 3.53Å; V221-K224 PolarHBondContact O-N 3.26Å; V221-K224 VanDerWaalsContact O-N 3.08Å; V221-E225 PolarHBondContact O-N 3.49Å
222	R	93.8	Very high	96.2	Very high	52 Å²	52	67 Å²	67	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-57	-48.2	174.8	166.9	175.4	-178.2	113.6	-6.9	111.6	G64 Y65 G96 T98 D220 K224 E225	G64-R222 VanDerWaalsContact O-CZ 3.24Å; G64-R222 PolarHBondContact O-NH1 3.45Å; G64-R222 PolarHBondContact O-NH2 3.34Å; Y65-R222 VanDerWaalsContact CE1-NE 3.28Å; G96-R222 PolarHBondContact O-NH1 2.9Å; T98-R222 HydrophobicContact CG2-CB 3.85Å; T98-R222 HydrophobicContact CG2-CG 3.63Å; D220-R222 VanDerWaalsContact C-N 3.33Å; D220-R222 PolarHBondContact O-N 3Å; R222-K224 PolarHBondContact O-N 3.46Å; R222-E225 PolarHBondContact O-N 3.4Å
223	E	94.2	Very high	96	Very high	19 Å²	19	71 Å²	71	9%	0.089	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-28.2	-179.9	-55.6	-58.1	143.6	0	0	111.2	H161 D220 V221 M238 N241 L242	H161-E223 IonicContact CE1-OE1 3.96Å; D220-E223 PolarHBondContact O-N 3.48Å; V221-E223 VanDerWaalsContact C-N 3.34Å; V221-E223 PolarHBondContact O-N 3.11Å; E223-M238 HydrophobicContact CB-CG 3.97Å; E223-M238 WeakPolarHBondContact O-CG 3.32Å; E223-N241 HydrophobicContact CG-CB 4.15Å; E223-N241 WeakPolarHBondContact OE2-CB 3.39Å; E223-N241 PolarHBondContact OE2-ND2 3.1Å; E223-L242 HydrophobicContact CB-CD1 4.48Å; E223-L242 HydrophobicContact CB-CD2 3.86Å; E223-L242 HydrophobicContact CB-CG 3.95Å; E223-L242 HydrophobicContact CG-CD2 4.16Å; E223-L242 HydrophobicContact CG-CG 4.31Å
224	K	94.8	Very high	95.9	Very high	114 Å²	114	67.2 Å²	67.2	50%	0.496	34%	0.335	S	S	.	.	H	α-helix	trans	-97.3	-6.8	-174.6	-66.8	173.4	-176.7	173.8	0	114.8	D220 V221 R222 K226 L242	D220-K224 WeakPolarHBondContact O-CG 3.46Å; D220-K224 PolarHBondContact O-N 3.37Å; V221-K224 CarbonylContact O-C 3.53Å; V221-K224 PolarHBondContact O-N 3.26Å; V221-K224 VanDerWaalsContact O-N 3.08Å; R222-K224 PolarHBondContact O-N 3.46Å; K224-K226 PolarHBondContact O-N 2.83Å; K224-L242 HydrophobicContact CG-CD1 4.4Å
225	E	92	Very high	95.8	Very high	78 Å²	78	67.2 Å²	67.2	36%	0.364	34%	0.336	S	S	.	.	S	Bend	trans	-67.1	-28.8	-177.4	-170	164.9	150.9	0	0	111.9	T98 H99 S100 V221 R222	T98-E225 WeakPolarHBondContact CB-OE2 3.3Å; T98-E225 PolarHBondContact OG1-OE2 3Å; H99-E225 WeakPolarHBondContact CB-OE1 3.44Å; H99-E225 PolarHBondContact N-OE1 3.32Å; S100-E225 PolarHBondContact N-OE2 3.48Å; S100-E225 PolarHBondContact OG-OE2 3.08Å; V221-E225 PolarHBondContact O-N 3.49Å; R222-E225 PolarHBondContact O-N 3.4Å
226	K	91.7	Very high	95.8	Very high	137 Å²	137	67.5 Å²	67.5	60%	0.596	34%	0.338	S	S	*	.	S	Bend	trans	-110	143	173.7	-64.4	-175.7	-179.9	-177.3	0	110.3	K224 Y228	K224-K226 PolarHBondContact O-N 2.83Å; K226-Y228 HydrophobicContact CB-CE1 4.4Å; K226-Y228 HydrophobicContact CB-CE2 4Å
227	S	93.2	Very high	95.7	Very high	121 Å²	121	66.8 Å²	66.8	85%	0.846	33%	0.332	S	S	*	.			trans	-102.7	140.9	169.3	-67.7	0	0	0	0	109.5
228	Y	95.8	Very high	95.6	Very high	77 Å²	77	65.5 Å²	65.5	30%	0.302	32%	0.318	S	S	.	.			trans	-122.6	146.7	-177.3	-63.2	-71.9	0	0	0	110.4	K226 E234 M238	K226-Y228 HydrophobicContact CB-CE1 4.4Å; K226-Y228 HydrophobicContact CB-CE2 4Å; Y228-E234 HydrophobicContact CD1-CB 3.33Å; Y228-E234 HydrophobicContact CD1-CG 3.96Å; Y228-E234 HydrophobicContact CD2-CB 3.99Å; Y228-E234 HydrophobicContact CE1-CB 3.43Å; Y228-E234 VanDerWaalsContact CE1-CB 3.43Å; Y228-E234 HydrophobicContact CE1-CG 3.82Å; Y228-E234 HydrophobicContact CE2-CB 4.09Å; Y228-E234 HydrophobicContact CG-CB 3.61Å; Y228-M238 HydrophobicContact CD2-CB 4.49Å; Y228-M238 HydrophobicContact CD2-SD 4.08Å; Y228-M238 HydrophobicContact CE2-SD 4.42Å
229	P	96.8	Very high	95.6	Very high	95 Å²	95	67.5 Å²	67.5	62%	0.617	33%	0.328	S	S	*	.			trans	-63.3	154.8	178.6	24	-29	0	0	0	111	S232 L235	P229-S232 WeakPolarHBondContact O-CB 3.39Å; P229-S232 PolarHBondContact O-N 3.47Å; P229-L235 WeakPolarHBondContact O-CD2 3.39Å
230	R	96.5	Very high	95.7	Very high	175 Å²	175	67.5 Å²	67.5	66%	0.66	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	146.8	175.4	-67.8	178.8	-178	167.8	4.3	109.9	S232 R303 T305	R230-S232 PolarHBondContact O-N 3.32Å; R230-S232 VanDerWaalsContact O-N 3.16Å; R230-R303 WeakPolarHBondContact CD-O 3.43Å; R230-T305 HydrophobicContact CG-CG2 4.5Å
231	H	95.6	Very high	95.7	Very high	103 Å²	103	67.6 Å²	67.6	48%	0.477	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	1.4	-177.8	-58.4	-85.4	0	0	0	116.3	G304	H231-G304 WeakPolarHBondContact CE1-CA 3.5Å; H231-G304 PolarHBondContact CE1-N 3.34Å; H231-G304 VanDerWaalsContact CE1-N 3.25Å; H231-G304 VanDerWaalsContact NE2-CA 3.33Å; H231-G304 WeakPolarHBondContact NE2-CA 3.44Å; H231-G304 PolarHBondContact NE2-N 3.26Å
232	S	97	Very high	95.7	Very high	18 Å²	18	67.3 Å²	67.3	13%	0.126	33%	0.326	C	S	.	.			trans	-71.7	148.7	176.4	105.3	0	0	0	0	111.4	P229 R230 E234 L235 A236 F300	P229-S232 WeakPolarHBondContact O-CB 3.39Å; P229-S232 PolarHBondContact O-N 3.47Å; R230-S232 PolarHBondContact O-N 3.32Å; R230-S232 VanDerWaalsContact O-N 3.16Å; S232-E234 WeakPolarHBondContact CB-OE2 3.47Å; S232-E234 PolarHBondContact O-N 3.03Å; S232-E234 PolarHBondContact OG-N 3.39Å; S232-E234 PolarHBondContact OG-OE2 3.16Å; S232-L235 PolarHBondContact O-N 2.92Å; S232-L235 PolarHBondContact OG-N 3.05Å; S232-A236 PolarHBondContact O-N 3.04Å; S232-A236 VanDerWaalsContact O-N 3.07Å; S232-F300 VanDerWaalsContact O-CE2 3.32Å; S232-F300 WeakPolarHBondContact O-CE2 3.41Å; S232-F300 WeakPolarHBondContact O-CZ 3.13Å
233	N	95.3	Very high	96	Very high	129 Å²	129	66.8 Å²	66.8	69%	0.69	33%	0.326	S	S	*	.	H	α-helix	trans	-63.1	-35	176.9	-73.1	-27.8	0	0	0	111.2	A236 R237	N233-A236 WeakPolarHBondContact O-CB 3.32Å; N233-A236 PolarHBondContact O-N 2.92Å; N233-R237 WeakPolarHBondContact O-CG 3.35Å; N233-R237 PolarHBondContact O-N 3.12Å
234	E	95.3	Very high	96.2	Very high	79 Å²	79	65.9 Å²	65.9	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-42.6	175.8	-54.8	77.1	-170	0	0	111.7	Y228 S232 A236 R237 M238	Y228-E234 HydrophobicContact CD1-CB 3.33Å; Y228-E234 HydrophobicContact CD1-CG 3.96Å; Y228-E234 HydrophobicContact CD2-CB 3.99Å; Y228-E234 HydrophobicContact CE1-CB 3.43Å; Y228-E234 VanDerWaalsContact CE1-CB 3.43Å; Y228-E234 HydrophobicContact CE1-CG 3.82Å; Y228-E234 HydrophobicContact CE2-CB 4.09Å; Y228-E234 HydrophobicContact CG-CB 3.61Å; S232-E234 WeakPolarHBondContact CB-OE2 3.47Å; S232-E234 PolarHBondContact O-N 3.03Å; S232-E234 PolarHBondContact OG-N 3.39Å; S232-E234 PolarHBondContact OG-OE2 3.16Å; E234-A236 VanDerWaalsContact C-N 3.28Å; E234-A236 PolarHBondContact O-N 3.4Å; E234-R237 PolarHBondContact O-N 3Å; E234-M238 WeakPolarHBondContact O-CB 3.43Å; E234-M238 PolarHBondContact O-N 3.07Å
235	L	97	Very high	96.4	Very high	19 Å²	19	60.5 Å²	60.5	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-40.2	173.7	-178.6	63.7	0	0	0	110.9	P229 S232 M238 L239 F300 G304	P229-L235 WeakPolarHBondContact O-CD2 3.39Å; S232-L235 PolarHBondContact O-N 2.92Å; S232-L235 PolarHBondContact OG-N 3.05Å; L235-M238 HydrophobicContact CD1-CE 3.49Å; L235-M238 VanDerWaalsContact CD1-CE 3.49Å; L235-M238 HydrophobicContact CD1-SD 4.45Å; L235-M238 PolarHBondContact O-N 3.44Å; L235-L239 HydrophobicContact CD1-CD1 4.36Å; L235-L239 HydrophobicContact CD1-CG 4.35Å; L235-L239 HydrophobicContact CG-CD1 4.16Å; L235-L239 WeakPolarHBondContact O-CB 3.47Å; L235-L239 VanDerWaalsContact O-CG 3.25Å; L235-L239 WeakPolarHBondContact O-CG 3.42Å; L235-L239 PolarHBondContact O-N 2.9Å; L235-F300 HydrophobicContact CB-CZ 3.96Å; L235-F300 HydrophobicContact CD2-CE1 4.01Å; L235-F300 HydrophobicContact CD2-CZ 4Å; L235-F300 HydrophobicContact CG-CE1 4.11Å; L235-F300 HydrophobicContact CG-CZ 3.91Å; L235-G304 WeakPolarHBondContact CD2-O 3.19Å
236	A	97.5	Very high	96.7	Very high	5 Å²	5	62.3 Å²	62.3	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-50.4	177.6	0	0	0	0	0	110.7	S232 N233 E234 M238 L239 M240 F300 L307 L325	S232-A236 PolarHBondContact O-N 3.04Å; S232-A236 VanDerWaalsContact O-N 3.07Å; N233-A236 WeakPolarHBondContact O-CB 3.32Å; N233-A236 PolarHBondContact O-N 2.92Å; E234-A236 VanDerWaalsContact C-N 3.28Å; E234-A236 PolarHBondContact O-N 3.4Å; A236-M238 PolarHBondContact O-N 3.22Å; A236-L239 PolarHBondContact O-N 3.26Å; A236-M240 WeakPolarHBondContact O-CB 3.4Å; A236-M240 PolarHBondContact O-N 3.37Å; A236-F300 HydrophobicContact CB-CD2 4.41Å; A236-F300 HydrophobicContact CB-CE2 3.57Å; A236-F300 HydrophobicContact CB-CZ 3.67Å; A236-L307 HydrophobicContact CB-CD2 4.27Å; A236-L307 WeakPolarHBondContact O-CD1 3.46Å; A236-L325 HydrophobicContact CB-CD1 3.73Å; A236-L325 HydrophobicContact CB-CD2 3.91Å
237	R	96.1	Very high	97	Very high	85 Å²	85	55.8 Å²	55.8	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-59.7	-45.9	177.8	-68.8	-171.7	-47.4	175.2	3.5	111.7	L151 N233 E234 L239 M240 N241 L325	L151-R237 PolarHBondContact O-NH1 2.66Å; N233-R237 WeakPolarHBondContact O-CG 3.35Å; N233-R237 PolarHBondContact O-N 3.12Å; E234-R237 PolarHBondContact O-N 3Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 2.85Å; R237-M240 WeakPolarHBondContact O-CB 3.16Å; R237-M240 PolarHBondContact O-N 2.76Å; R237-N241 WeakPolarHBondContact O-CB 3.28Å; R237-N241 PolarHBondContact O-N 2.86Å; R237-N241 PolarHBondContact O-OD1 3.39Å; R237-L325 HydrophobicContact CG-CD1 4.01Å
238	M	96.7	Very high	97.3	Very high	26 Å²	26	50 Å²	50	13%	0.128	23%	0.233	C	C	.	.	H	α-helix	trans	-55.1	-47.9	176.2	-176.7	-165.1	83.6	0	0	111.8	E223 Y228 E234 L235 A236 N241 L242	E223-M238 HydrophobicContact CB-CG 3.97Å; E223-M238 WeakPolarHBondContact O-CG 3.32Å; Y228-M238 HydrophobicContact CD2-CB 4.49Å; Y228-M238 HydrophobicContact CD2-SD 4.08Å; Y228-M238 HydrophobicContact CE2-SD 4.42Å; E234-M238 WeakPolarHBondContact O-CB 3.43Å; E234-M238 PolarHBondContact O-N 3.07Å; L235-M238 HydrophobicContact CD1-CE 3.49Å; L235-M238 VanDerWaalsContact CD1-CE 3.49Å; L235-M238 HydrophobicContact CD1-SD 4.45Å; L235-M238 PolarHBondContact O-N 3.44Å; A236-M238 PolarHBondContact O-N 3.22Å; M238-N241 PolarHBondContact O-N 3.37Å; M238-L242 HydrophobicContact CE-CD1 4.46Å; M238-L242 HydrophobicContact CG-CD1 4.28Å; M238-L242 WeakPolarHBondContact O-CB 3.35Å; M238-L242 VanDerWaalsContact O-CG 3.25Å; M238-L242 WeakPolarHBondContact O-CG 3.35Å; M238-L242 PolarHBondContact O-N 3.35Å
239	L	97.8	Very high	97.4	Very high	43 Å²	43	46.6 Å²	46.6	23%	0.225	22%	0.219	C	C	.	.	H	α-helix	trans	-66.5	-38.3	178.9	-69.6	174.1	0	0	0	112.4	L235 A236 R237 H243 F300 L307	L235-L239 HydrophobicContact CD1-CD1 4.36Å; L235-L239 HydrophobicContact CD1-CG 4.35Å; L235-L239 HydrophobicContact CG-CD1 4.16Å; L235-L239 WeakPolarHBondContact O-CB 3.47Å; L235-L239 VanDerWaalsContact O-CG 3.25Å; L235-L239 WeakPolarHBondContact O-CG 3.42Å; L235-L239 PolarHBondContact O-N 2.9Å; A236-L239 PolarHBondContact O-N 3.26Å; R237-L239 VanDerWaalsContact C-N 3.33Å; R237-L239 PolarHBondContact O-N 2.85Å; L239-H243 WeakPolarHBondContact O-CB 3.33Å; L239-H243 PolarHBondContact O-N 2.9Å; L239-H243 VanDerWaalsContact O-N 3.09Å; L239-F300 HydrophobicContact CD1-CE1 3.95Å; L239-L307 HydrophobicContact CB-CD1 3.64Å; L239-L307 HydrophobicContact CB-CG 3.94Å; L239-L307 HydrophobicContact CD1-CG 4.18Å
240	M	98	Very high	97.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-50.4	174.7	-177.3	-164.4	78.3	0	0	110.8	A236 R237 L242 H243 N244 L307 T323 L325	A236-M240 WeakPolarHBondContact O-CB 3.4Å; A236-M240 PolarHBondContact O-N 3.37Å; R237-M240 WeakPolarHBondContact O-CB 3.16Å; R237-M240 PolarHBondContact O-N 2.76Å; M240-L242 PolarHBondContact O-N 2.97Å; M240-H243 WeakPolarHBondContact O-CB 3.44Å; M240-H243 PolarHBondContact O-N 2.87Å; M240-H243 VanDerWaalsContact O-N 3.11Å; M240-N244 WeakPolarHBondContact CG-ND2 3.49Å; M240-N244 PolarHBondContact O-N 2.71Å; M240-N244 PolarHBondContact O-ND2 3.43Å; M240-L307 HydrophobicContact CB-CD1 4.11Å; M240-T323 WeakPolarHBondContact CG-O 3.19Å; M240-L325 HydrophobicContact CB-CD1 4.11Å; M240-L325 HydrophobicContact CB-CG 4.39Å; M240-L325 HydrophobicContact CG-CG 4.47Å; M240-L325 HydrophobicContact SD-CB 4.41Å; M240-L325 HydrophobicContact SD-CD1 3.86Å; M240-L325 HydrophobicContact SD-CG 3.84Å
241	N	97.5	Very high	97.6	Very high	9 Å²	9	35.1 Å²	35.1	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-46.7	178.8	-69	-4.5	0	0	0	111.4	H161 E223 R237 M238 H243 N244 N245	H161-N241 VanDerWaalsContact NE2-CG 3.33Å; H161-N241 PolarHBondContact NE2-ND2 2.9Å; H161-N241 PolarHBondContact NE2-OD1 3.26Å; E223-N241 HydrophobicContact CG-CB 4.15Å; E223-N241 WeakPolarHBondContact OE2-CB 3.39Å; E223-N241 PolarHBondContact OE2-ND2 3.1Å; R237-N241 WeakPolarHBondContact O-CB 3.28Å; R237-N241 PolarHBondContact O-N 2.86Å; R237-N241 PolarHBondContact O-OD1 3.39Å; M238-N241 PolarHBondContact O-N 3.37Å; N241-H243 VanDerWaalsContact C-N 3.3Å; N241-H243 PolarHBondContact O-N 3.31Å; N241-N244 PolarHBondContact O-N 2.78Å; N241-N245 WeakPolarHBondContact O-CB 3.3Å; N241-N245 PolarHBondContact O-N 3.11Å; N241-N245 PolarHBondContact O-ND2 3.41Å; N241-N245 PolarHBondContact O-OD1 2.96Å
