A0A077ZEG4_TRITR Loading...

Dedicator of cytokinesis N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZEG4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 168 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	31.5	Very low	35.4	Very low	243 Å²	243	154 Å²	154	100%	1.197	74%	0.744	S	S	*	*				0	123.9	0	-93.9	169.7	177.5	0	0	108	F3	M1-F3 PolarHBondContact O-N 2.76Å
2	A	36.1	Very low	36.3	Very low	82 Å²	82	146.7 Å²	146.7	68%	0.678	74%	0.738	S	S	*	*			trans	-50.4	125.1	-171.4	0	0	0	0	0	111.3	W4	A2-W4 PolarHBondContact O-N 3.32Å
3	F	27.9	Very low	37.2	Very low	216 Å²	216	148.8 Å²	148.8	95%	0.947	74%	0.74	S	S	*	*			trans	-51.4	90.5	158.1	-102.3	-105.9	0	0	0	106.8	M1 N5	M1-F3 PolarHBondContact O-N 2.76Å; F3-N5 PolarHBondContact O-N 2.8Å
4	W	25.4	Very low	37.2	Very low	228 Å²	228	147.9 Å²	147.9	86%	0.864	73%	0.73	S	S	*	*			trans	-64.2	96.3	175.6	-107.4	78.8	0	0	0	107	A2	A2-W4 PolarHBondContact O-N 3.32Å
5	N	30.3	Very low	37.7	Very low	108 Å²	108	139.5 Å²	139.5	58%	0.578	69%	0.689	S	S	*	*				56.9	87.2	126	-150.6	-0.7	0	0	0	113.5	F3 S7	F3-N5 PolarHBondContact O-N 2.8Å; N5-S7 PolarHBondContact O-N 2.79Å; N5-S7 PolarHBondContact O-OG 3.45Å
6	R	33.1	Very low	38.2	Very low	217 Å²	217	137.9 Å²	137.9	82%	0.819	69%	0.692	S	S	*	*			trans	-66	50.4	169.9	-143.9	176.6	-168.8	-155.6	3.2	110.9	H8	R6-H8 PolarHBondContact O-N 2.88Å
7	S	39.8	Very low	38.6	Very low	83 Å²	83	137.9 Å²	137.9	58%	0.58	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	38.9	-174.3	61.7	0	0	0	0	113.4	N5	N5-S7 PolarHBondContact O-N 2.79Å; N5-S7 PolarHBondContact O-OG 3.45Å
8	H	43.2	Very low	38.9	Very low	154 Å²	154	136.9 Å²	136.9	71%	0.713	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-1.7	172.3	-115.8	-78.9	0	0	0	113.5	R6	R6-H8 PolarHBondContact O-N 2.88Å
9	L	41.4	Very low	39.2	Very low	131 Å²	131	134.3 Å²	134.3	69%	0.686	68%	0.678	S	S	*	*	S	Bend	trans	-100.7	-0.5	-178.7	-72.4	172.4	0	0	0	115
10	F	38.8	Very low	39.1	Very low	171 Å²	171	132.2 Å²	132.2	75%	0.75	67%	0.674	S	S	*	*	S	Bend	trans	-117.1	-2.6	-176.1	-109.2	-90.4	0	0	0	116.2	G12	F10-G12 PolarHBondContact O-N 2.59Å
11	V	41.9	Very low	39.4	Very low	61 Å²	61	133.2 Å²	133.2	37%	0.37	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-67.7	-22.9	-179.3	-166.5	0	0	0	0	111.9	F13 H41	V11-F13 VanDerWaalsContact C-N 3.34Å; V11-F13 PolarHBondContact O-N 3.36Å; V11-H41 VanDerWaalsContact CG1-CE1 3.43Å; V11-H41 WeakPolarHBondContact CG1-CE1 3.3Å
12	G	46.1	Very low	40	Very low	66 Å²	66	130.6 Å²	130.6	68%	0.68	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-68.1	-21.9	-176.6	0	0	0	0	0	115.9	F10	F10-G12 PolarHBondContact O-N 2.59Å
13	F	48.2	Very low	40	Very low	174 Å²	174	130.7 Å²	130.7	76%	0.763	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-89.2	-16.8	-176	-146.9	-95.2	0	0	0	113.9	V11	V11-F13 VanDerWaalsContact C-N 3.34Å; V11-F13 PolarHBondContact O-N 3.36Å
14	F	37.3	Very low	40.7	Very low	137 Å²	137	127.1 Å²	127.1	60%	0.601	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-7.3	-174.5	-91.6	-82.8	0	0	0	115.2	L17	F14-L17 HydrophobicContact CD1-CD1 4.22Å; F14-L17 HydrophobicContact CE1-CD1 4.34Å; F14-L17 PolarHBondContact O-N 3.08Å
15	L	44.1	Very low	41.6	Very low	22 Å²	22	119.6 Å²	119.6	12%	0.115	65%	0.653	C	S	.	*	G	3₁₀ helix	trans	-69.7	-27.8	-172.5	-147.8	71.8	0	0	0	115.8	L17 L18 F45	L15-L17 PolarHBondContact O-N 3.24Å; L15-L18 PolarHBondContact O-N 3.26Å; L15-F45 HydrophobicContact CD2-CB 4.04Å; L15-F45 HydrophobicContact CD2-CD1 3.19Å; L15-F45 HydrophobicContact CD2-CD2 3.47Å; L15-F45 VanDerWaalsContact CD2-CD2 3.47Å; L15-F45 HydrophobicContact CD2-CE1 3.36Å; L15-F45 HydrophobicContact CD2-CE2 3.62Å; L15-F45 HydrophobicContact CD2-CG 3.24Å; L15-F45 HydrophobicContact CD2-CZ 3.57Å; L15-F45 HydrophobicContact CG-CE1 4.48Å
16	P	46.5	Very low	42.1	Very low	113 Å²	113	120.1 Å²	120.1	73%	0.734	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-67.7	-11.8	173.1	-20.1	32.7	0	0	0	114.3
17	L	44.5	Very low	42.6	Very low	139 Å²	139	114 Å²	114	73%	0.728	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-93.8	-9.2	-179	-86.6	160.5	0	0	0	114.3	F14 L15	F14-L17 HydrophobicContact CD1-CD1 4.22Å; F14-L17 HydrophobicContact CE1-CD1 4.34Å; F14-L17 PolarHBondContact O-N 3.08Å; L15-L17 PolarHBondContact O-N 3.24Å
18	L	43.7	Very low	43.1	Very low	119 Å²	119	115 Å²	115	62%	0.623	65%	0.651	S	S	*	*	S	Bend	trans	-109.5	0.9	-172.6	-88.4	164.4	0	0	0	115.5	L15	L15-L18 PolarHBondContact O-N 3.26Å
19	L	45	Very low	43.3	Very low	87 Å²	87	109.6 Å²	109.6	46%	0.455	64%	0.637	S	S	.	*	S	Bend	trans	-110.9	106.1	168	-61.2	174.2	0	0	0	107.9	N21 Y42	L19-N21 PolarHBondContact O-N 3.41Å; L19-Y42 HydrophobicContact CD1-CE2 3.87Å; L19-Y42 HydrophobicContact CD2-CE2 4.07Å
20	P	38.1	Very low	43.5	Very low	93 Å²	93	109.4 Å²	109.4	60%	0.604	63%	0.634	S	S	*	*			trans	-57.1	126.8	169.1	-15	27.7	0	0	0	107.5	E22	P20-E22 PolarHBondContact O-N 3.25Å; P20-E22 VanDerWaalsContact O-N 3.09Å
21	N	45.1	Very low	44.1	Very low	153 Å²	153	109.1 Å²	109.1	82%	0.818	63%	0.633	S	S	*	*			trans	-33.9	119.8	170	-99.4	-25.9	0	0	0	108.9	L19 S23	L19-N21 PolarHBondContact O-N 3.41Å; N21-S23 VanDerWaalsContact C-N 3.29Å; N21-S23 PolarHBondContact O-N 2.69Å; N21-S23 PolarHBondContact O-OG 2.76Å