242	L	98.2	Very high	97.7	Very high	29 Å²	29	30.2 Å²	30.2	15%	0.152	14%	0.143	C	C	.	.	H	α-helix	trans	-60.3	-38	175.9	-73.6	173.1	0	0	0	112.8	D220 E223 K224 M238 M240 R246	D220-L242 HydrophobicContact CB-CD2 3.48Å; D220-L242 VanDerWaalsContact CB-CD2 3.48Å; E223-L242 HydrophobicContact CB-CD1 4.48Å; E223-L242 HydrophobicContact CB-CD2 3.86Å; E223-L242 HydrophobicContact CB-CG 3.95Å; E223-L242 HydrophobicContact CG-CD2 4.16Å; E223-L242 HydrophobicContact CG-CG 4.31Å; K224-L242 HydrophobicContact CG-CD1 4.4Å; M238-L242 HydrophobicContact CE-CD1 4.46Å; M238-L242 HydrophobicContact CG-CD1 4.28Å; M238-L242 WeakPolarHBondContact O-CB 3.35Å; M238-L242 VanDerWaalsContact O-CG 3.25Å; M238-L242 WeakPolarHBondContact O-CG 3.35Å; M238-L242 PolarHBondContact O-N 3.35Å; M240-L242 PolarHBondContact O-N 2.97Å; L242-R246 WeakPolarHBondContact O-CB 3.47Å; L242-R246 PolarHBondContact O-N 2.8Å
243	H	98.5	Very high	97.7	Very high	42 Å²	42	36.3 Å²	36.3	19%	0.194	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-49.2	175.7	-175.4	91.5	0	0	0	111.2	L239 M240 N241 R246 A247 T318 H321 T323	L239-H243 WeakPolarHBondContact O-CB 3.33Å; L239-H243 PolarHBondContact O-N 2.9Å; L239-H243 VanDerWaalsContact O-N 3.09Å; M240-H243 WeakPolarHBondContact O-CB 3.44Å; M240-H243 PolarHBondContact O-N 2.87Å; M240-H243 VanDerWaalsContact O-N 3.11Å; N241-H243 VanDerWaalsContact C-N 3.3Å; N241-H243 PolarHBondContact O-N 3.31Å; H243-R246 CarbonylContact O-C 3.57Å; H243-R246 WeakPolarHBondContact O-CA 3.48Å; H243-R246 VanDerWaalsContact O-CB 3.3Å; H243-R246 WeakPolarHBondContact O-CB 3.24Å; H243-R246 PolarHBondContact O-N 3.04Å; H243-A247 PolarHBondContact O-N 2.94Å; H243-T318 PolarHBondContact CE1-O 2.97Å; H243-T318 VanDerWaalsContact CE1-O 3.32Å; H243-T318 PolarHBondContact NE2-O 2.54Å; H243-H321 PolarHBondContact CD2-O 2.92Å; H243-H321 VanDerWaalsContact CD2-O 3.32Å; H243-H321 PolarHBondContact NE2-O 2.83Å; H243-T323 PolarHBondContact CD2-OG1 2.82Å
244	N	98.7	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.3	-38.1	-177.2	-66.4	-24	0	0	0	112.1	G158 H161 A162 M240 N241 R246 A247 G248 T323	G158-N244 WeakPolarHBondContact CA-ND2 3.28Å; G158-N244 WeakPolarHBondContact O-CB 3.38Å; H161-N244 HydrophobicContact CB-CB 3.91Å; A162-N244 VanDerWaalsContact CA-O 3.3Å; A162-N244 WeakPolarHBondContact CA-O 3.28Å; A162-N244 WeakPolarHBondContact CB-O 3.47Å; M240-N244 WeakPolarHBondContact CG-ND2 3.49Å; M240-N244 PolarHBondContact O-N 2.71Å; M240-N244 PolarHBondContact O-ND2 3.43Å; N241-N244 PolarHBondContact O-N 2.78Å; N244-R246 VanDerWaalsContact C-N 3.27Å; N244-R246 PolarHBondContact O-N 3.36Å; N244-A247 PolarHBondContact O-N 3.3Å; N244-G248 PolarHBondContact O-N 2.82Å; N244-T323 PolarHBondContact ND2-O 2.97Å; N244-T323 PolarHBondContact OD1-N 3.4Å; N244-T323 PolarHBondContact OD1-O 3.46Å; N244-T323 PolarHBondContact OD1-OG1 2.74Å
245	N	98.6	Very high	97.9	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-55.8	-44.3	168.9	-68.1	-18	0	0	0	110.6	H161 A165 I219 D220 N241 G248 R249	H161-N245 WeakPolarHBondContact CB-OD1 3.26Å; H161-N245 PolarHBondContact ND1-OD1 3.14Å; H161-N245 PolarHBondContact O-OD1 3.27Å; A165-N245 HydrophobicContact CB-CB 4.22Å; A165-N245 WeakPolarHBondContact CB-O 3.25Å; I219-N245 HydrophobicContact CG2-CB 4.44Å; I219-N245 WeakPolarHBondContact CG2-ND2 3.39Å; D220-N245 PolarHBondContact OD1-ND2 3.41Å; N241-N245 WeakPolarHBondContact O-CB 3.3Å; N241-N245 PolarHBondContact O-N 3.11Å; N241-N245 PolarHBondContact O-ND2 3.41Å; N241-N245 PolarHBondContact O-OD1 2.96Å; N245-G248 PolarHBondContact O-N 3.4Å; N245-R249 WeakPolarHBondContact O-CG 3.2Å; N245-R249 PolarHBondContact O-N 3.35Å
246	R	98.6	Very high	97.9	Very high	116 Å²	116	33.1 Å²	33.1	44%	0.438	15%	0.149	S	C	.	.	H	α-helix	trans	-64.3	-44.3	177.4	179	179.4	-176	176.5	-2.1	111.7	L242 H243 N244 G248 R249 L250	L242-R246 WeakPolarHBondContact O-CB 3.47Å; L242-R246 PolarHBondContact O-N 2.8Å; H243-R246 CarbonylContact O-C 3.57Å; H243-R246 WeakPolarHBondContact O-CA 3.48Å; H243-R246 VanDerWaalsContact O-CB 3.3Å; H243-R246 WeakPolarHBondContact O-CB 3.24Å; H243-R246 PolarHBondContact O-N 3.04Å; N244-R246 VanDerWaalsContact C-N 3.27Å; N244-R246 PolarHBondContact O-N 3.36Å; R246-G248 VanDerWaalsContact C-N 3.3Å; R246-G248 PolarHBondContact O-N 2.79Å; R246-R249 PolarHBondContact O-N 3.5Å; R246-L250 HydrophobicContact CG-CD1 3.86Å; R246-L250 HydrophobicContact CG-CG 4.19Å; R246-L250 WeakPolarHBondContact O-CB 3.27Å; R246-L250 WeakPolarHBondContact O-CG 3.47Å; R246-L250 PolarHBondContact O-N 3.38Å
247	A	98.7	Very high	97.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.8	-46	177.4	0	0	0	0	0	111.1	H243 N244 L250 A251 P319 H321	H243-A247 PolarHBondContact O-N 2.94Å; N244-A247 PolarHBondContact O-N 3.3Å; A247-L250 PolarHBondContact O-N 3.29Å; A247-A251 PolarHBondContact O-N 3.43Å; A247-P319 WeakPolarHBondContact CA-O 3.24Å; A247-H321 WeakPolarHBondContact CB-O 3.23Å
248	G	98.8	Very high	97.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.4	-51.8	173.4	0	0	0	0	0	114	A162 A166 N244 N245 R246 L250 A251 V252	A162-G248 WeakPolarHBondContact O-CA 3.17Å; A166-G248 WeakPolarHBondContact CB-O 3.37Å; N244-G248 PolarHBondContact O-N 2.82Å; N245-G248 PolarHBondContact O-N 3.4Å; R246-G248 VanDerWaalsContact C-N 3.3Å; R246-G248 PolarHBondContact O-N 2.79Å; G248-L250 VanDerWaalsContact C-N 3.3Å; G248-L250 PolarHBondContact O-N 2.89Å; G248-A251 WeakPolarHBondContact O-CB 3.27Å; G248-A251 PolarHBondContact O-N 3.36Å; G248-V252 PolarHBondContact O-N 3.21Å
249	R	98.8	Very high	97.9	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-38.7	177.6	-63.4	-169.3	-69.5	-111.6	3.5	112.5	A165 V169 Y212 D220 N245 R246 V252 Y253	A165-R249 HydrophobicContact CB-CG 4.13Å; V169-R249 HydrophobicContact CG2-CB 4.02Å; V169-R249 HydrophobicContact CG2-CG 3.62Å; Y212-R249 HydrophobicContact CD2-CB 3.52Å; Y212-R249 HydrophobicContact CD2-CG 4.45Å; Y212-R249 HydrophobicContact CE2-CB 3.28Å; Y212-R249 HydrophobicContact CE2-CG 4.36Å; Y212-R249 HydrophobicContact CG-CB 4.41Å; D220-R249 VanDerWaalsContact CG-NH1 3.26Å; D220-R249 IonicContact OD1-CZ 2.86Å; D220-R249 IonicContact OD1-NH1 3.49Å; D220-R249 PolarHBondContact OD1-NH1 2.57Å; D220-R249 IonicContact OD1-NH2 3.68Å; D220-R249 IonicContact OD2-CZ 3.84Å; D220-R249 IonicContact OD2-NH1 3.12Å; D220-R249 PolarHBondContact OD2-NH1 3.05Å; D220-R249 VanDerWaalsContact OD2-NH1 3.15Å; D220-R249 IonicContact OD2-NH2 2.73Å; D220-R249 PolarHBondContact OD2-NH2 3.12Å; N245-R249 WeakPolarHBondContact O-CG 3.2Å; N245-R249 PolarHBondContact O-N 3.35Å; R246-R249 PolarHBondContact O-N 3.5Å; R249-V252 PolarHBondContact O-N 3.37Å; R249-Y253 PolarHBondContact O-N 3.01Å
250	L	98.5	Very high	97.8	Very high	30 Å²	30	34.4 Å²	34.4	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-69	-34.9	178.5	-74.6	176.8	0	0	0	112.2	Y212 R246 A247 G248 V252 Y253 K254 P319	Y212-L250 HydrophobicContact CE2-CD2 3.95Å; Y212-L250 HydrophobicContact CE2-CG 4.23Å; R246-L250 HydrophobicContact CG-CD1 3.86Å; R246-L250 HydrophobicContact CG-CG 4.19Å; R246-L250 WeakPolarHBondContact O-CB 3.27Å; R246-L250 WeakPolarHBondContact O-CG 3.47Å; R246-L250 PolarHBondContact O-N 3.38Å; A247-L250 PolarHBondContact O-N 3.29Å; G248-L250 VanDerWaalsContact C-N 3.3Å; G248-L250 PolarHBondContact O-N 2.89Å; L250-V252 VanDerWaalsContact C-N 3.26Å; L250-V252 PolarHBondContact O-N 3.26Å; L250-Y253 PolarHBondContact O-N 3.42Å; L250-Y253 VanDerWaalsContact O-N 3.12Å; L250-K254 WeakPolarHBondContact O-CB 3.23Å; L250-K254 WeakPolarHBondContact O-CG 3.42Å; L250-K254 PolarHBondContact O-N 3.32Å; L250-P319 HydrophobicContact CD1-CB 3.55Å
251	A	98.6	Very high	97.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-57.6	-41.1	175.8	0	0	0	0	0	111.7	A247 G248 Y253 L255 I284 Y287 L288	A247-A251 PolarHBondContact O-N 3.43Å; G248-A251 WeakPolarHBondContact O-CB 3.27Å; G248-A251 PolarHBondContact O-N 3.36Å; A251-Y253 PolarHBondContact O-N 3.2Å; A251-L255 VanDerWaalsContact O-CB 3.32Å; A251-L255 WeakPolarHBondContact O-CB 3.18Å; A251-L255 WeakPolarHBondContact O-CG 3.47Å; A251-L255 PolarHBondContact O-N 3.47Å; A251-I284 HydrophobicContact CB-CG2 4.2Å; A251-Y287 HydrophobicContact CB-CD1 3.74Å; A251-Y287 HydrophobicContact CB-CE1 3.86Å; A251-L288 HydrophobicContact CB-CD1 4.48Å; A251-L288 HydrophobicContact CB-CD2 3.79Å; A251-L288 HydrophobicContact CB-CG 4.09Å
252	V	98.7	Very high	97.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.9	-42.4	176	-173.3	0	0	0	0	111.7	A166 V169 I208 G248 R249 L250 A256 L278 I284	A166-V252 HydrophobicContact CB-CG2 3.75Å; A166-V252 WeakPolarHBondContact O-CG2 3.23Å; V169-V252 HydrophobicContact CB-CB 4.43Å; V169-V252 HydrophobicContact CB-CG2 4.14Å; V169-V252 HydrophobicContact CG1-CB 3.93Å; V169-V252 HydrophobicContact CG1-CG1 3.81Å; V169-V252 HydrophobicContact CG1-CG2 4.19Å; I208-V252 HydrophobicContact CG2-CG1 4.46Å; G248-V252 PolarHBondContact O-N 3.21Å; R249-V252 PolarHBondContact O-N 3.37Å; L250-V252 VanDerWaalsContact C-N 3.26Å; L250-V252 PolarHBondContact O-N 3.26Å; V252-A256 PolarHBondContact O-N 3.06Å; V252-L278 HydrophobicContact CG1-CD2 3.39Å; V252-I284 HydrophobicContact CB-CD1 4.48Å; V252-I284 HydrophobicContact CG1-CD1 4.34Å; V252-I284 HydrophobicContact CG2-CD1 4.2Å; V252-I284 HydrophobicContact CG2-CG2 4.44Å
253	Y	96.5	Very high	97.5	Very high	145 Å²	145	45.1 Å²	45.1	57%	0.569	23%	0.226	S	C	*	.	H	α-helix	trans	-67.9	-48.9	179	-174.3	-91	0	0	0	111.9	I208 R249 L250 A251 L255 A256	I208-Y253 HydrophobicContact CG2-CD2 3.93Å; R249-Y253 PolarHBondContact O-N 3.01Å; L250-Y253 PolarHBondContact O-N 3.42Å; L250-Y253 VanDerWaalsContact O-N 3.12Å; A251-Y253 PolarHBondContact O-N 3.2Å; Y253-L255 VanDerWaalsContact C-N 3.33Å; Y253-L255 PolarHBondContact O-N 2.79Å; Y253-A256 VanDerWaalsContact O-CB 3.26Å; Y253-A256 WeakPolarHBondContact O-CB 3.23Å; Y253-A256 PolarHBondContact O-N 2.89Å
254	K	96.9	Very high	97.2	Very high	108 Å²	108	43.8 Å²	43.8	47%	0.47	22%	0.223	S	C	.	.	H	α-helix	trans	-62.8	-36.9	-178.8	-74.8	-171.4	175.5	-162.8	0	113	L250 A256 D320	L250-K254 WeakPolarHBondContact O-CB 3.23Å; L250-K254 WeakPolarHBondContact O-CG 3.42Å; L250-K254 PolarHBondContact O-N 3.32Å; K254-A256 VanDerWaalsContact C-N 3.31Å; K254-D320 IonicContact NZ-OD1 2.79Å; K254-D320 IonicContact NZ-OD2 3.28Å; K254-D320 PolarHBondContact NZ-OD2 3.44Å
255	L	98.1	Very high	97	Very high	22 Å²	22	49.9 Å²	49.9	12%	0.115	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	0.1	-179.1	-65.5	173.2	0	0	0	113	A251 Y253 S279 I284 Y287	A251-L255 VanDerWaalsContact O-CB 3.32Å; A251-L255 WeakPolarHBondContact O-CB 3.18Å; A251-L255 WeakPolarHBondContact O-CG 3.47Å; A251-L255 PolarHBondContact O-N 3.47Å; Y253-L255 VanDerWaalsContact C-N 3.33Å; Y253-L255 PolarHBondContact O-N 2.79Å; L255-S279 VanDerWaalsContact O-CB 3.28Å; L255-S279 WeakPolarHBondContact O-CB 3.46Å; L255-S279 PolarHBondContact O-OG 3.13Å; L255-I284 HydrophobicContact CB-CG1 4.49Å; L255-I284 HydrophobicContact CD1-CB 4.27Å; L255-I284 HydrophobicContact CD1-CG1 3.84Å; L255-Y287 HydrophobicContact CD1-CD1 4.29Å; L255-Y287 HydrophobicContact CD1-CD2 4.3Å; L255-Y287 HydrophobicContact CD1-CG 3.83Å; L255-Y287 HydrophobicContact CD2-CD2 4.27Å
256	A	97.2	Very high	96.8	Very high	31 Å²	31	56.1 Å²	56.1	26%	0.256	30%	0.304	S	S	.	.			trans	-61.6	147.2	170.7	0	0	0	0	0	110.3	I208 V252 Y253 K254 T276	I208-A256 HydrophobicContact CD1-CB 3.32Å; V252-A256 PolarHBondContact O-N 3.06Å; Y253-A256 VanDerWaalsContact O-CB 3.26Å; Y253-A256 WeakPolarHBondContact O-CB 3.23Å; Y253-A256 PolarHBondContact O-N 2.89Å; K254-A256 VanDerWaalsContact C-N 3.31Å; A256-T276 HydrophobicContact CB-CG2 4.35Å
257	S	95.8	Very high	96.4	Very high	53 Å²	53	53.1 Å²	53.1	37%	0.371	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	165.5	-176.9	58.7	0	0	0	0	110.8	Q277	S257-Q277 PolarHBondContact N-O 3.33Å; S257-Q277 PolarHBondContact O-N 2.81Å
258	V	96.5	Very high	96.2	Very high	59 Å²	59	55.8 Å²	55.8	36%	0.358	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.8	167.9	178.7	0	0	0	0	108.4	P192 L195 W201 C274	P192-V258 HydrophobicContact CB-CG2 4.5Å; P192-V258 HydrophobicContact CG-CG2 3.71Å; L195-V258 HydrophobicContact CD1-CG1 3.89Å; W201-V258 HydrophobicContact CZ3-CG1 4.11Å; W201-V258 HydrophobicContact CZ3-CG2 4.11Å; V258-C274 HydrophobicContact CG1-CB 3.59Å
259	A	96.4	Very high	95.9	Very high	27 Å²	27	58.7 Å²	58.7	22%	0.223	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	146.5	166.1	0	0	0	0	0	109.6	C274 W275 Q277	A259-C274 CarbonylContact O-C 3.56Å; A259-C274 WeakPolarHBondContact O-CA 3.36Å; A259-W275 PolarHBondContact N-O 3.24Å; A259-W275 PolarHBondContact O-N 2.03Å; A259-Q277 HydrophobicContact CB-CB 3.51Å; A259-Q277 HydrophobicContact CB-CG 3.67Å
260	C	96.5	Very high	95.5	Very high	46 Å²	46	62.9 Å²	62.9	31%	0.311	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.6	-178.4	-54.8	0	0	0	0	110.9	R272 T273 C274	C260-R272 HydrophobicContact CB-CB 4.47Å; C260-R272 HydrophobicContact CB-CG 4.47Å; C260-T273 CarbonylContact C-O 3.51Å; C260-T273 VanDerWaalsContact CA-O 3.24Å; C260-T273 WeakPolarHBondContact CA-O 3.39Å; C260-C274 HydrophobicContact CB-CB 4.05Å; C260-C274 WeakPolarHBondContact CB-SG 3.42Å; C260-C274 WeakPolarHBondContact SG-CB 3.39Å; C260-C274 CovalentContact SG-SG 2.04Å; C260-C274 PolarHBondContact SG-SG 3.46Å