22	E	42.8	Very low	44.7	Very low	188 Å²	188	114.7 Å²	114.7	88%	0.879	65%	0.654	S	S	*	*			trans	-39.1	95.1	-177.5	-70.6	-157.7	153.5	0	0	110.5	P20	P20-E22 PolarHBondContact O-N 3.25Å; P20-E22 VanDerWaalsContact O-N 3.09Å
23	S	36.3	Very low	45.3	Very low	84 Å²	84	118 Å²	118	59%	0.587	66%	0.655	S	S	*	*			trans	-90.7	121.8	169.4	-69.3	0	0	0	0	104.4	N21 G25	N21-S23 VanDerWaalsContact C-N 3.29Å; N21-S23 PolarHBondContact O-N 2.69Å; N21-S23 PolarHBondContact O-OG 2.76Å; S23-G25 VanDerWaalsContact C-N 3.3Å; S23-G25 PolarHBondContact O-N 3.43Å
24	P	44.1	Very low	45.9	Very low	142 Å²	142	111.1 Å²	111.1	92%	0.922	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	94.8	-176.5	26.6	-31.6	0	0	0	107.8
25	G	42.7	Very low	47.6	Very low	69 Å²	69	108.2 Å²	108.2	71%	0.711	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	162.4	-0.1	-168.8	0	0	0	0	0	115.6	S23 S27	S23-G25 VanDerWaalsContact C-N 3.3Å; S23-G25 PolarHBondContact O-N 3.43Å; G25-S27 VanDerWaalsContact C-N 3.34Å; G25-S27 PolarHBondContact O-N 3.11Å
26	M	41.2	Very low	49	Very low	120 Å²	120	111.6 Å²	111.6	59%	0.591	65%	0.65	S	S	*	*			trans	-65.1	94.2	174.2	-85.5	164	70.2	0	0	111.1
27	S	43.3	Very low	50.4	Low	89 Å²	89	108.4 Å²	108.4	62%	0.622	64%	0.638	S	S	*	*			trans	-52.1	139.7	174.8	164.6	0	0	0	0	112.5	G25 G29 M30	G25-S27 VanDerWaalsContact C-N 3.34Å; G25-S27 PolarHBondContact O-N 3.11Å; S27-G29 PolarHBondContact O-N 3.24Å; S27-G29 PolarHBondContact OG-N 2.88Å; S27-M30 PolarHBondContact O-N 3.12Å
28	S	51.1	Low	51.9	Low	102 Å²	102	106.5 Å²	106.5	71%	0.713	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-45.4	-22.7	175.1	-163.8	0	0	0	0	114.5	M30	S28-M30 PolarHBondContact O-N 3.16Å
29	G	47.1	Very low	53.4	Low	41 Å²	41	105.2 Å²	105.2	42%	0.423	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-65.4	-24.2	-176.3	0	0	0	0	0	116.4	S27 K31	S27-G29 PolarHBondContact O-N 3.24Å; S27-G29 PolarHBondContact OG-N 2.88Å; G29-K31 PolarHBondContact O-N 2.91Å
30	M	46.3	Very low	54.9	Low	127 Å²	127	107.1 Å²	107.1	63%	0.626	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-78.9	-15.4	-175.7	-78.1	178.1	75.2	0	0	114.5	S27 S28 H32 I33	S27-M30 PolarHBondContact O-N 3.12Å; S28-M30 PolarHBondContact O-N 3.16Å; M30-H32 PolarHBondContact O-N 3.24Å; M30-I33 HydrophobicContact CG-CD1 4.34Å; M30-I33 PolarHBondContact O-N 2.66Å
31	K	51.7	Low	56.8	Low	166 Å²	166	105.5 Å²	105.5	72%	0.722	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-63.3	-29.5	174.1	-71.6	-173.9	179.3	-177.1	0	112.5	G29	G29-K31 PolarHBondContact O-N 2.91Å