261	K	96.4	Very high	95.3	Very high	140 Å²	140	64.9 Å²	64.9	61%	0.609	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.7	166.8	176.2	177.2	-176.6	-175.6	0	109.8	H263 R272 T273 W275	K261-H263 PolarHBondContact O-CD2 2.84Å; K261-R272 VanDerWaalsContact O-CA 3.24Å; K261-R272 WeakPolarHBondContact O-CA 3.44Å; K261-R272 VanDerWaalsContact O-CB 3.31Å; K261-R272 WeakPolarHBondContact O-CB 3.13Å; K261-T273 PolarHBondContact N-O 2.97Å; K261-T273 PolarHBondContact O-N 2.78Å; K261-T273 VanDerWaalsContact O-N 3.09Å; K261-W275 HydrophobicContact CB-CH2 3.6Å; K261-W275 HydrophobicContact CB-CZ3 3.94Å
262	C	96.6	Very high	95.1	Very high	39 Å²	39	67.8 Å²	67.8	26%	0.264	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	137.4	176.3	-55.5	0	0	0	0	110.2	C269	C262-C269 HydrophobicContact CB-CB 3.87Å; C262-C269 WeakPolarHBondContact CB-SG 3.33Å; C262-C269 VanDerWaalsContact SG-CA 3.55Å; C262-C269 WeakPolarHBondContact SG-CB 3.26Å; C262-C269 CovalentContact SG-SG 2.03Å; C262-C269 PolarHBondContact SG-SG 3.15Å
263	H	94.4	Very high	95	Very high	84 Å²	84	69 Å²	69	39%	0.389	41%	0.407	S	S	.	.			trans	-147.2	22.3	-178.7	53	80.3	0	0	0	112.8	K261 L271 T273	K261-H263 PolarHBondContact O-CD2 2.84Å; H263-L271 WeakPolarHBondContact CE1-CD2 3.25Å; H263-L271 WeakPolarHBondContact CE1-CG 3.42Å; H263-L271 PolarHBondContact N-O 3.01Å; H263-L271 VanDerWaalsContact ND1-CD2 3.34Å; H263-L271 WeakPolarHBondContact ND1-CD2 3.48Å; H263-T273 PolarHBondContact NE2-N 3.12Å; H263-T273 PolarHBondContact NE2-OG1 2.81Å
264	G	92	Very high	95.1	Very high	14 Å²	14	62.1 Å²	62.1	14%	0.144	38%	0.38	C	S	.	.	S	Bend	trans	-68.5	174.1	165.3	0	0	0	0	0	112.3	S266 G267 S268 L271	G264-S266 PolarHBondContact O-N 3.37Å; G264-G267 PolarHBondContact O-N 3.29Å; G264-S268 VanDerWaalsContact CA-O 3.25Å; G264-S268 WeakPolarHBondContact CA-O 3.42Å; G264-S268 PolarHBondContact N-O 3.3Å; G264-S268 PolarHBondContact O-N 3.15Å; G264-L271 PolarHBondContact N-O 2.74Å
265	V	95.1	Very high	95.1	Very high	128 Å²	128	59.3 Å²	59.3	78%	0.776	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-50.8	130.7	-179.4	-176.5	0	0	0	0	110.3	G267 S268	V265-G267 PolarHBondContact O-N 2.9Å; V265-S268 WeakPolarHBondContact O-CB 3.39Å; V265-S268 PolarHBondContact O-N 3.44Å
266	S	93.3	Very high	95.1	Very high	132 Å²	132	59.2 Å²	59.2	92%	0.923	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	55.8	27.8	-177.5	-54.8	0	0	0	0	115.2	G264	G264-S266 PolarHBondContact O-N 3.37Å
267	G	91.4	Very high	95.1	Very high	53 Å²	53	59.3 Å²	59.3	55%	0.546	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	84.2	10.6	-178.7	0	0	0	0	0	114.4	G264 V265	G264-G267 PolarHBondContact O-N 3.29Å; V265-G267 PolarHBondContact O-N 2.9Å
268	S	93.1	Very high	95.2	Very high	56 Å²	56	57.1 Å²	57.1	39%	0.392	35%	0.345	S	S	.	.			trans	-57.2	146.6	175.4	176.8	0	0	0	0	112.4	G264 V265 S270	G264-S268 VanDerWaalsContact CA-O 3.25Å; G264-S268 WeakPolarHBondContact CA-O 3.42Å; G264-S268 PolarHBondContact N-O 3.3Å; G264-S268 PolarHBondContact O-N 3.15Å; V265-S268 WeakPolarHBondContact O-CB 3.39Å; V265-S268 PolarHBondContact O-N 3.44Å; S268-S270 VanDerWaalsContact C-N 3.32Å; S268-S270 PolarHBondContact OG-N 3.43Å; S268-S270 PolarHBondContact OG-OG 3.49Å
269	C	93.7	Very high	95.3	Very high	62 Å²	62	54.4 Å²	54.4	42%	0.419	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	13.6	176.5	-63.2	0	0	0	0	113.8	C262 L271	C262-C269 HydrophobicContact CB-CB 3.87Å; C262-C269 WeakPolarHBondContact CB-SG 3.33Å; C262-C269 VanDerWaalsContact SG-CA 3.55Å; C262-C269 WeakPolarHBondContact SG-CB 3.26Å; C262-C269 CovalentContact SG-SG 2.03Å; C262-C269 PolarHBondContact SG-SG 3.15Å; C269-L271 PolarHBondContact O-N 2.93Å
270	S	90.9	Very high	95.4	Very high	91 Å²	91	57.2 Å²	57.2	64%	0.636	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.5	170.4	55.7	0	0	0	0	111.7	S268	S268-S270 VanDerWaalsContact C-N 3.32Å; S268-S270 PolarHBondContact OG-N 3.43Å; S268-S270 PolarHBondContact OG-OG 3.49Å
271	L	92.5	Very high	95.5	Very high	73 Å²	73	55.7 Å²	55.7	38%	0.382	33%	0.333	S	S	.	.	S	Bend	trans	-117.1	128.8	168.6	-167.5	67.7	0	0	0	109.5	I200 H263 G264 C269	I200-L271 HydrophobicContact CD1-CD1 4.09Å; H263-L271 WeakPolarHBondContact CE1-CD2 3.25Å; H263-L271 WeakPolarHBondContact CE1-CG 3.42Å; H263-L271 PolarHBondContact N-O 3.01Å; H263-L271 VanDerWaalsContact ND1-CD2 3.34Å; H263-L271 WeakPolarHBondContact ND1-CD2 3.48Å; G264-L271 PolarHBondContact N-O 2.74Å; C269-L271 PolarHBondContact O-N 2.93Å
272	R	95.5	Very high	95.6	Very high	61 Å²	61	51.2 Å²	51.2	23%	0.23	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	149.7	175.1	62.6	175.4	124.7	177.9	-2.6	112	W199 I200 C260 K261	W199-R272 HydrophobicContact CB-CG 3.91Å; W199-R272 VanDerWaalsContact CD2-CD 3.42Å; W199-R272 HydrophobicContact CD2-CG 3.83Å; W199-R272 VanDerWaalsContact CD2-CZ 3.49Å; W199-R272 HydrophobicContact CE3-CG 4.37Å; W199-R272 HydrophobicContact CG-CG 3.51Å; W199-R272 VanDerWaalsContact CZ2-NH1 3.33Å; W199-R272 VanDerWaalsContact CZ3-NH1 3.35Å; W199-R272 VanDerWaalsContact NE1-NE 3.15Å; I200-R272 PolarHBondContact N-O 3.34Å; C260-R272 HydrophobicContact CB-CB 4.47Å; C260-R272 HydrophobicContact CB-CG 4.47Å; K261-R272 VanDerWaalsContact O-CA 3.24Å; K261-R272 WeakPolarHBondContact O-CA 3.44Å; K261-R272 VanDerWaalsContact O-CB 3.31Å; K261-R272 WeakPolarHBondContact O-CB 3.13Å
273	T	96.8	Very high	95.7	Very high	26 Å²	26	55.2 Å²	55.2	16%	0.16	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.3	172.5	-57.5	0	0	0	0	109.2	I200 G202 C260 K261 H263 W275	I200-T273 HydrophobicContact CB-CG2 4.44Å; I200-T273 HydrophobicContact CG2-CG2 4.32Å; I200-T273 CarbonylContact O-C 3.5Å; I200-T273 VanDerWaalsContact O-CA 3.32Å; I200-T273 WeakPolarHBondContact O-CA 3.21Å; G202-T273 VanDerWaalsContact C-CG2 3.46Å; C260-T273 CarbonylContact C-O 3.51Å; C260-T273 VanDerWaalsContact CA-O 3.24Å; C260-T273 WeakPolarHBondContact CA-O 3.39Å; K261-T273 PolarHBondContact N-O 2.97Å; K261-T273 PolarHBondContact O-N 2.78Å; K261-T273 VanDerWaalsContact O-N 3.09Å; H263-T273 PolarHBondContact NE2-N 3.12Å; H263-T273 PolarHBondContact NE2-OG1 2.81Å; T273-W275 WeakPolarHBondContact O-CZ3 3.04Å
274	C	97.6	Very high	95.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.4	-174.4	-53.9	0	0	0	0	112.3	L195 I200 W201 G202 V258 A259 C260	L195-C274 HydrophobicContact CD1-CB 4.45Å; L195-C274 HydrophobicContact CD2-CB 4.13Å; I200-C274 PolarHBondContact O-N 3.46Å; W201-C274 HydrophobicContact CE3-CB 4.27Å; W201-C274 VanDerWaalsContact CE3-O 3.24Å; W201-C274 HydrophobicContact CZ3-CB 4.5Å; G202-C274 PolarHBondContact N-O 3.26Å; G202-C274 CarbonylContact O-C 3.5Å; V258-C274 HydrophobicContact CG1-CB 3.59Å; A259-C274 CarbonylContact O-C 3.56Å; A259-C274 WeakPolarHBondContact O-CA 3.36Å; C260-C274 HydrophobicContact CB-CB 4.05Å; C260-C274 WeakPolarHBondContact CB-SG 3.42Å; C260-C274 WeakPolarHBondContact SG-CB 3.39Å; C260-C274 CovalentContact SG-SG 2.04Å; C260-C274 PolarHBondContact SG-SG 3.46Å
275	W	97.6	Very high	96.2	Very high	49 Å²	49	50.5 Å²	50.5	19%	0.186	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	166.6	-178.9	54.8	85.4	0	0	0	112.2	W201 G202 A259 K261 T273 Q277	W201-W275 VanDerWaalsContact CH2-C 3.47Å; G202-W275 WeakPolarHBondContact O-CB 3.06Å; A259-W275 PolarHBondContact N-O 3.24Å; A259-W275 PolarHBondContact O-N 2.03Å; K261-W275 HydrophobicContact CB-CH2 3.6Å; K261-W275 HydrophobicContact CB-CZ3 3.94Å; T273-W275 WeakPolarHBondContact O-CZ3 3.04Å; W275-Q277 PolarHBondContact O-N 2.9Å
276	T	97.2	Very high	96.4	Very high	19 Å²	19	50.6 Å²	50.6	12%	0.117	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	126.1	170.7	-45.3	0	0	0	0	111	S187 W201 G205 D206 I208 A256	S187-T276 PolarHBondContact OG-OG1 3.12Å; W201-T276 VanDerWaalsContact CH2-N 3.25Å; W201-T276 WeakPolarHBondContact CH2-OG1 3.1Å; W201-T276 WeakPolarHBondContact CZ2-OG1 3.37Å; G205-T276 CarbonylContact C-O 3.58Å; G205-T276 WeakPolarHBondContact CA-O 3.49Å; D206-T276 PolarHBondContact N-O 3.41Å; I208-T276 HydrophobicContact CD1-CG2 3.93Å; A256-T276 HydrophobicContact CB-CG2 4.35Å
277	Q	98.1	Very high	96.6	Very high	34 Å²	34	47.5 Å²	47.5	16%	0.159	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.6	-177.1	-173.4	52.8	67.3	0	0	110.3	K177 D206 S257 A259 W275	K177-Q277 VanDerWaalsContact NZ-OE1 3.08Å; D206-Q277 WeakPolarHBondContact OD2-CA 3.36Å; D206-Q277 PolarHBondContact OD2-NE2 3.1Å; S257-Q277 PolarHBondContact N-O 3.33Å; S257-Q277 PolarHBondContact O-N 2.81Å; A259-Q277 HydrophobicContact CB-CB 3.51Å; A259-Q277 HydrophobicContact CB-CG 3.67Å; W275-Q277 PolarHBondContact O-N 2.9Å
278	L	98.4	Very high	97	Very high	6 Å²	6	45 Å²	45	3%	0.031	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-58.6	138.6	169.1	-71.7	165.6	0	0	0	110.2	H170 A173 R174 D206 I208 V252	H170-L278 WeakPolarHBondContact O-CD1 3.32Å; A173-L278 HydrophobicContact CB-CD1 3.96Å; A173-L278 HydrophobicContact CB-CD2 4.22Å; A173-L278 HydrophobicContact CB-CG 4.43Å; R174-L278 HydrophobicContact CB-CD1 4.05Å; D206-L278 HydrophobicContact CB-CD1 3.92Å; D206-L278 HydrophobicContact CB-CG 3.64Å; D206-L278 PolarHBondContact OD2-N 3.34Å; I208-L278 HydrophobicContact CD1-CD2 3.85Å; I208-L278 HydrophobicContact CG1-CD2 3.89Å; V252-L278 HydrophobicContact CG1-CD2 3.39Å
279	S	98.4	Very high	97.2	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.021	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-64.3	154.4	165.6	-93	0	0	0	0	111.2	H170 L255 F281 R283	H170-S279 PolarHBondContact NE2-O 2.98Å; L255-S279 VanDerWaalsContact O-CB 3.28Å; L255-S279 WeakPolarHBondContact O-CB 3.46Å; L255-S279 PolarHBondContact O-OG 3.13Å; S279-F281 PolarHBondContact O-N 2.65Å; S279-R283 PolarHBondContact OG-NH1 3.46Å
280	P	98.4	Very high	97.4	Very high	85 Å²	85	48.4 Å²	48.4	55%	0.552	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-52	135.6	166.5	-24.6	34.2	0	0	0	110.5	T282 R283 I284	P280-T282 PolarHBondContact O-N 3.38Å; P280-T282 VanDerWaalsContact O-N 3.16Å; P280-R283 WeakPolarHBondContact O-CB 3.24Å; P280-R283 PolarHBondContact O-N 3.12Å; P280-I284 PolarHBondContact O-N 3.04Å
281	F	98.6	Very high	97.7	Very high	14 Å²	14	45 Å²	45	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-28.5	-174.6	-164.1	-105.5	0	0	0	112.8	L121 E125 I163 A166 H170 S279 R283 I284 G285	L121-F281 HydrophobicContact CD1-CB 4.08Å; L121-F281 HydrophobicContact CD1-CD1 3.57Å; L121-F281 HydrophobicContact CD1-CE1 4.19Å; L121-F281 HydrophobicContact CD1-CG 3.9Å; L121-F281 HydrophobicContact CD2-CB 4.08Å; L121-F281 HydrophobicContact CD2-CD1 3.94Å; L121-F281 HydrophobicContact CD2-CD2 3.73Å; L121-F281 HydrophobicContact CD2-CE1 4.28Å; L121-F281 HydrophobicContact CD2-CE2 4.13Å; L121-F281 HydrophobicContact CD2-CG 3.64Å; L121-F281 HydrophobicContact CD2-CZ 4.37Å; L121-F281 HydrophobicContact CG-CB 4.33Å; L121-F281 HydrophobicContact CG-CD1 3.43Å; L121-F281 VanDerWaalsContact CG-CD1 3.43Å; L121-F281 HydrophobicContact CG-CD2 4.14Å; L121-F281 HydrophobicContact CG-CE1 3.63Å; L121-F281 HydrophobicContact CG-CE2 4.34Å; L121-F281 HydrophobicContact CG-CG 3.7Å; L121-F281 HydrophobicContact CG-CZ 4.09Å; L121-F281 WeakPolarHBondContact O-CE1 3.45Å; E125-F281 HydrophobicContact CB-CD1 3.71Å; E125-F281 HydrophobicContact CB-CE1 3.48Å; E125-F281 VanDerWaalsContact CB-CE1 3.48Å; E125-F281 HydrophobicContact CG-CD1 3.8Å; E125-F281 HydrophobicContact CG-CE1 3.8Å; I163-F281 HydrophobicContact CD1-CE1 3.88Å; I163-F281 HydrophobicContact CD1-CZ 3.79Å; I163-F281 HydrophobicContact CG1-CE1 4.36Å; I163-F281 HydrophobicContact CG1-CZ 4.32Å; A166-F281 HydrophobicContact CB-CE2 4.2Å; A166-F281 HydrophobicContact CB-CZ 4.41Å; H170-F281 HydrophobicContact CB-CD2 3.89Å; H170-F281 HydrophobicContact CB-CE2 4.04Å; H170-F281 AromaticContact CD2-CD2 3.75Å; H170-F281 AromaticContact CG-CD2 3.72Å; S279-F281 PolarHBondContact O-N 2.65Å; F281-R283 PolarHBondContact O-N 2.87Å; F281-I284 HydrophobicContact CD2-CB 4.38Å; F281-I284 HydrophobicContact CD2-CD1 4.03Å; F281-I284 HydrophobicContact CE2-CG2 4.42Å; F281-I284 CarbonylContact O-C 3.55Å; F281-I284 WeakPolarHBondContact O-CA 3.41Å; F281-I284 WeakPolarHBondContact O-CB 3.47Å; F281-I284 PolarHBondContact O-N 3.18Å; F281-G285 PolarHBondContact O-N 3.46Å
282	T	98.5	Very high	97.9	Very high	46 Å²	46	42.6 Å²	42.6	28%	0.282	20%	0.196	S	C	.	.	H	α-helix	trans	-59.1	-32.8	172.9	56.5	0	0	0	0	113.4	E125 P280 R286	E125-T282 WeakPolarHBondContact OE1-CA 3.49Å; P280-T282 PolarHBondContact O-N 3.38Å; P280-T282 VanDerWaalsContact O-N 3.16Å; T282-R286 PolarHBondContact O-N 3.33Å; T282-R286 VanDerWaalsContact O-N 3.07Å
283	R	98.5	Very high	97.9	Very high	123 Å²	123	42.7 Å²	42.7	46%	0.464	20%	0.201	S	C	.	.	H	α-helix	trans	-71	-37.7	174	-172.5	-178.6	-178.5	-171.8	4.6	111	S279 P280 F281 R286 Y287	S279-R283 PolarHBondContact OG-NH1 3.46Å; P280-R283 WeakPolarHBondContact O-CB 3.24Å; P280-R283 PolarHBondContact O-N 3.12Å; F281-R283 PolarHBondContact O-N 2.87Å; R283-R286 PolarHBondContact O-N 3.18Å; R283-Y287 WeakPolarHBondContact O-CB 3.45Å; R283-Y287 PolarHBondContact O-N 3.26Å