32	H	54.2	Low	58.3	Low	177 Å²	177	102.7 Å²	102.7	82%	0.819	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-82.9	-13.6	-179.5	-77.2	-82.1	0	0	0	114.3	M30	M30-H32 PolarHBondContact O-N 3.24Å
33	I	57.2	Low	59.9	Low	137 Å²	137	97.2 Å²	97.2	70%	0.703	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-27.2	-176.9	-55.7	175.3	0	0	0	110.9	M30 S35	M30-I33 HydrophobicContact CG-CD1 4.34Å; M30-I33 PolarHBondContact O-N 2.66Å; I33-S35 PolarHBondContact O-N 3.1Å
34	A	61.7	Low	61.9	Low	29 Å²	29	97.3 Å²	97.3	24%	0.24	56%	0.56	C	S	.	*	S	Bend	trans	-66.6	121.3	178.5	0	0	0	0	0	111	F38 M39	A34-F38 HydrophobicContact CB-CD1 3.8Å; A34-F38 HydrophobicContact CB-CE1 4.48Å; A34-M39 HydrophobicContact CB-CG 3.86Å
35	S	73.3	Confident	63.6	Low	76 Å²	76	93.4 Å²	93.4	53%	0.531	53%	0.529	S	S	.	.			trans	-54.4	143.4	169.5	170.1	0	0	0	0	110.2	I33 G37 F38 M39	I33-S35 PolarHBondContact O-N 3.1Å; S35-G37 PolarHBondContact O-N 3.28Å; S35-G37 VanDerWaalsContact O-N 3.09Å; S35-F38 WeakPolarHBondContact O-CA 3.29Å; S35-F38 WeakPolarHBondContact O-CB 3.49Å; S35-F38 PolarHBondContact O-N 3.08Å; S35-M39 PolarHBondContact O-N 3.14Å; S35-M39 VanDerWaalsContact O-N 3.17Å
36	P	74	Confident	65.5	Low	93 Å²	93	92.5 Å²	92.5	60%	0.604	51%	0.512	S	S	*	.	H	α-helix	trans	-50.1	-37.2	176.1	-28.7	34.9	0	0	0	113.6	F38 M39 I40	P36-F38 VanDerWaalsContact C-N 3.34Å; P36-F38 PolarHBondContact O-N 3.36Å; P36-M39 PolarHBondContact O-N 3.22Å; P36-I40 WeakPolarHBondContact O-CG1 3.5Å; P36-I40 PolarHBondContact O-N 3.07Å; P36-I40 VanDerWaalsContact O-N 3.14Å
37	G	75.7	Confident	67.5	Low	46 Å²	46	90.6 Å²	90.6	47%	0.474	50%	0.502	S	S	.	.	H	α-helix	trans	-65.8	-34	176.9	0	0	0	0	0	113.7	S35 H41	S35-G37 PolarHBondContact O-N 3.28Å; S35-G37 VanDerWaalsContact O-N 3.09Å; G37-H41 PolarHBondContact O-N 3.2Å
38	F	75.2	Confident	69.4	Low	99 Å²	99	86.6 Å²	86.6	43%	0.434	47%	0.474	S	S	.	.	H	α-helix	trans	-68.4	-42.1	174.4	-179.8	-94.5	0	0	0	111.3	A34 S35 P36 I40 H41 Y42	A34-F38 HydrophobicContact CB-CD1 3.8Å; A34-F38 HydrophobicContact CB-CE1 4.48Å; S35-F38 WeakPolarHBondContact O-CA 3.29Å; S35-F38 WeakPolarHBondContact O-CB 3.49Å; S35-F38 PolarHBondContact O-N 3.08Å; P36-F38 VanDerWaalsContact C-N 3.34Å; P36-F38 PolarHBondContact O-N 3.36Å; F38-I40 PolarHBondContact O-N 3.28Å; F38-H41 PolarHBondContact O-N 2.99Å; F38-Y42 WeakPolarHBondContact O-CB 3.44Å; F38-Y42 PolarHBondContact O-N 3.07Å
39	M	75.2	Confident	71	Confident	92 Å²	92	84 Å²	84	45%	0.453	45%	0.453	S	S	.	.	H	α-helix	trans	-62.2	-43.5	178.2	-69.7	-153.7	-71.8	0	0	112.3	A34 S35 P36 H41 Y42 S43	A34-M39 HydrophobicContact CB-CG 3.86Å; S35-M39 PolarHBondContact O-N 3.14Å; S35-M39 VanDerWaalsContact O-N 3.17Å; P36-M39 PolarHBondContact O-N 3.22Å; M39-H41 PolarHBondContact O-N 2.89Å; M39-Y42 PolarHBondContact O-N 3.13Å; M39-S43 PolarHBondContact O-N 3.39Å; M39-S43 PolarHBondContact O-OG 3.32Å
40	I	76.6	Confident	72.8	Confident	126 Å²	126	85.3 Å²	85.3	65%	0.646	46%	0.456	S	S	*	.	H	α-helix	trans	-60.4	-47.1	177.8	-66	166.7	0	0	0	111	P36 F38 Y42 S43 F44	P36-I40 WeakPolarHBondContact O-CG1 3.5Å; P36-I40 PolarHBondContact O-N 3.07Å; P36-I40 VanDerWaalsContact O-N 3.14Å; F38-I40 PolarHBondContact O-N 3.28Å; I40-Y42 VanDerWaalsContact C-N 3.34Å; I40-Y42 PolarHBondContact O-N 3.44Å; I40-S43 PolarHBondContact O-N 2.91Å; I40-F44 WeakPolarHBondContact O-CB 3.34Å; I40-F44 PolarHBondContact O-N 3.2Å
41	H	77.8	Confident	74.6	Confident	59 Å²	59	80.6 Å²	80.6	27%	0.273	43%	0.434	S	S	.	.	H	α-helix	trans	-64.2	-39.8	178.6	-175.7	-84.8	0	0	0	112	V11 G37 F38 M39 F45	V11-H41 VanDerWaalsContact CG1-CE1 3.43Å; V11-H41 WeakPolarHBondContact CG1-CE1 3.3Å; G37-H41 PolarHBondContact O-N 3.2Å; F38-H41 PolarHBondContact O-N 2.99Å; M39-H41 PolarHBondContact O-N 2.89Å; H41-F45 WeakPolarHBondContact O-CB 3.48Å; H41-F45 PolarHBondContact O-N 2.97Å
42	Y	77.6	Confident	76.1	Confident	94 Å²	94	73.1 Å²	73.1	37%	0.369	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-47.5	176.4	179.1	-94	0	0	0	111.9	L19 F38 M39 I40 F44 F45 S46	L19-Y42 HydrophobicContact CD1-CE2 3.87Å; L19-Y42 HydrophobicContact CD2-CE2 4.07Å; F38-Y42 WeakPolarHBondContact O-CB 3.44Å; F38-Y42 PolarHBondContact O-N 3.07Å; M39-Y42 PolarHBondContact O-N 3.13Å; I40-Y42 VanDerWaalsContact C-N 3.34Å; I40-Y42 PolarHBondContact O-N 3.44Å; Y42-F44 VanDerWaalsContact C-N 3.32Å; Y42-F44 PolarHBondContact O-N 2.95Å; Y42-F45 PolarHBondContact O-N 2.74Å; Y42-S46 WeakPolarHBondContact O-CB 3.34Å; Y42-S46 PolarHBondContact O-N 3.42Å
43	S	76.2	Confident	77.8	Confident	74 Å²	74	71 Å²	71	52%	0.517	39%	0.392	S	S	.	.	H	α-helix	trans	-58	-45	177	-66.2	0	0	0	0	111.6	M39 I40 S46 E47	M39-S43 PolarHBondContact O-N 3.39Å; M39-S43 PolarHBondContact O-OG 3.32Å; I40-S43 PolarHBondContact O-N 2.91Å; S43-S46 PolarHBondContact O-N 2.96Å; S43-E47 WeakPolarHBondContact O-CB 3.29Å; S43-E47 PolarHBondContact O-N 3.04Å
44	F	78.1	Confident	79.3	Confident	85 Å²	85	67.9 Å²	67.9	37%	0.373	38%	0.379	S	S	.	.	