284	I	98.7	Very high	97.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-44.3	177	-58.5	170.8	0	0	0	110	A166 A251 V252 L255 P280 F281 R286 Y287 L288	A166-I284 HydrophobicContact CB-CG2 4.05Å; A251-I284 HydrophobicContact CB-CG2 4.2Å; V252-I284 HydrophobicContact CB-CD1 4.48Å; V252-I284 HydrophobicContact CG1-CD1 4.34Å; V252-I284 HydrophobicContact CG2-CD1 4.2Å; V252-I284 HydrophobicContact CG2-CG2 4.44Å; L255-I284 HydrophobicContact CB-CG1 4.49Å; L255-I284 HydrophobicContact CD1-CB 4.27Å; L255-I284 HydrophobicContact CD1-CG1 3.84Å; P280-I284 PolarHBondContact O-N 3.04Å; F281-I284 HydrophobicContact CD2-CB 4.38Å; F281-I284 HydrophobicContact CD2-CD1 4.03Å; F281-I284 HydrophobicContact CE2-CG2 4.42Å; F281-I284 CarbonylContact O-C 3.55Å; F281-I284 WeakPolarHBondContact O-CA 3.41Å; F281-I284 WeakPolarHBondContact O-CB 3.47Å; F281-I284 PolarHBondContact O-N 3.18Å; I284-R286 PolarHBondContact O-N 3.21Å; I284-Y287 PolarHBondContact O-N 3.28Å; I284-L288 HydrophobicContact CG2-CD1 4.15Å; I284-L288 WeakPolarHBondContact O-CG 3.1Å; I284-L288 PolarHBondContact O-N 3.09Å
285	G	98.6	Very high	97.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-46.3	173.4	0	0	0	0	0	112.5	F281 L288 R289	F281-G285 PolarHBondContact O-N 3.46Å; G285-L288 PolarHBondContact O-N 2.68Å; G285-R289 WeakPolarHBondContact O-CB 3.23Å; G285-R289 PolarHBondContact O-N 2.93Å
286	R	98.3	Very high	97.9	Very high	129 Å²	129	46.5 Å²	46.5	49%	0.487	22%	0.22	S	C	.	.	H	α-helix	trans	-62.7	-43.5	176.2	-169.2	-174.8	-58.4	118	0.6	112.6	T282 R283 I284 R289 Q290	T282-R286 PolarHBondContact O-N 3.33Å; T282-R286 VanDerWaalsContact O-N 3.07Å; R283-R286 PolarHBondContact O-N 3.18Å; I284-R286 PolarHBondContact O-N 3.21Å; R286-R289 PolarHBondContact O-N 3.48Å; R286-Q290 WeakPolarHBondContact O-CG 3.21Å; R286-Q290 PolarHBondContact O-N 3.28Å
287	Y	98.5	Very high	98	Very high	67 Å²	67	48.6 Å²	48.6	26%	0.263	23%	0.228	S	C	.	.	H	α-helix	trans	-61.2	-46.4	177.3	175.8	-89.4	0	0	0	111.5	A251 L255 R283 I284 R289 Q290 G291 D320	A251-Y287 HydrophobicContact CB-CD1 3.74Å; A251-Y287 HydrophobicContact CB-CE1 3.86Å; L255-Y287 HydrophobicContact CD1-CD1 4.29Å; L255-Y287 HydrophobicContact CD1-CD2 4.3Å; L255-Y287 HydrophobicContact CD1-CG 3.83Å; L255-Y287 HydrophobicContact CD2-CD2 4.27Å; R283-Y287 WeakPolarHBondContact O-CB 3.45Å; R283-Y287 PolarHBondContact O-N 3.26Å; I284-Y287 PolarHBondContact O-N 3.28Å; Y287-R289 VanDerWaalsContact C-N 3.29Å; Y287-R289 PolarHBondContact O-N 2.91Å; Y287-Q290 PolarHBondContact O-N 2.86Å; Y287-G291 PolarHBondContact O-N 3.01Å; Y287-D320 PolarHBondContact OH-OD2 3.32Å
288	L	98.6	Very high	98	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-31.8	176	-70	174.5	0	0	0	111.9	F159 A162 I163 A166 A251 I284 G285 G291 Y292 I322	F159-L288 HydrophobicContact CD2-CB 4.21Å; F159-L288 HydrophobicContact CE2-CB 3.64Å; F159-L288 HydrophobicContact CZ-CB 4.46Å; A162-L288 HydrophobicContact CB-CD1 4.36Å; A162-L288 HydrophobicContact CB-CD2 4.12Å; I163-L288 HydrophobicContact CB-CD1 4.34Å; I163-L288 HydrophobicContact CD1-CD1 3.74Å; A166-L288 HydrophobicContact CB-CD1 3.97Å; A251-L288 HydrophobicContact CB-CD1 4.48Å; A251-L288 HydrophobicContact CB-CD2 3.79Å; A251-L288 HydrophobicContact CB-CG 4.09Å; I284-L288 HydrophobicContact CG2-CD1 4.15Å; I284-L288 WeakPolarHBondContact O-CG 3.1Å; I284-L288 PolarHBondContact O-N 3.09Å; G285-L288 PolarHBondContact O-N 2.68Å; L288-G291 CarbonylContact O-C 3.51Å; L288-G291 PolarHBondContact O-N 3.46Å; L288-Y292 PolarHBondContact O-N 3.02Å; L288-I322 WeakPolarHBondContact O-CD1 3.29Å
289	R	97.5	Very high	97.9	Very high	82 Å²	82	52.2 Å²	52.2	31%	0.309	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-42.8	177	-172.3	175.2	79	153.4	5.9	111.2	Q129 F159 G285 R286 Y287 G291 Y292 D293	Q129-R289 WeakPolarHBondContact O-CD 3.5Å; Q129-R289 PolarHBondContact O-NH1 2.99Å; Q129-R289 VanDerWaalsContact OE1-CD 3.24Å; F159-R289 HydrophobicContact CE2-CB 4.32Å; G285-R289 WeakPolarHBondContact O-CB 3.23Å; G285-R289 PolarHBondContact O-N 2.93Å; R286-R289 PolarHBondContact O-N 3.48Å; Y287-R289 VanDerWaalsContact C-N 3.29Å; Y287-R289 PolarHBondContact O-N 2.91Å; R289-G291 VanDerWaalsContact C-N 3.29Å; R289-G291 PolarHBondContact O-N 3.39Å; R289-Y292 WeakPolarHBondContact O-CB 3.4Å; R289-Y292 PolarHBondContact O-N 2.83Å; R289-D293 PolarHBondContact O-N 3.38Å
290	Q	97.1	Very high	97.9	Very high	107 Å²	107	53.7 Å²	53.7	50%	0.5	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-43.7	171.5	-69.8	170.7	-18.2	0	0	110.7	R286 Y287 Y292 D293 E294	R286-Q290 WeakPolarHBondContact O-CG 3.21Å; R286-Q290 PolarHBondContact O-N 3.28Å; Y287-Q290 PolarHBondContact O-N 2.86Å; Q290-Y292 PolarHBondContact O-N 3.15Å; Q290-D293 PolarHBondContact O-N 3.39Å; Q290-E294 PolarHBondContact O-N 2.04Å; Q290-E294 VanDerWaalsContact O-N 3.11Å
291	G	97.4	Very high	97.8	Very high	18 Å²	18	51.1 Å²	51.1	19%	0.186	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-24.3	173.7	0	0	0	0	0	114.7	Y287 L288 R289 A295	Y287-G291 PolarHBondContact O-N 3.01Å; L288-G291 CarbonylContact O-C 3.51Å; L288-G291 PolarHBondContact O-N 3.46Å; R289-G291 VanDerWaalsContact C-N 3.29Å; R289-G291 PolarHBondContact O-N 3.39Å; G291-A295 PolarHBondContact O-N 3.23Å
292	Y	97.6	Very high	97.6	Very high	23 Å²	23	61.4 Å²	61.4	9%	0.09	27%	0.27	C	S	.	.	H	α-helix	trans	-76.1	-42.7	172.9	159	-85.2	0	0	0	111.5	F130 R155 E156 F159 L288 R289 Q290 E294 A295	F130-Y292 HydrophobicContact CE1-CD1 4.09Å; F130-Y292 HydrophobicContact CE1-CD2 4.34Å; F130-Y292 AromaticContact CE1-CE1 3.69Å; F130-Y292 HydrophobicContact CE1-CE1 3.69Å; F130-Y292 AromaticContact CE1-CE2 3.94Å; F130-Y292 HydrophobicContact CE1-CE2 3.94Å; F130-Y292 HydrophobicContact CE1-CG 4.42Å; F130-Y292 AromaticContact CE1-CZ 3.62Å; F130-Y292 AromaticContact CZ-CD1 3.77Å; F130-Y292 HydrophobicContact CZ-CD1 3.77Å; F130-Y292 AromaticContact CZ-CD2 3.87Å; F130-Y292 HydrophobicContact CZ-CD2 3.87Å; F130-Y292 AromaticContact CZ-CE1 3.88Å; F130-Y292 HydrophobicContact CZ-CE1 3.88Å; F130-Y292 AromaticContact CZ-CE2 3.94Å; F130-Y292 HydrophobicContact CZ-CE2 3.94Å; F130-Y292 AromaticContact CZ-CG 3.79Å; F130-Y292 HydrophobicContact CZ-CG 3.79Å; F130-Y292 AromaticContact CZ-CZ 3.97Å; R155-Y292 HydrophobicContact CB-CD2 3.79Å; R155-Y292 HydrophobicContact CB-CE2 3.39Å; R155-Y292 WeakPolarHBondContact O-CD2 3.36Å; E156-Y292 HydrophobicContact CG-CE2 4.19Å; E156-Y292 PolarHBondContact OE1-OH 3.34Å; F159-Y292 HydrophobicContact CB-CD2 3.92Å; F159-Y292 HydrophobicContact CB-CG 4.46Å; L288-Y292 PolarHBondContact O-N 3.02Å; R289-Y292 WeakPolarHBondContact O-CB 3.4Å; R289-Y292 PolarHBondContact O-N 2.83Å; Q290-Y292 PolarHBondContact O-N 3.15Å; Y292-E294 PolarHBondContact O-N 3.26Å; Y292-A295 WeakPolarHBondContact O-CB 3.48Å; Y292-A295 PolarHBondContact O-N 3.48Å; Y292-A295 VanDerWaalsContact O-N 3.12Å
293	D	95.8	Very high	97.5	Very high	64 Å²	64	68.3 Å²	68.3	34%	0.342	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-34.3	177.4	-69.8	-36.7	0	0	0	110.5	R133 R289 Q290	R133-D293 IonicContact CZ-OD1 2.81Å; R133-D293 IonicContact NH1-OD1 3.36Å; R133-D293 PolarHBondContact NH1-OD1 2.98Å; R133-D293 IonicContact NH2-OD1 3.5Å; R133-D293 PolarHBondContact NH2-OD1 3.12Å; R133-D293 IonicContact NH2-OD2 3.72Å; R133-D293 PolarHBondContact NH2-OD2 3.35Å; R133-D293 VanDerWaalsContact NH2-OD2 3.09Å; R289-D293 PolarHBondContact O-N 3.38Å; Q290-D293 PolarHBondContact O-N 3.39Å
294	E	96	Very high	97.4	Very high	141 Å²	141	62.5 Å²	62.5	66%	0.659	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	15.5	176.9	-61.2	178	-174.2	0	0	114.3	Q290 Y292	Q290-E294 PolarHBondContact O-N 2.04Å; Q290-E294 VanDerWaalsContact O-N 3.11Å; Y292-E294 PolarHBondContact O-N 3.26Å
295	A	97.8	Very high	97.2	Very high	9 Å²	9	65 Å²	65	7%	0.074	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-58.9	143.5	-174.7	0	0	0	0	0	112.9	R155 G291 Y292 I322 Y324	R155-A295 HydrophobicContact CG-CB 4.13Å; G291-A295 PolarHBondContact O-N 3.23Å; Y292-A295 WeakPolarHBondContact O-CB 3.48Å; Y292-A295 PolarHBondContact O-N 3.48Å; Y292-A295 VanDerWaalsContact O-N 3.12Å; A295-I322 WeakPolarHBondContact CA-O 3Å; A295-I322 HydrophobicContact CB-CB 4.22Å; A295-I322 HydrophobicContact CB-CG2 4.16Å; A295-Y324 HydrophobicContact CB-CD1 4.02Å; A295-Y324 HydrophobicContact CB-CE1 4.47Å; A295-Y324 WeakPolarHBondContact O-CE1 3.31Å
296	I	98.1	Very high	97.1	Very high	4 Å²	4	73.8 Å²	73.8	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.1	-172.4	-58.3	173.7	0	0	0	110.7	R309 L314 S315 I317 H321 I322 T323 Y324	I296-R309 HydrophobicContact CG2-CB 4.34Å; I296-L314 HydrophobicContact CG2-CB 4.25Å; I296-L314 HydrophobicContact CG2-CD1 4.13Å; I296-S315 WeakPolarHBondContact CD1-OG 3.25Å; I296-I317 HydrophobicContact CB-CG1 4.43Å; I296-I317 HydrophobicContact CD1-CG1 4.04Å; I296-I317 HydrophobicContact CG2-CD1 4.35Å; I296-I317 HydrophobicContact CG2-CG1 3.91Å; I296-H321 HydrophobicContact CD1-CB 4.12Å; I296-H321 VanDerWaalsContact CD1-ND1 3.26Å; I296-H321 WeakPolarHBondContact CD1-ND1 3.19Å; I296-I322 PolarHBondContact N-O 2.88Å; I296-T323 WeakPolarHBondContact O-CA 3.5Å; I296-Y324 PolarHBondContact O-N 3.43Å; I296-Y324 VanDerWaalsContact O-N 3.12Å
297	K	98.2	Very high	97	Very high	64 Å²	64	69.5 Å²	69.5	28%	0.278	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.7	171.5	-163.1	172.6	-170.7	170.7	0	111.1	A310 L314 Y324 L325 E327	K297-A310 HydrophobicContact CB-CB 4.07Å; K297-A310 HydrophobicContact CD-CB 4.39Å; K297-A310 HydrophobicContact CG-CB 4.02Å; K297-A310 WeakPolarHBondContact O-CB 3.4Å; K297-A310 PolarHBondContact O-N 3.39Å; K297-L314 HydrophobicContact CB-CD1 4.27Å; K297-Y324 CarbonylContact C-O 3.44Å; K297-Y324 WeakPolarHBondContact CA-O 3.41Å; K297-Y324 HydrophobicContact CB-CD1 4.36Å; K297-Y324 HydrophobicContact CB-CD2 4.47Å; K297-Y324 HydrophobicContact CB-CE1 3.76Å; K297-Y324 HydrophobicContact CB-CE2 3.92Å; K297-Y324 HydrophobicContact CD-CE2 3.97Å; K297-Y324 HydrophobicContact CG-CD2 4.2Å; K297-Y324 HydrophobicContact CG-CE1 4.47Å; K297-Y324 HydrophobicContact CG-CE2 3.74Å; K297-Y324 VanDerWaalsContact N-CE1 3.28Å; K297-L325 WeakPolarHBondContact CE-O 3.24Å; K297-E327 WeakPolarHBondContact CD-OE1 3.24Å; K297-E327 WeakPolarHBondContact CE-OE1 3.44Å; K297-E327 IonicContact NZ-OE1 3.74Å; K297-E327 PolarHBondContact NZ-OE1 3.38Å
298	V	98.2	Very high	96.9	Very high	6 Å²	6	71.5 Å²	71.5	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	155.5	-177.7	-54.7	0	0	0	0	112.7	L307 R308 I317 T323 Y324 L325	V298-L307 HydrophobicContact CB-CB 4.14Å; V298-L307 HydrophobicContact CG2-CB 4.02Å; V298-L307 HydrophobicContact CG2-CD1 3.74Å; V298-L307 HydrophobicContact CG2-CD2 4.37Å; V298-L307 HydrophobicContact CG2-CG 4.26Å; V298-R308 CarbonylContact C-O 3.59Å; V298-R308 WeakPolarHBondContact CA-O 3.47Å; V298-R308 WeakPolarHBondContact CB-O 3.35Å; V298-I317 HydrophobicContact CG1-CD1 3.48Å; V298-I317 VanDerWaalsContact CG1-CD1 3.48Å; V298-T323 HydrophobicContact CG1-CG2 3.74Å; V298-Y324 WeakPolarHBondContact CG2-O 3.25Å; V298-Y324 PolarHBondContact N-O 3.2Å; V298-L325 HydrophobicContact CG2-CD2 3.71Å; V298-L325 HydrophobicContact CG2-CG 4.34Å
299	K	97.4	Very high	96.8	Very high	110 Å²	110	75.1 Å²	75.1	48%	0.478	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	166.1	173.2	73.5	-172.8	-177.6	-168.6	0	110.3	L307 R308 A310	K299-L307 CarbonylContact O-C 3.5Å; K299-L307 WeakPolarHBondContact O-CA 3.46Å; K299-R308 PolarHBondContact N-O 2.85Å; K299-R308 WeakPolarHBondContact O-CG 3.06Å; K299-R308 PolarHBondContact O-N 3.49Å; K299-R308 VanDerWaalsContact O-O 3.11Å; K299-A310 HydrophobicContact CD-CB 4.38Å; K299-A310 WeakPolarHBondContact CE-O 3.08Å; K299-A310 PolarHBondContact NZ-O 2.86Å
300	F	97.7	Very high	96.8	Very high	33 Å²	33	72.4 Å²	72.4	15%	0.145	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	152.1	177.8	-83	-63.7	0	0	0	114.4	S232 L235 A236 L239 R306 L307 R308	S232-F300 VanDerWaalsContact O-CE2 3.32Å; S232-F300 WeakPolarHBondContact O-CE2 3.41Å; S232-F300 WeakPolarHBondContact O-CZ 3.13Å; L235-F300 HydrophobicContact CB-CZ 3.96Å; L235-F300 HydrophobicContact CD2-CE1 4.01Å; L235-F300 HydrophobicContact CD2-CZ 4Å; L235-F300 HydrophobicContact CG-CE1 4.11Å; L235-F300 HydrophobicContact CG-CZ 3.91Å; A236-F300 HydrophobicContact CB-CD2 4.41Å; A236-F300 HydrophobicContact CB-CE2 3.57Å; A236-F300 HydrophobicContact CB-CZ 3.67Å; L239-F300 HydrophobicContact CD1-CE1 3.95Å; F300-R306 CarbonylContact C-O 3.48Å; F300-L307 HydrophobicContact CD1-CD2 3.97Å; F300-L307 HydrophobicContact CE1-CD2 4.11Å; F300-L307 HydrophobicContact CG-CD2 4.29Å; F300-R308 PolarHBondContact O-NE 3.09Å
301	N	96	Very high	96.7	Very high	32 Å²	32	69.6 Å²	69.6	17%	0.171	31%	0.312	C	S	.	.			trans	-69.2	166.8	160.3	72.4	-11.4	0	0	0	111.9	R303 G304 T305 R306 R308	N301-R303 PolarHBondContact O-N 3.46Å; N301-R303 VanDerWaalsContact O-N 3.08Å; N301-G304 PolarHBondContact O-N 3.46Å; N301-G304 PolarHBondContact OD1-N 2.99Å; N301-T305 PolarHBondContact ND2-OG1 2.96Å; N301-T305 PolarHBondContact OD1-N 3.08Å; N301-R306 PolarHBondContact N-O 3.41Å; N301-R306 PolarHBondContact OD1-N 3.34Å; N301-R306 PolarHBondContact OD1-O 3.31Å; N301-R308 VanDerWaalsContact C-NH2 3.33Å; N301-R308 VanDerWaalsContact CA-CZ 3.45Å; N301-R308 VanDerWaalsContact CA-NH2 3.33Å
302	R	95.3	Very high	96.5	Very high	229 Å²	229	79.4 Å²	79.4	86%	0.864	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.9	-179.3	-76.4	-173.6	-179.5	168	-1.4	111.8
303	R	96.2	Very high	96.3	Very high	192 Å²	192	87.2 Å²	87.2	73%	0.725	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-8.2	179.4	-61	-175.8	-177.3	176.3	0.7	114	R230 N301 T305	R230-R303 WeakPolarHBondContact CD-O 3.43Å; N301-R303 PolarHBondContact O-N 3.46Å; N301-R303 VanDerWaalsContact O-N 3.08Å; R303-T305 VanDerWaalsContact C-N 3.26Å; R303-T305 HydrophobicContact CB-CG2 4.18Å; R303-T305 PolarHBondContact O-N 3.28Å
304	G	95.8	Very high	96.2	Very high	0 Å²	0	87 Å²	87	0%	0	38%	0.379	C	S	.	.	S	Bend	trans	66.3	21.6	-177.3	0	0	0	0	0	115.2	H231 L235 N301	H231-G304 WeakPolarHBondContact CE1-CA 3.5Å; H231-G304 PolarHBondContact CE1-N 3.34Å; H231-G304 VanDerWaalsContact CE1-N 3.25Å; H231-G304 VanDerWaalsContact NE2-CA 3.33Å; H231-G304 WeakPolarHBondContact NE2-CA 3.44Å; H231-G304 PolarHBondContact NE2-N 3.26Å; L235-G304 WeakPolarHBondContact CD2-O 3.19Å; N301-G304 PolarHBondContact O-N 3.46Å; N301-G304 PolarHBondContact OD1-N 2.99Å
305	T	95.3	Very high	96	Very high	53 Å²	53	83.5 Å²	83.5	33%	0.325	37%	0.37	S	S	.	.	S	Bend	trans	-106.6	-21.8	-174.1	56.5	0	0	0	0	114.4	R230 N301 R303	R230-T305 HydrophobicContact CG-CG2 4.5Å; N301-T305 PolarHBondContact ND2-OG1 2.96Å; N301-T305 PolarHBondContact OD1-N 3.08Å; R303-T305 VanDerWaalsContact C-N 3.26Å; R303-T305 HydrophobicContact CB-CG2 4.18Å; R303-T305 PolarHBondContact O-N 3.28Å
306	R	95.9	Very high	95.9	Very high	184 Å²	184	92.8 Å²	92.8	69%	0.694	40%	0.403	S	S	*	.	S	Bend	trans	-144.6	150.9	-177.5	-61.3	-175.1	-175.7	179.3	1.3	110.2	F300 N301	F300-R306 CarbonylContact C-O 3.48Å; N301-R306 PolarHBondContact N-O 3.41Å; N301-R306 PolarHBondContact OD1-N 3.34Å; N301-R306 PolarHBondContact OD1-O 3.31Å
307	L	97.1	Very high	95.8	Very high	40 Å²	40	95.1 Å²	95.1	21%	0.209	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	145.3	171.1	-60.2	176.6	0	0	0	110.5	A236 L239 M240 V298 K299 F300 L325	A236-L307 HydrophobicContact CB-CD2 4.27Å; A236-L307 WeakPolarHBondContact O-CD1 3.46Å; L239-L307 HydrophobicContact CB-CD1 3.64Å; L239-L307 HydrophobicContact CB-CG 3.94Å; L239-L307 HydrophobicContact CD1-CG 4.18Å; M240-L307 HydrophobicContact CB-CD1 4.11Å; V298-L307 HydrophobicContact CB-CB 4.14Å; V298-L307 HydrophobicContact CG2-CB 4.02Å; V298-L307 HydrophobicContact CG2-CD1 3.74Å; V298-L307 HydrophobicContact CG2-CD2 4.37Å; V298-L307 HydrophobicContact CG2-CG 4.26Å; K299-L307 CarbonylContact O-C 3.5Å; K299-L307 WeakPolarHBondContact O-CA 3.46Å; F300-L307 HydrophobicContact CD1-CD2 3.97Å; F300-L307 HydrophobicContact CE1-CD2 4.11Å; F300-L307 HydrophobicContact CG-CD2 4.29Å; L307-L325 HydrophobicContact CD1-CD2 4.34Å; L307-L325 HydrophobicContact CD2-CD2 4.11Å
308	R	96.4	Very high	95.7	Very high	109 Å²	109	94.6 Å²	94.6	41%	0.411	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	164.9	174	58.5	173.7	163	-163.8	-4.4	109.4	V298 K299 F300 N301 A310	V298-R308 CarbonylContact C-O 3.59Å; V298-R308 WeakPolarHBondContact CA-O 3.47Å; V298-R308 WeakPolarHBondContact CB-O 3.35Å; K299-R308 PolarHBondContact N-O 2.85Å; K299-R308 WeakPolarHBondContact O-CG 3.06Å; K299-R308 PolarHBondContact O-N 3.49Å; K299-R308 VanDerWaalsContact O-O 3.11Å; F300-R308 PolarHBondContact O-NE 3.09Å; N301-R308 VanDerWaalsContact C-NH2 3.33Å; N301-R308 VanDerWaalsContact CA-CZ 3.45Å; N301-R308 VanDerWaalsContact CA-NH2 3.33Å; R308-A310 PolarHBondContact O-N 2.9Å
309	R	96.9	Very high	95.6	Very high	77 Å²	77	96.8 Å²	96.8	29%	0.291	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	137.7	175.1	61.5	-178.1	-178.6	179.3	3.6	111.8	I296 S311 R312 L314 I317	I296-R309 HydrophobicContact CG2-CB 4.34Å; R309-S311 VanDerWaalsContact C-N 3.34Å; R309-S311 VanDerWaalsContact CD-O 3.24Å; R309-S311 WeakPolarHBondContact CD-O 3.4Å; R309-S311 VanDerWaalsContact CG-O 3.28Å; R309-S311 WeakPolarHBondContact CG-O 3.43Å; R309-R312 PolarHBondContact NH1-O 3.35Å; R309-L314 HydrophobicContact CB-CB 4.23Å; R309-L314 WeakPolarHBondContact CD-O 3.27Å; R309-L314 PolarHBondContact NH1-O 2.87Å; R309-I317 HydrophobicContact CB-CD1 4.25Å; R309-I317 HydrophobicContact CB-CG1 4.49Å; R309-I317 VanDerWaalsContact N-CD1 3.34Å
310	A	96.5	Very high	95.5	Very high	25 Å²	25	93.1 Å²	93.1	21%	0.207	42%	0.418	C	S	.	.	S	Bend	trans	-67.1	-35.2	-177.4	0	0	0	0	0	112.8	K297 K299 R308 L314	K297-A310 HydrophobicContact CB-CB 4.07Å; K297-A310 HydrophobicContact CD-CB 4.39Å; K297-A310 HydrophobicContact CG-CB 4.02Å; K297-A310 WeakPolarHBondContact O-CB 3.4Å; K297-A310 PolarHBondContact O-N 3.39Å; K299-A310 HydrophobicContact CD-CB 4.38Å; K299-A310 WeakPolarHBondContact CE-O 3.08Å; K299-A310 PolarHBondContact NZ-O 2.86Å; R308-A310 PolarHBondContact O-N 2.9Å; A310-L314 HydrophobicContact CB-CD1 4.28Å
311	S	95.3	Very high	95.5	Very high	49 Å²	49	93.6 Å²	93.6	34%	0.343	42%	0.42	S	S	.	.	S	Bend	trans	-128.2	155.7	176.9	175.8	0	0	0	0	111.2	R309 Q313 L314	R309-S311 VanDerWaalsContact C-N 3.34Å; R309-S311 VanDerWaalsContact CD-O 3.24Å; R309-S311 WeakPolarHBondContact CD-O 3.4Å; R309-S311 VanDerWaalsContact CG-O 3.28Å; R309-S311 WeakPolarHBondContact CG-O 3.43Å; S311-Q313 VanDerWaalsContact C-N 3.28Å; S311-Q313 PolarHBondContact OG-N 2.89Å; S311-L314 PolarHBondContact O-N 3.12Å
312	R	93.6	Very high	95.6	Very high	223 Å²	223	92.1 Å²	92.1	84%	0.842	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-22.1	174.7	-73.7	-176.5	172.1	175.8	-2.7	113.2	R309 L314	R309-R312 PolarHBondContact NH1-O 3.35Å; R312-L314 VanDerWaalsContact C-N 3.26Å
313	Q	93.8	Very high	95.8	Very high	187 Å²	187	81.3 Å²	81.3	87%	0.874	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.1	176	-69.5	166	-23.1	0	0	112.4	S311	S311-Q313 VanDerWaalsContact C-N 3.28Å; S311-Q313 PolarHBondContact OG-N 2.89Å
314	L	93.1	Very high	95.9	Very high	59 Å²	59	72.8 Å²	72.8	31%	0.309	34%	0.34	S	S	.	.	S	Bend	trans	-72.3	146.8	174.8	-60.9	173.3	0	0	0	110.6	I296 K297 R309 A310 S311 R312	I296-L314 HydrophobicContact CG2-CB 4.25Å; I296-L314 HydrophobicContact CG2-CD1 4.13Å; K297-L314 HydrophobicContact CB-CD1 4.27Å; R309-L314 HydrophobicContact CB-CB 4.23Å; R309-L314 WeakPolarHBondContact CD-O 3.27Å; R309-L314 PolarHBondContact NH1-O 2.87Å; A310-L314 HydrophobicContact CB-CD1 4.28Å; S311-L314 PolarHBondContact O-N 3.12Å; R312-L314 VanDerWaalsContact C-N 3.26Å
315	S	92.7	Very high	96	Very high	68 Å²	68	73.8 Å²	73.8	48%	0.476	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-56.3	158.6	175.5	59.4	0	0	0	0	111.8	I296	I296-S315 WeakPolarHBondContact CD1-OG 3.25Å
316	R	94.5	Very high	96	Very high	204 Å²	204	75.1 Å²	75.1	77%	0.77	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-69.5	135.1	174.2	-71.9	-176.4	177	175.3	0.7	108.6	T318 H321	R316-T318 PolarHBondContact O-N 2.99Å; R316-H321 PolarHBondContact O-CE1 3Å; R316-H321 PolarHBondContact O-ND1 3.44Å
317	I	95.4	Very high	95.9	Very high	54 Å²	54	71.5 Å²	71.5	28%	0.277	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-74.1	120.9	-179.5	-57.7	163.1	0	0	0	109	I296 V298 R309 T323	I296-I317 HydrophobicContact CB-CG1 4.43Å; I296-I317 HydrophobicContact CD1-CG1 4.04Å; I296-I317 HydrophobicContact CG2-CD1 4.35Å; I296-I317 HydrophobicContact CG2-CG1 3.91Å; V298-I317 HydrophobicContact CG1-CD1 3.48Å; V298-I317 VanDerWaalsContact CG1-CD1 3.48Å; R309-I317 HydrophobicContact CB-CD1 4.25Å; R309-I317 HydrophobicContact CB-CG1 4.49Å; R309-I317 VanDerWaalsContact N-CD1 3.34Å; I317-T323 HydrophobicContact CG2-CG2 3.94Å
318	T	96.4	Very high	95.7	Very high	53 Å²	53	71.6 Å²	71.6	33%	0.325	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-102.3	163.7	168.7	55.5	0	0	0	0	109.6	H243 R316 D320 H321	H243-T318 PolarHBondContact CE1-O 2.97Å; H243-T318 VanDerWaalsContact CE1-O 3.32Å; H243-T318 PolarHBondContact NE2-O 2.54Å; R316-T318 PolarHBondContact O-N 2.99Å; T318-D320 WeakPolarHBondContact CB-OD1 3.49Å; T318-D320 PolarHBondContact O-N 3.48Å; T318-D320 VanDerWaalsContact O-N 3.09Å; T318-D320 PolarHBondContact OG1-OD1 3.43Å; T318-H321 PolarHBondContact N-ND1 3.48Å; T318-H321 PolarHBondContact O-N 3.34Å; T318-H321 PolarHBondContact OG1-CE1 3.06Å; T318-H321 PolarHBondContact OG1-ND1 3.32Å; T318-H321 PolarHBondContact OG1-NE2 3.18Å
319	P	96.6	Very high	95.4	Very high	52 Å²	52	68.6 Å²	68.6	34%	0.338	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.2	-178	-25.8	36.8	0	0	0	116.4	A247 L250	A247-P319 WeakPolarHBondContact CA-O 3.24Å; L250-P319 HydrophobicContact CD1-CB 3.55Å
320	D	95.4	Very high	95.1	Very high	33 Å²	33	70 Å²	70	18%	0.176	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-6.2	-178.5	58.8	-49.2	0	0	0	114.3	K254 Y287 T318	K254-D320 IonicContact NZ-OD1 2.79Å; K254-D320 IonicContact NZ-OD2 3.28Å; K254-D320 PolarHBondContact NZ-OD2 3.44Å; Y287-D320 PolarHBondContact OH-OD2 3.32Å; T318-D320 WeakPolarHBondContact CB-OD1 3.49Å; T318-D320 PolarHBondContact O-N 3.48Å; T318-D320 VanDerWaalsContact O-N 3.09Å; T318-D320 PolarHBondContact OG1-OD1 3.43Å
321	H	97.9	Very high	94.8	Very high	42 Å²	42	69.7 Å²	69.7	19%	0.194	35%	0.348	C	S	.	.	S	Bend	trans	-74.4	149.2	171.7	-67.3	152.6	0	0	0	111.1	H243 A247 I296 R316 T318	H243-H321 PolarHBondContact CD2-O 2.92Å; H243-H321 VanDerWaalsContact CD2-O 3.32Å; H243-H321 PolarHBondContact NE2-O 2.83Å; A247-H321 WeakPolarHBondContact CB-O 3.23Å; I296-H321 HydrophobicContact CD1-CB 4.12Å; I296-H321 VanDerWaalsContact CD1-ND1 3.26Å; I296-H321 WeakPolarHBondContact CD1-ND1 3.19Å; R316-H321 PolarHBondContact O-CE1 3Å; R316-H321 PolarHBondContact O-ND1 3.44Å; T318-H321 PolarHBondContact N-ND1 3.48Å; T318-H321 PolarHBondContact O-N 3.34Å; T318-H321 PolarHBondContact OG1-CE1 3.06Å; T318-H321 PolarHBondContact OG1-ND1 3.32Å; T318-H321 PolarHBondContact OG1-NE2 3.18Å
322	I	98.3	Very high	94.7	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.005	34%	0.337	C	S	.	.			trans	-84.1	138.1	164.1	-63.5	177.1	0	0	0	107.8	F159 A162 L288 A295 I296	F159-I322 HydrophobicContact CB-CD1 4.34Å; F159-I322 HydrophobicContact CD2-CD1 4.02Å; A162-I322 HydrophobicContact CB-CD1 4.28Å; A162-I322 HydrophobicContact CB-CG1 4.43Å; L288-I322 WeakPolarHBondContact O-CD1 3.29Å; A295-I322 WeakPolarHBondContact CA-O 3Å; A295-I322 HydrophobicContact CB-CB 4.22Å; A295-I322 HydrophobicContact CB-CG2 4.16Å; I296-I322 PolarHBondContact N-O 2.88Å
323	T	98.4	Very high	94.5	Very high	3 Å²	3	61 Å²	61	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	148.5	-179.8	57.7	0	0	0	0	111.1	M240 H243 N244 I296 V298 I317	M240-T323 WeakPolarHBondContact CG-O 3.19Å; H243-T323 PolarHBondContact CD2-OG1 2.82Å; N244-T323 PolarHBondContact ND2-O 2.97Å; N244-T323 PolarHBondContact OD1-N 3.4Å; N244-T323 PolarHBondContact OD1-O 3.46Å; N244-T323 PolarHBondContact OD1-OG1 2.74Å; I296-T323 WeakPolarHBondContact O-CA 3.5Å; V298-T323 HydrophobicContact CG1-CG2 3.74Å; I317-T323 HydrophobicContact CG2-CG2 3.94Å
324	Y	98.4	Very high	94.1	Very high	12 Å²	12	58.3 Å²	58.3	5%	0.047	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	155.5	179.6	77.6	-87.7	0	0	0	111.3	G153 R155 A295 I296 K297 V298 D326 E327	G153-Y324 CarbonylContact O-C 3.52Å; R155-Y324 HydrophobicContact CG-CD1 3.51Å; R155-Y324 HydrophobicContact CG-CD2 4.03Å; R155-Y324 HydrophobicContact CG-CE1 3.83Å; R155-Y324 HydrophobicContact CG-CE2 4.3Å; R155-Y324 HydrophobicContact CG-CG 3.59Å; R155-Y324 VanDerWaalsContact NE-CE1 3.27Å; R155-Y324 PolarHBondContact NH2-OH 2.93Å; A295-Y324 HydrophobicContact CB-CD1 4.02Å; A295-Y324 HydrophobicContact CB-CE1 4.47Å; A295-Y324 WeakPolarHBondContact O-CE1 3.31Å; I296-Y324 PolarHBondContact O-N 3.43Å; I296-Y324 VanDerWaalsContact O-N 3.12Å; K297-Y324 CarbonylContact C-O 3.44Å; K297-Y324 WeakPolarHBondContact CA-O 3.41Å; K297-Y324 HydrophobicContact CB-CD1 4.36Å; K297-Y324 HydrophobicContact CB-CD2 4.47Å; K297-Y324 HydrophobicContact CB-CE1 3.76Å; K297-Y324 HydrophobicContact CB-CE2 3.92Å; K297-Y324 HydrophobicContact CD-CE2 3.97Å; K297-Y324 HydrophobicContact CG-CD2 4.2Å; K297-Y324 HydrophobicContact CG-CE1 4.47Å; K297-Y324 HydrophobicContact CG-CE2 3.74Å; K297-Y324 VanDerWaalsContact N-CE1 3.28Å; V298-Y324 WeakPolarHBondContact CG2-O 3.25Å; V298-Y324 PolarHBondContact N-O 3.2Å; Y324-D326 WeakPolarHBondContact CD2-O 3.35Å; Y324-E327 PolarHBondContact OH-OE2 3.08Å
325	L	98	Very high	93.5	Very high	22 Å²	22	58 Å²	58	12%	0.115	30%	0.297	C	S	.	.	S	Bend	trans	-103.3	-47.6	-179.3	-64.8	162.3	0	0	0	111.5	G153 A236 R237 M240 K297 V298 L307	G153-L325 PolarHBondContact O-N 3.37Å; A236-L325 HydrophobicContact CB-CD1 3.73Å; A236-L325 HydrophobicContact CB-CD2 3.91Å; R237-L325 HydrophobicContact CG-CD1 4.01Å; M240-L325 HydrophobicContact CB-CD1 4.11Å; M240-L325 HydrophobicContact CB-CG 4.39Å; M240-L325 HydrophobicContact CG-CG 4.47Å; M240-L325 HydrophobicContact SD-CB 4.41Å; M240-L325 HydrophobicContact SD-CD1 3.86Å; M240-L325 HydrophobicContact SD-CG 3.84Å; K297-L325 WeakPolarHBondContact CE-O 3.24Å; V298-L325 HydrophobicContact CG2-CD2 3.71Å; V298-L325 HydrophobicContact CG2-CG 4.34Å; L307-L325 HydrophobicContact CD1-CD2 4.34Å; L307-L325 HydrophobicContact CD2-CD2 4.11Å