H	α-helix	trans	-59.5	-49	175.1	177.2	-89	0	0	0	112.1	I40 Y42 S46 E47 V48 L106	I40-F44 WeakPolarHBondContact O-CB 3.34Å; I40-F44 PolarHBondContact O-N 3.2Å; Y42-F44 VanDerWaalsContact C-N 3.32Å; Y42-F44 PolarHBondContact O-N 2.95Å; F44-S46 PolarHBondContact O-N 3.18Å; F44-E47 PolarHBondContact O-N 3.45Å; F44-V48 HydrophobicContact CD1-CG2 4.39Å; F44-V48 HydrophobicContact CE1-CG2 4.07Å; F44-V48 HydrophobicContact CZ-CG2 4.26Å; F44-V48 WeakPolarHBondContact O-CG2 3.42Å; F44-V48 PolarHBondContact O-N 2.95Å; F44-L106 HydrophobicContact CD2-CB 3.8Å; F44-L106 HydrophobicContact CD2-CD2 4.11Å; F44-L106 HydrophobicContact CE2-CB 3.21Å; F44-L106 HydrophobicContact CE2-CD2 4.33Å; F44-L106 HydrophobicContact CE2-CG 4.4Å; F44-L106 HydrophobicContact CZ-CB 3.82Å
45	F	79.7	Confident	80.5	Confident	60 Å²	60	66.6 Å²	66.6	26%	0.263	37%	0.369	S	S	.	.	H	α-helix	trans	-63.7	-40.8	179.2	-179.6	-91.6	0	0	0	112.3	L15 H41 Y42 E47 V48 T49 L102	L15-F45 HydrophobicContact CD2-CB 4.04Å; L15-F45 HydrophobicContact CD2-CD1 3.19Å; L15-F45 HydrophobicContact CD2-CD2 3.47Å; L15-F45 VanDerWaalsContact CD2-CD2 3.47Å; L15-F45 HydrophobicContact CD2-CE1 3.36Å; L15-F45 HydrophobicContact CD2-CE2 3.62Å; L15-F45 HydrophobicContact CD2-CG 3.24Å; L15-F45 HydrophobicContact CD2-CZ 3.57Å; L15-F45 HydrophobicContact CG-CE1 4.48Å; H41-F45 WeakPolarHBondContact O-CB 3.48Å; H41-F45 PolarHBondContact O-N 2.97Å; Y42-F45 PolarHBondContact O-N 2.74Å; F45-E47 VanDerWaalsContact C-N 3.34Å; F45-E47 PolarHBondContact O-N 3.42Å; F45-V48 PolarHBondContact O-N 3.11Å; F45-T49 HydrophobicContact CD1-CG2 3.97Å; F45-T49 HydrophobicContact CD2-CG2 4.47Å; F45-T49 HydrophobicContact CE1-CG2 3.39Å; F45-T49 HydrophobicContact CE2-CG2 3.98Å; F45-T49 HydrophobicContact CG-CG2 4.48Å; F45-T49 HydrophobicContact CZ-CG2 3.4Å; F45-T49 VanDerWaalsContact CZ-CG2 3.4Å; F45-T49 WeakPolarHBondContact O-CB 3.36Å; F45-T49 WeakPolarHBondContact O-CG2 3.39Å; F45-T49 PolarHBondContact O-N 3.03Å; F45-T49 PolarHBondContact O-OG1 3.42Å; F45-L102 HydrophobicContact CE2-CD1 4.47Å
46	S	81.8	Confident	81.4	Confident	51 Å²	51	65.3 Å²	65.3	36%	0.357	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-40.8	176.7	-174.6	0	0	0	0	111.6	Y42 S43 F44 T49 S50	Y42-S46 WeakPolarHBondContact O-CB 3.34Å; Y42-S46 PolarHBondContact O-N 3.42Å; S43-S46 PolarHBondContact O-N 2.96Å; F44-S46 PolarHBondContact O-N 3.18Å; S46-T49 WeakPolarHBondContact CA-OG1 3.26Å; S46-T49 PolarHBondContact O-OG1 3.22Å; S46-T49 VanDerWaalsContact O-OG1 3.06Å; S46-S50 VanDerWaalsContact O-CB 3.28Å; S46-S50 WeakPolarHBondContact O-CB 3.4Å; S46-S50 PolarHBondContact O-N 3.03Å