326	D	95.5	Very high	93	Very high	80 Å²	80	58.4 Å²	58.4	43%	0.428	30%	0.3	S	S	.	.	S	Bend	trans	-110	145.8	-168.3	-52.4	-44.4	0	0	0	110.4	G153 Y324	G153-D326 WeakPolarHBondContact CA-OD2 3.13Å; G153-D326 PolarHBondContact N-OD2 3.03Å; G153-D326 PolarHBondContact O-N 3.34Å; Y324-D326 WeakPolarHBondContact CD2-O 3.35Å
327	E	94.8	Very high	92	Very high	109 Å²	109	55.6 Å²	55.6	51%	0.509	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-65.9	145.7	171.9	-59.6	-56.2	157.7	0	0	110.2	K297 Y324	K297-E327 WeakPolarHBondContact CD-OE1 3.24Å; K297-E327 WeakPolarHBondContact CE-OE1 3.44Å; K297-E327 IonicContact NZ-OE1 3.74Å; K297-E327 PolarHBondContact NZ-OE1 3.38Å; Y324-E327 PolarHBondContact OH-OE2 3.08Å
328	S	92.3	Very high	91	Very high	42 Å²	42	55.2 Å²	55.2	29%	0.294	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-64.2	141.1	178.6	-57.4	0	0	0	0	110.8	E156	E156-S328 VanDerWaalsContact CD-OG 3.29Å; E156-S328 PolarHBondContact OE1-OG 2.81Å; E156-S328 WeakPolarHBondContact OE2-CB 3.18Å; E156-S328 PolarHBondContact OE2-OG 3.38Å
329	S	90	Very high	90	Very high	46 Å²	46	55.7 Å²	55.7	32%	0.322	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-63.8	162.9	174.9	-59	0	0	0	0	111.7	Y331	S329-Y331 WeakPolarHBondContact O-CD2 3.2Å; S329-Y331 WeakPolarHBondContact O-CE2 3.17Å; S329-Y331 PolarHBondContact O-N 3.24Å
330	N	90	Very high	89	Confident	107 Å²	107	53.9 Å²	53.9	57%	0.572	29%	0.287	S	S	*	.			trans	-75	115.1	168.8	-175.9	1.2	0	0	0	110	C332	N330-C332 WeakPolarHBondContact OD1-CB 3.29Å; N330-C332 PolarHBondContact OD1-N 2.95Å; N330-C332 PolarHBondContact OD1-SG 2.8Å; N330-C332 VanDerWaalsContact OD1-SG 3.39Å
331	Y	91.4	Very high	88.3	Confident	17 Å²	17	53.2 Å²	53.2	7%	0.067	29%	0.285	C	S	.	.			trans	-94.6	5	179.4	-64.7	-77.4	0	0	0	113.6	H134 W135 E156 S329 T340 T343	H134-Y331 HydrophobicContact CB-CG 4.47Å; W135-Y331 HydrophobicContact CB-CD1 3.94Å; W135-Y331 HydrophobicContact CB-CD2 3.94Å; W135-Y331 HydrophobicContact CB-CE1 3.85Å; W135-Y331 HydrophobicContact CB-CE2 3.84Å; W135-Y331 HydrophobicContact CB-CG 4Å; W135-Y331 AromaticContact CD1-CE1 3.73Å; W135-Y331 HydrophobicContact CG-CD1 4.46Å; W135-Y331 HydrophobicContact CG-CE1 4.02Å; E156-Y331 HydrophobicContact CG-CE2 4.34Å; S329-Y331 WeakPolarHBondContact O-CD2 3.2Å; S329-Y331 WeakPolarHBondContact O-CE2 3.17Å; S329-Y331 PolarHBondContact O-N 3.24Å; Y331-T340 HydrophobicContact CD1-CG2 3.88Å; Y331-T340 HydrophobicContact CE1-CG2 3.65Å; Y331-T343 WeakPolarHBondContact O-CG2 3.47Å; Y331-T343 PolarHBondContact O-N 3.17Å
332	C	92	Very high	87.8	Confident	19 Å²	19	52.4 Å²	52.4	13%	0.128	28%	0.284	C	S	.	.	S	Bend	trans	-67.5	-46.5	178.9	-73.6	0	0	0	0	112.5	N330 S342 T343 C363 R365	N330-C332 WeakPolarHBondContact OD1-CB 3.29Å; N330-C332 PolarHBondContact OD1-N 2.95Å; N330-C332 PolarHBondContact OD1-SG 2.8Å; N330-C332 VanDerWaalsContact OD1-SG 3.39Å; C332-S342 PolarHBondContact O-OG 2.86Å; C332-T343 PolarHBondContact O-N 3.36Å; C332-T343 PolarHBondContact O-OG1 3.46Å; C332-C363 VanDerWaalsContact CA-SG 3.5Å; C332-C363 HydrophobicContact CB-CB 3.74Å; C332-C363 WeakPolarHBondContact CB-SG 3.27Å; C332-C363 WeakPolarHBondContact SG-CB 3.3Å; C332-C363 CovalentContact SG-SG 2.02Å; C332-C363 PolarHBondContact SG-SG 3.47Å; C332-R365 PolarHBondContact O-NH1 3.46Å
333	D	89.2	Confident	87.6	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.374	28%	0.284	S	S	.	.	S	Bend	trans	-110.5	150.5	-178.4	-66.6	-59.1	0	0	0	110.1	D335 R344 R365	D333-D335 PolarHBondContact O-N 3.08Å; D333-R344 IonicContact OD1-CZ 3.43Å; D333-R344 IonicContact OD1-NH1 2.8Å; D333-R344 PolarHBondContact OD1-NH1 3.46Å; D333-R344 IonicContact OD1-NH2 3.13Å; D333-R344 PolarHBondContact OD1-NH2 3.4Å; D333-R344 VanDerWaalsContact OD1-NH2 3.13Å; D333-R365 IonicContact OD1-NH1 3.13Å; D333-R365 PolarHBondContact OD1-NH1 2.03Å; D333-R365 VanDerWaalsContact OD1-NH1 3.13Å
334	Y	85.2	Confident	87.3	Confident	131 Å²	131	58.1 Å²	58.1	51%	0.514	31%	0.305	S	S	.	.			trans	-67.9	129.7	174.1	177.7	-97.8	0	0	0	108.5	T340	Y334-T340 WeakPolarHBondContact CA-O 3.49Å; Y334-T340 WeakPolarHBondContact CD2-O 3.4Å
335	D	82.1	Confident	87.1	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.283	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-118.7	114.7	172.4	172.6	14.2	0	0	0	108.4	D333 N337 T338 Q339 T340	D333-D335 PolarHBondContact O-N 3.08Å; D335-N337 PolarHBondContact O-N 3.07Å; D335-N337 WeakPolarHBondContact OD1-CB 3.33Å; D335-N337 PolarHBondContact OD1-N 3.11Å; D335-T338 WeakPolarHBondContact CB-OG1 3.28Å; D335-T338 VanDerWaalsContact CG-OG1 3.23Å; D335-T338 PolarHBondContact O-N 3.36Å; D335-T338 WeakPolarHBondContact OD2-CB 3.46Å; D335-T338 VanDerWaalsContact OD2-CG2 3.27Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.43Å; D335-T338 PolarHBondContact OD2-N 2.91Å; D335-T338 PolarHBondContact OD2-OG1 3.42Å; D335-Q339 VanDerWaalsContact O-CA 3.27Å; D335-Q339 WeakPolarHBondContact O-CA 3.44Å; D335-Q339 PolarHBondContact O-N 3.03Å; D335-T340 PolarHBondContact O-N 3.29Å
336	S	81.1	Confident	86.9	Confident	77 Å²	77	60.4 Å²	60.4	54%	0.538	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-27	-179.9	58.1	0	0	0	0	112.9
337	N	74.7	Confident	86.8	Confident	145 Å²	145	58.9 Å²	58.9	78%	0.775	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-43.8	-177.2	-62.5	-43.3	0	0	0	111.2	D335	D335-N337 PolarHBondContact O-N 3.07Å; D335-N337 WeakPolarHBondContact OD1-CB 3.33Å; D335-N337 PolarHBondContact OD1-N 3.11Å
338	T	73.8	Confident	86.7	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.282	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-7.4	177.6	57.5	0	0	0	0	113	P148 D335 T340	P148-T338 VanDerWaalsContact CB-O 3.29Å; P148-T338 WeakPolarHBondContact CB-O 3.4Å; P148-T338 WeakPolarHBondContact CG-O 2.89Å; D335-T338 WeakPolarHBondContact CB-OG1 3.28Å; D335-T338 VanDerWaalsContact CG-OG1 3.23Å; D335-T338 PolarHBondContact O-N 3.36Å; D335-T338 WeakPolarHBondContact OD2-CB 3.46Å; D335-T338 VanDerWaalsContact OD2-CG2 3.27Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.43Å; D335-T338 PolarHBondContact OD2-N 2.91Å; D335-T338 PolarHBondContact OD2-OG1 3.42Å; T338-T340 PolarHBondContact O-N 3.12Å; T338-T340 WeakPolarHBondContact OG1-CG2 3.12Å; T338-T340 PolarHBondContact OG1-OG1 3.37Å
339	Q	75.1	Confident	86.8	Confident	62 Å²	62	54.7 Å²	54.7	29%	0.29	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	36.9	-175.5	-76	175.5	28.4	0	0	111.8	P148 D335	P148-Q339 HydrophobicContact CB-CB 4.33Å; P148-Q339 HydrophobicContact CG-CB 3.33Å; P148-Q339 HydrophobicContact CG-CG 4.41Å; D335-Q339 VanDerWaalsContact O-CA 3.27Å; D335-Q339 WeakPolarHBondContact O-CA 3.44Å; D335-Q339 PolarHBondContact O-N 3.03Å
340	T	75.6	Confident	86.6	Confident	14 Å²	14	55.6 Å²	55.6	9%	0.086	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-82.6	130.6	175.8	52.6	0	0	0	0	109.8	Y331 Y334 D335 T338	Y331-T340 HydrophobicContact CD1-CG2 3.88Å; Y331-T340 HydrophobicContact CE1-CG2 3.65Å; Y334-T340 WeakPolarHBondContact CA-O 3.49Å; Y334-T340 WeakPolarHBondContact CD2-O 3.4Å; D335-T340 PolarHBondContact O-N 3.29Å; T338-T340 PolarHBondContact O-N 3.12Å; T338-T340 WeakPolarHBondContact OG1-CG2 3.12Å; T338-T340 PolarHBondContact OG1-OG1 3.37Å
341	S	80.8	Confident	86.3	Confident	19 Å²	19	58.3 Å²	58.3	13%	0.133	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-65.4	145.7	173.9	53.4	0	0	0	0	111
342	S	88.2	Confident	85.7	Confident	26 Å²	26	60 Å²	60	18%	0.182	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-80.5	157.5	174.7	-175.7	0	0	0	0	111.4	C332 R344	C332-S342 PolarHBondContact O-OG 2.86Å; S342-R344 VanDerWaalsContact C-N 3.31Å; S342-R344 WeakPolarHBondContact OG-CG 3.33Å; S342-R344 PolarHBondContact OG-N 3.14Å
343	T	92.9	Very high	85	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.359	C	S	.	.	S	Bend	trans	-80.1	-4.9	169.4	54.7	0	0	0	0	115.3	H134 Y331 C332 R346 L361 R365 C402	H134-T343 HydrophobicContact CB-CG2 4.08Å; Y331-T343 WeakPolarHBondContact O-CG2 3.47Å; Y331-T343 PolarHBondContact O-N 3.17Å; C332-T343 PolarHBondContact O-N 3.36Å; C332-T343 PolarHBondContact O-OG1 3.46Å; T343-R346 WeakPolarHBondContact O-CB 3.17Å; T343-R346 WeakPolarHBondContact O-CG 3.42Å; T343-R346 PolarHBondContact O-N 3.42Å; T343-L361 VanDerWaalsContact CB-O 3.26Å; T343-L361 WeakPolarHBondContact CB-O 3.17Å; T343-L361 HydrophobicContact CG2-CD1 4.45Å; T343-L361 WeakPolarHBondContact CG2-O 3.44Å; T343-L361 PolarHBondContact OG1-O 3.26Å; T343-R365 PolarHBondContact OG1-NH2 2.93Å; T343-C402 VanDerWaalsContact O-CB 3.3Å; T343-C402 WeakPolarHBondContact O-CB 3.08Å
344	R	93.1	Very high	84.6	Confident	123 Å²	123	67.2 Å²	67.2	46%	0.464	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	141.8	175.1	-65.2	-168.6	173.5	77.4	3.4	110.8	D333 S342 R346 N403	D333-R344 IonicContact OD1-CZ 3.43Å; D333-R344 IonicContact OD1-NH1 2.8Å; D333-R344 PolarHBondContact OD1-NH1 3.46Å; D333-R344 IonicContact OD1-NH2 3.13Å; D333-R344 PolarHBondContact OD1-NH2 3.4Å; D333-R344 VanDerWaalsContact OD1-NH2 3.13Å; S342-R344 VanDerWaalsContact C-N 3.31Å; S342-R344 WeakPolarHBondContact OG-CG 3.33Å; S342-R344 PolarHBondContact OG-N 3.14Å; R344-R346 PolarHBondContact O-N 3.47Å; R344-N403 WeakPolarHBondContact CG-O 3.42Å
345	G	93	Very high	84.5	Confident	56 Å²	56	64.9 Å²	64.9	58%	0.577	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	6.3	178.5	0	0	0	0	0	115.2	V401 C402	G345-V401 VanDerWaalsContact C-CG1 3.42Å; G345-V401 WeakPolarHBondContact O-CG1 3.29Å; G345-C402 PolarHBondContact N-O 3.4Å
346	R	93.3	Very high	84.5	Confident	27 Å²	27	62.9 Å²	62.9	10%	0.102	35%	0.354	C	S	.	.			trans	-89.1	142.5	179.6	-66.7	-174.8	61.2	-163.5	-9.2	112.8	R131 R133 H134 T343 R344 V401 C402	R131-R346 PolarHBondContact O-NH2 2.96Å; R133-R346 PolarHBondContact O-NH1 3.18Å; R133-R346 PolarHBondContact O-NH2 2.89Å; H134-R346 PolarHBondContact O-NH1 2.66Å; T343-R346 WeakPolarHBondContact O-CB 3.17Å; T343-R346 WeakPolarHBondContact O-CG 3.42Å; T343-R346 PolarHBondContact O-N 3.42Å; R344-R346 PolarHBondContact O-N 3.47Å; R346-V401 CarbonylContact O-C 3.6Å; R346-V401 WeakPolarHBondContact O-CA 3.15Å; R346-C402 PolarHBondContact O-N 3.33Å; R346-C402 PolarHBondContact O-SG 2.97Å
347	E	93.8	Very high	85	Confident	48 Å²	48	59.9 Å²	59.9	22%	0.224	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.2	171.7	-171.2	-178.2	-156.5	0	0	110.8	R131 L361 R372 H400	R131-E347 IonicContact CZ-OE2 2.77Å; R131-E347 IonicContact NH2-OE2 2.92Å; R131-E347 PolarHBondContact NH2-OE2 2.78Å; E347-L361 WeakPolarHBondContact O-CD2 3.15Å; E347-R372 IonicContact OE1-CZ 3.81Å; E347-R372 IonicContact OE1-NH1 2.76Å; E347-R372 PolarHBondContact OE1-NH1 2.96Å; E347-R372 IonicContact OE1-NH2 3.37Å; E347-H400 CarbonylContact C-O 3.58Å; E347-H400 VanDerWaalsContact CA-O 3.24Å; E347-H400 WeakPolarHBondContact CA-O 3.47Å
348	C	94.3	Very high	85.9	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.02	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	165.6	178.5	67.8	0	0	0	0	111.8	C358 L361 C362 H400	C348-C358 VanDerWaalsContact C-SG 3.52Å; C348-C358 HydrophobicContact CB-CB 3.88Å; C348-C358 WeakPolarHBondContact CB-SG 3.15Å; C348-C358 VanDerWaalsContact SG-CA 3.54Å; C348-C358 WeakPolarHBondContact SG-CB 3.48Å; C348-C358 CovalentContact SG-SG 2.04Å; C348-C358 PolarHBondContact SG-SG 3.45Å; C348-L361 HydrophobicContact CB-CB 4.44Å; C348-L361 HydrophobicContact CB-CD2 3.94Å; C348-C362 VanDerWaalsContact SG-SG 3.61Å; C348-H400 PolarHBondContact N-O 3.13Å
349	L	92.6	Very high	86.8	Confident	60 Å²	60	54 Å²	54	31%	0.314	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-110.5	115	-179.9	-58	178.1	0	0	0	109.8	F132 N352 A356 S357 C358	F132-L349 HydrophobicContact CD1-CG 4.34Å; F132-L349 HydrophobicContact CD2-CD1 4.32Å; F132-L349 HydrophobicContact CE1-CD2 4.28Å; F132-L349 HydrophobicContact CE1-CG 4.18Å; F132-L349 HydrophobicContact CE2-CD1 4.25Å; F132-L349 HydrophobicContact CG-CD1 4.49Å; F132-L349 HydrophobicContact CZ-CD1 4.37Å; F132-L349 HydrophobicContact CZ-CD2 4.27Å; F132-L349 HydrophobicContact CZ-CG 4.37Å; L349-N352 HydrophobicContact CB-CB 3.86Å; L349-A356 HydrophobicContact CD1-CB 4.1Å; L349-A356 PolarHBondContact N-O 3.12Å; L349-A356 VanDerWaalsContact N-O 3.08Å; L349-S357 VanDerWaalsContact O-CA 3.3Å; L349-S357 WeakPolarHBondContact O-CA 3.36Å; L349-C358 VanDerWaalsContact C-SG 3.56Å; L349-C358 PolarHBondContact O-N 2.88Å; L349-C358 VanDerWaalsContact O-N 3.15Å
350	P	87	Confident	87.6	Confident	64 Å²	64	53.9 Å²	53.9	42%	0.416	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-39.5	-172.6	29.1	-39.1	0	0	0	112.9	N352 H400	P350-N352 PolarHBondContact O-N 3.18Å; P350-H400 WeakPolarHBondContact CD-CD2 3.33Å; P350-H400 VanDerWaalsContact CG-CD2 3.47Å; P350-H400 WeakPolarHBondContact CG-CD2 3.26Å; P350-H400 WeakPolarHBondContact CG-NE2 3.4Å
351	N	82.3	Confident	88.5	Confident	164 Å²	164	53.2 Å²	53.2	88%	0.877	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	23.8	-173.2	-63.3	-19.6	0	0	0	113.3
352	N	80.4	Confident	89.2	Confident	53 Å²	53	52.3 Å²	52.3	28%	0.283	30%	0.301	S	S	.	.			trans	-99.9	141.8	-179.9	-158.9	-39.1	0	0	0	110.3	L349 P350 D354 A356 S357	L349-N352 HydrophobicContact CB-CB 3.86Å; P350-N352 PolarHBondContact O-N 3.18Å; N352-D354 PolarHBondContact OD1-N 3.44Å; N352-A356 HydrophobicContact CB-CB 4.41Å; N352-S357 WeakPolarHBondContact O-CB 3.24Å
353	T	76.9	Confident	89.5	Confident	132 Å²	132	52.6 Å²	52.6	81%	0.81	30%	0.303	S	S	*	.	S	Bend	trans	-89.2	-13.1	178.2	51.7	0	0	0	0	113.5
354	D	81.6	Confident	89.5	Confident	109 Å²	109	59.1 Å²	59.1	58%	0.583	34%	0.338	S	S	*	.	S	Bend	trans	-96.1	-167.9	-172.1	-64.2	-15.8	0	0	0	111.9	N352 A356 S357	N352-D354 PolarHBondContact OD1-N 3.44Å; D354-A356 PolarHBondContact O-N 3.39Å; D354-S357 WeakPolarHBondContact O-CB 3.36Å; D354-S357 PolarHBondContact O-N 3.26Å; D354-S357 PolarHBondContact O-OG 3.11Å
355	Q	81.7	Confident	89.5	Confident	82 Å²	82	56.2 Å²	56.2	38%	0.383	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-13.2	175.8	-59.6	-170.1	8.4	0	0	114.3	F132 R133 S357	F132-Q355 CarbonylContact O-C 3.59Å; R133-Q355 VanDerWaalsContact CZ-OE1 3.28Å; R133-Q355 VanDerWaalsContact NH1-NE2 3.12Å; Q355-S357 VanDerWaalsContact C-N 3.34Å
356	A	81.9	Confident	89.6	Confident	11 Å²	11	55.2 Å²	55.2	9%	0.091	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-7.8	175.1	0	0	0	0	0	114	F132 L349 N352 D354	F132-A356 HydrophobicContact CB-CB 3.47Å; F132-A356 VanDerWaalsContact CB-CB 3.47Å; F132-A356 HydrophobicContact CG-CB 4.19Å; F132-A356 WeakPolarHBondContact O-CA 3.27Å; L349-A356 HydrophobicContact CD1-CB 4.1Å; L349-A356 PolarHBondContact N-O 3.12Å; L349-A356 VanDerWaalsContact N-O 3.08Å; N352-A356 HydrophobicContact CB-CB 4.41Å; D354-A356 PolarHBondContact O-N 3.39Å
357	S	92	Very high	89.7	Confident	13 Å²	13	55.9 Å²	55.9	9%	0.091	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-58.6	142.6	176.5	80.9	0	0	0	0	110.6	L349 N352 D354 Q355 A359 T360 L361	L349-S357 VanDerWaalsContact O-CA 3.3Å; L349-S357 WeakPolarHBondContact O-CA 3.36Å; N352-S357 WeakPolarHBondContact O-CB 3.24Å; D354-S357 WeakPolarHBondContact O-CB 3.36Å; D354-S357 PolarHBondContact O-N 3.26Å; D354-S357 PolarHBondContact O-OG 3.11Å; Q355-S357 VanDerWaalsContact C-N 3.34Å; S357-A359 PolarHBondContact O-N 3.46Å; S357-T360 PolarHBondContact O-N 3.03Å; S357-T360 WeakPolarHBondContact OG-CB 3.48Å; S357-T360 PolarHBondContact OG-N 2.83Å; S357-T360 PolarHBondContact OG-OG1 3.46Å; S357-L361 WeakPolarHBondContact O-CB 3.48Å; S357-L361 PolarHBondContact O-N 2.85Å
358	C	93.6	Very high	89.7	Confident	13 Å²	13	59.1 Å²	59.1	9%	0.088	34%	0.34	C	S	.	.	H	α-helix	trans	-58.7	-36	176.1	-70.6	0	0	0	0	112.2	C348 L349 C362	C348-C358 VanDerWaalsContact C-SG 3.52Å; C348-C358 HydrophobicContact CB-CB 3.88Å; C348-C358 WeakPolarHBondContact CB-SG 3.15Å; C348-C358 VanDerWaalsContact SG-CA 3.54Å; C348-C358 WeakPolarHBondContact SG-CB 3.48Å; C348-C358 CovalentContact SG-SG 2.04Å; C348-C358 PolarHBondContact SG-SG 3.45Å; L349-C358 VanDerWaalsContact C-SG 3.56Å; L349-C358 PolarHBondContact O-N 2.88Å; L349-C358 VanDerWaalsContact O-N 3.15Å; C358-C362 WeakPolarHBondContact O-CB 3.31Å; C358-C362 PolarHBondContact O-N 3.48Å; C358-C362 PolarHBondContact O-SG 2.95Å
359	A	92.7	Very high	89.8	Confident	55 Å²	55	62.7 Å²	62.7	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-59.2	-49.9	175.6	0	0	0	0	0	111.8	S357 C363 N364	S357-A359 PolarHBondContact O-N 3.46Å; A359-C363 PolarHBondContact O-N 3Å; A359-N364 PolarHBondContact O-N 3.39Å; A359-N364 PolarHBondContact O-OD1 3.38Å; A359-N364 VanDerWaalsContact O-OD1 3.13Å
360	T	92.9	Very high	89.9	Confident	59 Å²	59	63.1 Å²	63.1	36%	0.362	36%	0.363	S	S	.	.	H	α-helix	trans	-71.3	-54	-179.3	-53.8	0	0	0	0	111.9	H134 S357 C362 C363	H134-T360 PolarHBondContact NE2-O 3.3Å; S357-T360 PolarHBondContact O-N 3.03Å; S357-T360 WeakPolarHBondContact OG-CB 3.48Å; S357-T360 PolarHBondContact OG-N 2.83Å; S357-T360 PolarHBondContact OG-OG1 3.46Å; T360-C362 VanDerWaalsContact C-N 3.35Å; T360-C362 PolarHBondContact O-N 2.89Å; T360-C363 PolarHBondContact O-N 2.91Å; T360-C363 VanDerWaalsContact O-N 3.08Å
361	L	93.9	Very high	90.3	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-39.4	-172.7	-173.2	62.5	0	0	0	112.2	H134 T343 E347 C348 S357 C363	H134-L361 PolarHBondContact CD2-O 3.39Å; T343-L361 VanDerWaalsContact CB-O 3.26Å; T343-L361 WeakPolarHBondContact CB-O 3.17Å; T343-L361 HydrophobicContact CG2-CD1 4.45Å; T343-L361 WeakPolarHBondContact CG2-O 3.44Å; T343-L361 PolarHBondContact OG1-O 3.26Å; E347-L361 WeakPolarHBondContact O-CD2 3.15Å; C348-L361 HydrophobicContact CB-CB 4.44Å; C348-L361 HydrophobicContact CB-CD2 3.94Å; S357-L361 WeakPolarHBondContact O-CB 3.48Å; S357-L361 PolarHBondContact O-N 2.85Å; L361-C363 PolarHBondContact O-N 3.44Å
362	C	94.7	Very high	91	Very high	0 Å²	0	62 Å²	62	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	5.4	178.9	-48.7	0	0	0	0	113.2	C348 C358 T360 N364 R365 G366 C402	C348-C362 VanDerWaalsContact SG-SG 3.61Å; C358-C362 WeakPolarHBondContact O-CB 3.31Å; C358-C362 PolarHBondContact O-N 3.48Å; C358-C362 PolarHBondContact O-SG 2.95Å; T360-C362 VanDerWaalsContact C-N 3.35Å; T360-C362 PolarHBondContact O-N 2.89Å; C362-N364 VanDerWaalsContact C-N 3.27Å; C362-N364 PolarHBondContact O-N 3.48Å; C362-R365 WeakPolarHBondContact O-CB 3.32Å; C362-R365 WeakPolarHBondContact O-CG 3.31Å; C362-R365 PolarHBondContact O-N 2.03Å; C362-R365 VanDerWaalsContact O-N 3.13Å; C362-R365 PolarHBondContact O-NE 3.16Å; C362-R365 VanDerWaalsContact O-NE 3.16Å; C362-G366 WeakPolarHBondContact CB-O 3.39Å; C362-C402 WeakPolarHBondContact CA-SG 3.04Å; C362-C402 HydrophobicContact CB-CB 3.53Å; C362-C402 WeakPolarHBondContact CB-SG 3.44Å; C362-C402 WeakPolarHBondContact SG-CA 3.41Å; C362-C402 WeakPolarHBondContact SG-CB 3.48Å; C362-C402 CovalentContact SG-SG 2.03Å; C362-C402 PolarHBondContact SG-SG 3.15Å
363	C	94.3	Very high	91.7	Very high	32 Å²	32	66 Å²	66	22%	0.216	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	42.5	178.3	-49	0	0	0	0	112.4	H134 C332 A359 T360 L361 R365	H134-C363 PolarHBondContact NE2-SG 3.17Å; C332-C363 VanDerWaalsContact CA-SG 3.5Å; C332-C363 HydrophobicContact CB-CB 3.74Å; C332-C363 WeakPolarHBondContact CB-SG 3.27Å; C332-C363 WeakPolarHBondContact SG-CB 3.3Å; C332-C363 CovalentContact SG-SG 2.02Å; C332-C363 PolarHBondContact SG-SG 3.47Å; A359-C363 PolarHBondContact O-N 3Å; T360-C363 PolarHBondContact O-N 2.91Å; T360-C363 VanDerWaalsContact O-N 3.08Å; L361-C363 PolarHBondContact O-N 3.44Å; C363-R365 PolarHBondContact O-N 3.17Å; C363-R365 VanDerWaalsContact O-N 3.11Å
364	N	93.5	Very high	92.6	Very high	138 Å²	138	61.5 Å²	61.5	74%	0.738	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	16.3	-177.9	-57.3	-47.1	0	0	0	116	A359 C362 G366	A359-N364 PolarHBondContact O-N 3.39Å; A359-N364 PolarHBondContact O-OD1 3.38Å; A359-N364 VanDerWaalsContact O-OD1 3.13Å; C362-N364 VanDerWaalsContact C-N 3.27Å; C362-N364 PolarHBondContact O-N 3.48Å; N364-G366 PolarHBondContact O-N 3.28Å
365	R	94.2	Very high	93.3	Very high	62 Å²	62	65.3 Å²	65.3	23%	0.234	34%	0.341	C	S	.	.	S	Bend	trans	-77.1	-3.4	174.4	-61.7	178.8	-60.8	-156	2.9	113.9	C332 D333 T343 C362 C363 N403	C332-R365 PolarHBondContact O-NH1 3.46Å; D333-R365 IonicContact OD1-NH1 3.13Å; D333-R365 PolarHBondContact OD1-NH1 2.03Å; D333-R365 VanDerWaalsContact OD1-NH1 3.13Å; T343-R365 PolarHBondContact OG1-NH2 2.93Å; C362-R365 WeakPolarHBondContact O-CB 3.32Å; C362-R365 WeakPolarHBondContact O-CG 3.31Å; C362-R365 PolarHBondContact O-N 2.03Å; C362-R365 VanDerWaalsContact O-N 3.13Å; C362-R365 PolarHBondContact O-NE 3.16Å; C362-R365 VanDerWaalsContact O-NE 3.16Å; C363-R365 PolarHBondContact O-N 3.17Å; C363-R365 VanDerWaalsContact O-N 3.11Å; R365-N403 HydrophobicContact CB-CB 4.49Å; R365-N403 PolarHBondContact NE-O 3.42Å; R365-N403 PolarHBondContact O-ND2 3.44Å
366	G	93.5	Very high	94	Very high	35 Å²	35	65.3 Å²	65.3	36%	0.361	34%	0.341	S	S	.	.			trans	82.3	174.6	-171.3	0	0	0	0	0	113.3	C362 N364 N403	C362-G366 WeakPolarHBondContact CB-O 3.39Å; N364-G366 PolarHBondContact O-N 3.28Å; G366-N403 PolarHBondContact O-N 2.96Å
367	S	95.1	Very high	94.6	Very high	41 Å²	41	71.4 Å²	71.4	29%	0.287	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	148.1	174.9	56	0	0	0	0	110.9	V401	S367-V401 CarbonylContact C-O 3.45Å; S367-V401 WeakPolarHBondContact CA-O 3Å; S367-V401 VanDerWaalsContact CB-O 3.27Å; S367-V401 WeakPolarHBondContact CB-O 3.36Å
368	Q	95.6	Very high	94.8	Very high	116 Å²	116	71.7 Å²	71.7	54%	0.542	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.3	170.9	-78.8	166.1	16	0	0	109.9	H400 V401 N403	Q368-H400 CarbonylContact O-C 3.58Å; Q368-H400 WeakPolarHBondContact O-CA 3.44Å; Q368-V401 PolarHBondContact N-O 2.85Å; Q368-V401 PolarHBondContact O-N 3.05Å; Q368-N403 VanDerWaalsContact CG-OD1 3.29Å; Q368-N403 WeakPolarHBondContact CG-OD1 3.35Å; Q368-N403 PolarHBondContact NE2-OD1 3.11Å
369	T	95.8	Very high	94.9	Very high	77 Å²	77	77.4 Å²	77.4	47%	0.472	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.8	168.1	-52.7	0	0	0	0	108.9	E398 H400	T369-E398 HydrophobicContact CG2-CB 4.1Å; T369-H400 PolarHBondContact OG1-CE1 3.49Å; T369-H400 PolarHBondContact OG1-ND1 3.3Å
370	Q	95.2	Very high	95.1	Very high	70 Å²	70	78 Å²	78	33%	0.327	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.4	174.9	-64.8	-174.5	20.7	0	0	109.3	E398 Y399 V401	Q370-E398 WeakPolarHBondContact O-CA 3.39Å; Q370-Y399 HydrophobicContact CB-CD1 4.14Å; Q370-Y399 HydrophobicContact CB-CD2 4.44Å; Q370-Y399 HydrophobicContact CB-CE1 3.52Å; Q370-Y399 HydrophobicContact CB-CE2 3.87Å; Q370-Y399 WeakPolarHBondContact CB-OH 3.32Å; Q370-Y399 PolarHBondContact N-O 3.29Å; Q370-Y399 VanDerWaalsContact O-CD1 3.23Å; Q370-Y399 WeakPolarHBondContact O-CD1 3.42Å; Q370-Y399 PolarHBondContact O-N 3.19Å; Q370-Y399 PolarHBondContact OE1-OH 3.48Å; Q370-V401 HydrophobicContact CG-CG2 4.38Å
371	L	95.7	Very high	95.2	Very high	112 Å²	112	81.8 Å²	81.8	59%	0.586	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.2	177.2	-60.1	-179.6	0	0	0	109.3	T396 E398	L371-T396 HydrophobicContact CB-CG2 3.86Å; L371-T396 HydrophobicContact CD1-CG2 4.12Å; L371-T396 HydrophobicContact CD2-CG2 4.09Å; L371-T396 HydrophobicContact CG-CG2 4.24Å; L371-E398 HydrophobicContact CD2-CB 4.23Å; L371-E398 HydrophobicContact CD2-CG 3.61Å
372	R	95.3	Very high	95.3	Very high	91 Å²	91	87.7 Å²	87.7	34%	0.343	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.4	169.9	64.2	179.9	-172	-143.5	-5.2	110.6	E347 V374 E397 Y399	E347-R372 IonicContact OE1-CZ 3.81Å; E347-R372 IonicContact OE1-NH1 2.76Å; E347-R372 PolarHBondContact OE1-NH1 2.96Å; E347-R372 IonicContact OE1-NH2 3.37Å; R372-V374 HydrophobicContact CG-CG2 3.94Å; R372-V374 PolarHBondContact O-N 3.29Å; R372-E397 HydrophobicContact CG-CB 4.14Å; R372-E397 IonicContact CZ-OE2 3.68Å; R372-E397 PolarHBondContact N-O 3.05Å; R372-E397 IonicContact NE-OE2 3.16Å; R372-E397 PolarHBondContact NE-OE2 2.81Å; R372-E397 IonicContact NH2-OE2 2.66Å; R372-E397 PolarHBondContact NH2-OE2 3.32Å; R372-E397 PolarHBondContact O-N 2.88Å; R372-Y399 HydrophobicContact CB-CD1 3.94Å; R372-Y399 HydrophobicContact CB-CE1 3.62Å; R372-Y399 HydrophobicContact CG-CD1 3.73Å; R372-Y399 HydrophobicContact CG-CE1 3.96Å
373	E	96.5	Very high	95.2	Very high	137 Å²	137	89.8 Å²	89.8	64%	0.64	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	117.9	167.5	-67.8	-168.9	157	0	0	109.7	V394 K395	E373-V394 HydrophobicContact CB-CG1 3.94Å; E373-V394 HydrophobicContact CG-CG1 4.1Å; E373-K395 WeakPolarHBondContact CA-O 3.4Å
374	V	95.3	Very high	95	Very high	38 Å²	38	99.8 Å²	99.8	23%	0.23	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.6	173.1	-178.9	0	0	0	0	108.7	R372 K395 E397	R372-V374 HydrophobicContact CG-CG2 3.94Å; R372-V374 PolarHBondContact O-N 3.29Å; V374-K395 HydrophobicContact CB-CG 3.97Å; V374-K395 PolarHBondContact N-O 2.71Å; V374-K395 WeakPolarHBondContact O-CG 3.24Å; V374-K395 PolarHBondContact O-N 3.04Å; V374-E397 HydrophobicContact CB-CG 4.33Å; V374-E397 HydrophobicContact CG2-CB 4.19Å; V374-E397 HydrophobicContact CG2-CG 3.87Å; V374-E397 WeakPolarHBondContact CG2-OE2 3.08Å
375	R	96.4	Very high	94.6	Very high	189 Å²	189	97.4 Å²	97.4	71%	0.713	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	117.5	173.8	-61.4	-173	179.1	-175.9	-1	109	T392 C393 V394	R375-T392 HydrophobicContact CB-CG2 4.07Å; R375-C393 WeakPolarHBondContact CA-O 2.99Å; R375-V394 HydrophobicContact CG-CG2 4.3Å
376	E	95.3	Very high	94.2	Very high	83 Å²	83	99.4 Å²	99.4	39%	0.388	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	159	178	69.7	-177.2	-179.2	0	0	112.1	T392 C393 K395	E376-T392 WeakPolarHBondContact O-CA 3.48Å; E376-C393 PolarHBondContact N-O 3.3Å; E376-C393 PolarHBondContact O-N 2.98Å; E376-K395 VanDerWaalsContact CD-CE 3.46Å; E376-K395 WeakPolarHBondContact OE1-CD 3.3Å; E376-K395 IonicContact OE1-NZ 3.66Å; E376-K395 WeakPolarHBondContact OE2-CE 3.38Å; E376-K395 IonicContact OE2-NZ 2.82Å; E376-K395 PolarHBondContact OE2-NZ 2.85Å
377	K	96.2	Very high	94.2	Very high	139 Å²	139	104.9 Å²	104.9	60%	0.604	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	122.6	172.1	-64.6	-54	-172.4	179.7	0	108.4	C390 Q391 T392	K377-C390 HydrophobicContact CB-CB 3.93Å; K377-C390 HydrophobicContact CD-CB 4.09Å; K377-C390 HydrophobicContact CG-CB 4.38Å; K377-Q391 WeakPolarHBondContact CA-O 3.43Å; K377-T392 PolarHBondContact NZ-OG1 3.36Å