47	E	83.7	Confident	82.3	Confident	79 Å²	79	66.2 Å²	66.2	37%	0.369	35%	0.354	S	S	.	.	H	α-helix	trans	-66.4	-45.9	177.6	-166.5	178.2	166	0	0	110.9	S43 F44 F45 T49 S50 V51 L106 K110	S43-E47 WeakPolarHBondContact O-CB 3.29Å; S43-E47 PolarHBondContact O-N 3.04Å; F44-E47 PolarHBondContact O-N 3.45Å; F45-E47 VanDerWaalsContact C-N 3.34Å; F45-E47 PolarHBondContact O-N 3.42Å; E47-T49 PolarHBondContact O-N 2.96Å; E47-S50 PolarHBondContact O-N 3.42Å; E47-V51 WeakPolarHBondContact O-CG2 3.35Å; E47-V51 PolarHBondContact O-N 3.18Å; E47-L106 HydrophobicContact CB-CD1 4.16Å; E47-L106 HydrophobicContact CG-CD1 3.74Å; E47-L106 HydrophobicContact CG-CD2 4.47Å; E47-L106 VanDerWaalsContact OE2-CD2 3.29Å; E47-L106 WeakPolarHBondContact OE2-CD2 3.42Å; E47-K110 WeakPolarHBondContact OE1-CE 3.41Å; E47-K110 IonicContact OE1-NZ 2.72Å; E47-K110 PolarHBondContact OE1-NZ 3.03Å
48	V	82.3	Confident	83	Confident	6 Å²	6	67.1 Å²	67.1	4%	0.036	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-44.7	177.4	172.1	0	0	0	0	111.7	F44 F45 V51 A52 L102 L106 V109	F44-V48 HydrophobicContact CD1-CG2 4.39Å; F44-V48 HydrophobicContact CE1-CG2 4.07Å; F44-V48 HydrophobicContact CZ-CG2 4.26Å; F44-V48 WeakPolarHBondContact O-CG2 3.42Å; F44-V48 PolarHBondContact O-N 2.95Å; F45-V48 PolarHBondContact O-N 3.11Å; V48-V51 PolarHBondContact O-N 3.2Å; V48-A52 VanDerWaalsContact O-CB 3.3Å; V48-A52 WeakPolarHBondContact O-CB 3.44Å; V48-A52 PolarHBondContact O-N 2.9Å; V48-L102 HydrophobicContact CG1-CD2 3.74Å; V48-L106 HydrophobicContact CG2-CB 4.06Å; V48-L106 HydrophobicContact CG2-CD1 3.91Å; V48-V109 HydrophobicContact CG1-CG2 4.29Å
49	T	85.1	Confident	84	Confident	47 Å²	47	62.4 Å²	62.4	29%	0.288	33%	0.33	S	S	.	.	H	α-helix	trans	-68	-35.8	178.8	49.8	0	0	0	0	112.5	F45 S46 E47 A52 K53 L102	F45-T49 HydrophobicContact CD1-CG2 3.97Å; F45-T49 HydrophobicContact CD2-CG2 4.47Å; F45-T49 HydrophobicContact CE1-CG2 3.39Å; F45-T49 HydrophobicContact CE2-CG2 3.98Å; F45-T49 HydrophobicContact CG-CG2 4.48Å; F45-T49 HydrophobicContact CZ-CG2 3.4Å; F45-T49 VanDerWaalsContact CZ-CG2 3.4Å; F45-T49 WeakPolarHBondContact O-CB 3.36Å; F45-T49 WeakPolarHBondContact O-CG2 3.39Å; F45-T49 PolarHBondContact O-N 3.03Å; F45-T49 PolarHBondContact O-OG1 3.42Å; S46-T49 WeakPolarHBondContact CA-OG1 3.26Å; S46-T49 PolarHBondContact O-OG1 3.22Å; S46-T49 VanDerWaalsContact O-OG1 3.06Å; E47-T49 PolarHBondContact O-N 2.96Å; T49-A52 PolarHBondContact O-N 3.06Å; T49-K53 WeakPolarHBondContact O-CB 3.41Å; T49-K53 PolarHBondContact O-N 3.46Å; T49-L102 HydrophobicContact CG2-CD2 4.4Å
50	S	85.9	Confident	85.1	Confident	68 Å²	68	60.3 Å²	60.3	48%	0.476	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-50.9	172.8	177.9	0	0	0	0	111.5	S46 E47 A52 K53 T54	S46-S50 VanDerWaalsContact O-CB 3.28Å; S46-S50 WeakPolarHBondContact O-CB 3.4Å; S46-S50 PolarHBondContact O-N 3.03Å; E47-S50 PolarHBondContact O-N 3.42Å; S50-A52 VanDerWaalsContact C-N 3.29Å; S50-A52 PolarHBondContact O-N 3.15Å; S50-K53 PolarHBondContact O-N 3.48Å; S50-T54 PolarHBondContact O-N 2.91Å; S50-T54 PolarHBondContact O-OG1 2.91Å