378	C	96.1	Very high	94.2	Very high	19 Å²	19	107.2 Å²	107.2	13%	0.128	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	168.4	-176.9	64	0	0	0	0	109.5	C380 Q391 C393	C378-C380 PolarHBondContact O-N 3.46Å; C378-Q391 PolarHBondContact N-O 3.38Å; C378-Q391 PolarHBondContact O-N 3.27Å; C378-C393 HydrophobicContact CB-CB 3.64Å; C378-C393 WeakPolarHBondContact CB-SG 3.42Å; C378-C393 VanDerWaalsContact SG-CA 3.58Å; C378-C393 WeakPolarHBondContact SG-CB 3.02Å; C378-C393 PolarHBondContact SG-N 2.85Å; C378-C393 CovalentContact SG-SG 2Å; C378-C393 PolarHBondContact SG-SG 3.1Å
379	H	96	Very high	94.2	Very high	132 Å²	132	106 Å²	106	61%	0.611	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.4	41.4	177.9	-55.3	-59.8	0	0	0	112.7	Q381	H379-Q381 PolarHBondContact O-N 3.5Å
380	C	96.4	Very high	94.3	Very high	68 Å²	68	104.4 Å²	104.4	46%	0.459	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	120.4	-179.1	-66.3	0	0	0	0	110.3	C378 V388 E389 C390	C378-C380 PolarHBondContact O-N 3.46Å; C380-V388 HydrophobicContact CB-CG1 3.88Å; C380-E389 CarbonylContact C-O 3.59Å; C380-E389 WeakPolarHBondContact CA-O 3.34Å; C380-C390 HydrophobicContact CB-CB 4.05Å; C380-C390 WeakPolarHBondContact CB-SG 3.34Å; C380-C390 WeakPolarHBondContact SG-CB 3.32Å; C380-C390 CovalentContact SG-SG 2.03Å; C380-C390 PolarHBondContact SG-SG 3.28Å
381	Q	95	Very high	94.3	Very high	139 Å²	139	107 Å²	107	65%	0.65	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.5	174.7	-65.7	-176.7	-5.6	0	0	109.4	H379 V388 E389	H379-Q381 PolarHBondContact O-N 3.5Å; Q381-V388 WeakPolarHBondContact O-CA 3.22Å; Q381-E389 PolarHBondContact N-O 3.07Å; Q381-E389 PolarHBondContact O-N 2.93Å
382	F	95.7	Very high	94.4	Very high	124 Å²	124	105.4 Å²	105.4	54%	0.544	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	116.7	171.7	-178.6	-102.3	0	0	0	108.8	W384 V388	F382-W384 AromaticContact CE1-CE3 3.82Å; F382-W384 HydrophobicContact CE1-CE3 3.82Å; F382-W384 HydrophobicContact CE1-CZ3 4.38Å; F382-V388 HydrophobicContact CD2-CG2 3.84Å
383	N	91.8	Very high	94.5	Very high	44 Å²	44	102.8 Å²	102.8	24%	0.235	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	117	171.4	-67.5	-28.8	0	0	0	108	C385 R387 E389	N383-C385 CarbonylContact O-C 3.47Å; N383-C385 PolarHBondContact O-N 2.98Å; N383-R387 HydrophobicContact CB-CG 3.76Å; N383-R387 PolarHBondContact N-O 3.25Å; N383-R387 PolarHBondContact ND2-NE 2.83Å; N383-E389 WeakPolarHBondContact ND2-CG 3.48Å; N383-E389 PolarHBondContact ND2-OE2 3.2Å
384	W	90.7	Very high	94.5	Very high	241 Å²	241	100 Å²	100	91%	0.913	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	118.4	-179.3	-177.2	-107.3	0	0	0	110.3	F382	F382-W384 AromaticContact CE1-CE3 3.82Å; F382-W384 HydrophobicContact CE1-CE3 3.82Å; F382-W384 HydrophobicContact CE1-CZ3 4.38Å
385	C	85.5	Confident	94.5	Very high	89 Å²	89	101.4 Å²	101.4	60%	0.601	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.8	111.3	-157.9	-164.4	0	0	0	0	117.8	N383	N383-C385 CarbonylContact O-C 3.47Å; N383-C385 PolarHBondContact O-N 2.98Å
386	C	85.5	Confident	94.5	Very high	104 Å²	104	96.8 Å²	96.8	70%	0.703	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	cis	-150.1	40.8	-4.2	-73.9	0	0	0	0	108.1
387	R	93.7	Very high	94.4	Very high	150 Å²	150	95.4 Å²	95.4	57%	0.566	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	140.4	-171.9	64.9	-179.2	172.8	168.2	-4.5	110.4	N383 E389	N383-R387 HydrophobicContact CB-CG 3.76Å; N383-R387 PolarHBondContact N-O 3.25Å; N383-R387 PolarHBondContact ND2-NE 2.83Å; R387-E389 WeakPolarHBondContact CD-OE1 3.33Å; R387-E389 HydrophobicContact CG-CG 4.39Å; R387-E389 IonicContact CZ-OE1 3.34Å; R387-E389 IonicContact NE-OE1 3.7Å; R387-E389 PolarHBondContact NE-OE1 3.13Å; R387-E389 VanDerWaalsContact NE-OE1 3.16Å; R387-E389 IonicContact NH1-OE1 3.28Å; R387-E389 PolarHBondContact NH1-OE1 2.03Å; R387-E389 IonicContact NH2-OE1 3.95Å
388	V	95.2	Very high	94.3	Very high	90 Å²	90	95.3 Å²	95.3	55%	0.545	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.6	166.4	179.7	0	0	0	0	106.9	C380 Q381 F382	C380-V388 HydrophobicContact CB-CG1 3.88Å; Q381-V388 WeakPolarHBondContact O-CA 3.22Å; F382-V388 HydrophobicContact CD2-CG2 3.84Å
389	E	95.3	Very high	94.3	Very high	91 Å²	91	96.8 Å²	96.8	43%	0.425	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	124.9	172.6	-69.9	-177.3	169	0	0	108.5	C380 Q381 N383 R387	C380-E389 CarbonylContact C-O 3.59Å; C380-E389 WeakPolarHBondContact CA-O 3.34Å; Q381-E389 PolarHBondContact N-O 3.07Å; Q381-E389 PolarHBondContact O-N 2.93Å; N383-E389 WeakPolarHBondContact ND2-CG 3.48Å; N383-E389 PolarHBondContact ND2-OE2 3.2Å; R387-E389 WeakPolarHBondContact CD-OE1 3.33Å; R387-E389 HydrophobicContact CG-CG 4.39Å; R387-E389 IonicContact CZ-OE1 3.34Å; R387-E389 IonicContact NE-OE1 3.7Å; R387-E389 PolarHBondContact NE-OE1 3.13Å; R387-E389 VanDerWaalsContact NE-OE1 3.16Å; R387-E389 IonicContact NH1-OE1 3.28Å; R387-E389 PolarHBondContact NH1-OE1 2.03Å; R387-E389 IonicContact NH2-OE1 3.95Å
390	C	97	Very high	94.2	Very high	42 Å²	42	92.2 Å²	92.2	28%	0.284	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.7	179.4	-55.2	0	0	0	0	109.7	K377 C380	K377-C390 HydrophobicContact CB-CB 3.93Å; K377-C390 HydrophobicContact CD-CB 4.09Å; K377-C390 HydrophobicContact CG-CB 4.38Å; C380-C390 HydrophobicContact CB-CB 4.05Å; C380-C390 WeakPolarHBondContact CB-SG 3.34Å; C380-C390 WeakPolarHBondContact SG-CB 3.32Å; C380-C390 CovalentContact SG-SG 2.03Å; C380-C390 PolarHBondContact SG-SG 3.28Å
391	Q	96.6	Very high	94.2	Very high	126 Å²	126	89.8 Å²	89.8	59%	0.589	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	161.6	164.9	-63.1	178.8	-4.3	0	0	109.7	K377 C378	K377-Q391 WeakPolarHBondContact CA-O 3.43Å; C378-Q391 PolarHBondContact N-O 3.38Å; C378-Q391 PolarHBondContact O-N 3.27Å
392	T	97	Very high	94.2	Very high	78 Å²	78	83.3 Å²	83.3	48%	0.479	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	109	171.8	-53.6	0	0	0	0	107.4	R375 E376 K377	R375-T392 HydrophobicContact CB-CG2 4.07Å; E376-T392 WeakPolarHBondContact O-CA 3.48Å; K377-T392 PolarHBondContact NZ-OG1 3.36Å
393	C	97.3	Very high	94.2	Very high	36 Å²	36	81.3 Å²	81.3	24%	0.243	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	144	174.3	-71.7	0	0	0	0	109.4	R375 E376 C378	R375-C393 WeakPolarHBondContact CA-O 2.99Å; E376-C393 PolarHBondContact N-O 3.3Å; E376-C393 PolarHBondContact O-N 2.98Å; C378-C393 HydrophobicContact CB-CB 3.64Å; C378-C393 WeakPolarHBondContact CB-SG 3.42Å; C378-C393 VanDerWaalsContact SG-CA 3.58Å; C378-C393 WeakPolarHBondContact SG-CB 3.02Å; C378-C393 PolarHBondContact SG-N 2.85Å; C378-C393 CovalentContact SG-SG 2Å; C378-C393 PolarHBondContact SG-SG 3.1Å
394	V	96.7	Very high	94.3	Very high	79 Å²	79	83.2 Å²	83.2	48%	0.479	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.6	168.8	-172.5	0	0	0	0	106.6	E373 R375	E373-V394 HydrophobicContact CB-CG1 3.94Å; E373-V394 HydrophobicContact CG-CG1 4.1Å; R375-V394 HydrophobicContact CG-CG2 4.3Å
395	K	95.2	Very high	94.5	Very high	67 Å²	67	74.9 Å²	74.9	29%	0.291	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	144.9	170.6	61.3	175.1	177.4	-179.1	0	109.4	E373 V374 E376 E397	E373-K395 WeakPolarHBondContact CA-O 3.4Å; V374-K395 HydrophobicContact CB-CG 3.97Å; V374-K395 PolarHBondContact N-O 2.71Å; V374-K395 WeakPolarHBondContact O-CG 3.24Å; V374-K395 PolarHBondContact O-N 3.04Å; E376-K395 VanDerWaalsContact CD-CE 3.46Å; E376-K395 WeakPolarHBondContact OE1-CD 3.3Å; E376-K395 IonicContact OE1-NZ 3.66Å; E376-K395 WeakPolarHBondContact OE2-CE 3.38Å; E376-K395 IonicContact OE2-NZ 2.82Å; E376-K395 PolarHBondContact OE2-NZ 2.85Å; K395-E397 HydrophobicContact CD-CG 4.16Å; K395-E397 WeakPolarHBondContact CE-OE1 3.37Å; K395-E397 HydrophobicContact CG-CG 4.32Å; K395-E397 IonicContact NZ-OE1 2.64Å; K395-E397 PolarHBondContact NZ-OE1 3.4Å
396	T	95.9	Very high	95	Very high	92 Å²	92	74.1 Å²	74.1	56%	0.564	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.8	171.2	-53.7	0	0	0	0	108	L371	L371-T396 HydrophobicContact CB-CG2 3.86Å; L371-T396 HydrophobicContact CD1-CG2 4.12Å; L371-T396 HydrophobicContact CD2-CG2 4.09Å; L371-T396 HydrophobicContact CG-CG2 4.24Å
397	E	94.2	Very high	95.5	Very high	53 Å²	53	72.4 Å²	72.4	25%	0.248	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.8	174.6	-68.7	-172.7	169.8	0	0	110.1	R372 V374 K395	R372-E397 HydrophobicContact CG-CB 4.14Å; R372-E397 IonicContact CZ-OE2 3.68Å; R372-E397 PolarHBondContact N-O 3.05Å; R372-E397 IonicContact NE-OE2 3.16Å; R372-E397 PolarHBondContact NE-OE2 2.81Å; R372-E397 IonicContact NH2-OE2 2.66Å; R372-E397 PolarHBondContact NH2-OE2 3.32Å; R372-E397 PolarHBondContact O-N 2.88Å; V374-E397 HydrophobicContact CB-CG 4.33Å; V374-E397 HydrophobicContact CG2-CB 4.19Å; V374-E397 HydrophobicContact CG2-CG 3.87Å; V374-E397 WeakPolarHBondContact CG2-OE2 3.08Å; K395-E397 HydrophobicContact CD-CG 4.16Å; K395-E397 WeakPolarHBondContact CE-OE1 3.37Å; K395-E397 HydrophobicContact CG-CG 4.32Å; K395-E397 IonicContact NZ-OE1 2.64Å; K395-E397 PolarHBondContact NZ-OE1 3.4Å
398	E	94.5	Very high	95.6	Very high	137 Å²	137	67.5 Å²	67.5	64%	0.64	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.6	168.5	-48.2	-161.2	148.2	0	0	110.2	T369 Q370 L371	T369-E398 HydrophobicContact CG2-CB 4.1Å; Q370-E398 WeakPolarHBondContact O-CA 3.39Å; L371-E398 HydrophobicContact CD2-CB 4.23Å; L371-E398 HydrophobicContact CD2-CG 3.61Å
399	Y	94.4	Very high	95.7	Very high	51 Å²	51	66 Å²	66	20%	0.2	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.9	171.3	69	-77.3	0	0	0	110.2	Q370 R372 V401	Q370-Y399 HydrophobicContact CB-CD1 4.14Å; Q370-Y399 HydrophobicContact CB-CD2 4.44Å; Q370-Y399 HydrophobicContact CB-CE1 3.52Å; Q370-Y399 HydrophobicContact CB-CE2 3.87Å; Q370-Y399 WeakPolarHBondContact CB-OH 3.32Å; Q370-Y399 PolarHBondContact N-O 3.29Å; Q370-Y399 VanDerWaalsContact O-CD1 3.23Å; Q370-Y399 WeakPolarHBondContact O-CD1 3.42Å; Q370-Y399 PolarHBondContact O-N 3.19Å; Q370-Y399 PolarHBondContact OE1-OH 3.48Å; R372-Y399 HydrophobicContact CB-CD1 3.94Å; R372-Y399 HydrophobicContact CB-CE1 3.62Å; R372-Y399 HydrophobicContact CG-CD1 3.73Å; R372-Y399 HydrophobicContact CG-CE1 3.96Å; Y399-V401 HydrophobicContact CD2-CG2 3.56Å; Y399-V401 HydrophobicContact CE2-CG2 3.29Å
400	H	95.4	Very high	95.7	Very high	35 Å²	35	64.2 Å²	64.2	16%	0.162	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	132	-175.2	-59.1	-90.2	0	0	0	110.3	E347 C348 P350 Q368 T369	E347-H400 CarbonylContact C-O 3.58Å; E347-H400 VanDerWaalsContact CA-O 3.24Å; E347-H400 WeakPolarHBondContact CA-O 3.47Å; C348-H400 PolarHBondContact N-O 3.13Å; P350-H400 WeakPolarHBondContact CD-CD2 3.33Å; P350-H400 VanDerWaalsContact CG-CD2 3.47Å; P350-H400 WeakPolarHBondContact CG-CD2 3.26Å; P350-H400 WeakPolarHBondContact CG-NE2 3.4Å; Q368-H400 CarbonylContact O-C 3.58Å; Q368-H400 WeakPolarHBondContact O-CA 3.44Å; T369-H400 PolarHBondContact OG1-CE1 3.49Å; T369-H400 PolarHBondContact OG1-ND1 3.3Å
401	V	95.5	Very high	95.6	Very high	17 Å²	17	65.9 Å²	65.9	10%	0.103	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.7	-177.2	-176	0	0	0	0	109.5	G345 R346 S367 Q368 Q370 Y399 N403	G345-V401 VanDerWaalsContact C-CG1 3.42Å; G345-V401 WeakPolarHBondContact O-CG1 3.29Å; R346-V401 CarbonylContact O-C 3.6Å; R346-V401 WeakPolarHBondContact O-CA 3.15Å; S367-V401 CarbonylContact C-O 3.45Å; S367-V401 WeakPolarHBondContact CA-O 3Å; S367-V401 VanDerWaalsContact CB-O 3.27Å; S367-V401 WeakPolarHBondContact CB-O 3.36Å; Q368-V401 PolarHBondContact N-O 2.85Å; Q368-V401 PolarHBondContact O-N 3.05Å; Q370-V401 HydrophobicContact CG-CG2 4.38Å; Y399-V401 HydrophobicContact CD2-CG2 3.56Å; Y399-V401 HydrophobicContact CE2-CG2 3.29Å; V401-N403 PolarHBondContact O-N 3.26Å
402	C	95.4	Very high	95.5	Very high	4 Å²	4	60.9 Å²	60.9	3%	0.027	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	133.7	176.1	-62.7	0	0	0	0	111.9	T343 G345 R346 C362	T343-C402 VanDerWaalsContact O-CB 3.3Å; T343-C402 WeakPolarHBondContact O-CB 3.08Å; G345-C402 PolarHBondContact N-O 3.4Å; R346-C402 PolarHBondContact O-N 3.33Å; R346-C402 PolarHBondContact O-SG 2.97Å; C362-C402 WeakPolarHBondContact CA-SG 3.04Å; C362-C402 HydrophobicContact CB-CB 3.53Å; C362-C402 WeakPolarHBondContact CB-SG 3.44Å; C362-C402 WeakPolarHBondContact SG-CA 3.41Å; C362-C402 WeakPolarHBondContact SG-CB 3.48Å; C362-C402 CovalentContact SG-SG 2.03Å; C362-C402 PolarHBondContact SG-SG 3.15Å
403	N	94.6	Very high	95.4	Very high	82 Å²	82	59.4 Å²	59.4	44%	0.439	31%	0.309	S	S	.	.			trans	-62.3	0	172.4	-65.2	-23.8	0	0	0	112.3	R344 R365 G366 Q368 V401	R344-N403 WeakPolarHBondContact CG-O 3.42Å; R365-N403 HydrophobicContact CB-CB 4.49Å; R365-N403 PolarHBondContact NE-O 3.42Å; R365-N403 PolarHBondContact O-ND2 3.44Å; G366-N403 PolarHBondContact O-N 2.96Å; Q368-N403 VanDerWaalsContact CG-OD1 3.29Å; Q368-N403 WeakPolarHBondContact CG-OD1 3.35Å; Q368-N403 PolarHBondContact NE2-OD1 3.11Å; V401-N403 PolarHBondContact O-N 3.26Å

Retrieved 403 of 403 residues in 85.7 ms (Link to these results)

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