51	V	83.3	Confident	86	Confident	28 Å²	28	57.9 Å²	57.9	17%	0.17	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-39.5	177.6	177.9	0	0	0	0	111	E47 V48 K53 T54 A55 V109 N113	E47-V51 WeakPolarHBondContact O-CG2 3.35Å; E47-V51 PolarHBondContact O-N 3.18Å; V48-V51 PolarHBondContact O-N 3.2Å; V51-K53 PolarHBondContact O-N 3.45Å; V51-T54 PolarHBondContact O-N 3.31Å; V51-A55 VanDerWaalsContact O-CB 3.28Å; V51-A55 WeakPolarHBondContact O-CB 3.47Å; V51-A55 PolarHBondContact O-N 3.35Å; V51-V109 HydrophobicContact CB-CG1 3.95Å; V51-V109 HydrophobicContact CG1-CG1 3.48Å; V51-V109 VanDerWaalsContact CG1-CG1 3.48Å; V51-N113 HydrophobicContact CG1-CB 4.3Å
52	A	84.7	Confident	87	Confident	9 Å²	9	56 Å²	56	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-62.4	-42.4	176.7	0	0	0	0	0	112.7	V48 T49 S50 V56 I99	V48-A52 VanDerWaalsContact O-CB 3.3Å; V48-A52 WeakPolarHBondContact O-CB 3.44Å; V48-A52 PolarHBondContact O-N 2.9Å; T49-A52 PolarHBondContact O-N 3.06Å; S50-A52 VanDerWaalsContact C-N 3.29Å; S50-A52 PolarHBondContact O-N 3.15Å; A52-V56 VanDerWaalsContact O-CG2 3.28Å; A52-V56 WeakPolarHBondContact O-CG2 3.45Å; A52-V56 PolarHBondContact O-N 3.39Å; A52-I99 HydrophobicContact CB-CG2 3.73Å
53	K	88.2	Confident	88	Confident	133 Å²	133	52.7 Å²	52.7	58%	0.578	30%	0.299	S	S	*	.	H	α-helix	trans	-62.2	-51.2	176	-177.5	-177.7	172.4	-174.7	0	111	T49 S50 V51 A55 V56 E57	T49-K53 WeakPolarHBondContact O-CB 3.41Å; T49-K53 PolarHBondContact O-N 3.46Å; S50-K53 PolarHBondContact O-N 3.48Å; V51-K53 PolarHBondContact O-N 3.45Å; K53-A55 VanDerWaalsContact C-N 3.35Å; K53-A55 PolarHBondContact O-N 2.91Å; K53-V56 PolarHBondContact O-N 3.26Å; K53-V56 VanDerWaalsContact O-N 3.1Å; K53-E57 WeakPolarHBondContact CE-OE1 3.07Å; K53-E57 IonicContact NZ-OE1 2.81Å; K53-E57 PolarHBondContact O-N 2.88Å; K53-E57 VanDerWaalsContact O-N 3.1Å
54	T	88.5	Confident	89	Confident	71 Å²	71	54.9 Å²	54.9	44%	0.436	30%	0.303	S	S	.	.	H	α-helix	trans	-58.3	-46.5	178.2	-58.5	0	0	0	0	111.2	S50 V51 V56 E57 T58	S50-T54 PolarHBondContact O-N 2.91Å; S50-T54 PolarHBondContact O-OG1 2.91Å; V51-T54 PolarHBondContact O-N 3.31Å; T54-V56 VanDerWaalsContact C-N 3.25Å; T54-V56 PolarHBondContact O-N 3.29Å; T54-E57 PolarHBondContact O-N 3.19Å; T54-T58 WeakPolarHBondContact O-CB 3.15Å; T54-T58 PolarHBondContact O-N 2.83Å; T54-T58 PolarHBondContact O-OG1 2.89Å
55	A	88.1	Confident	89.9	Confident	2 Å²	2	54.8 Å²	54.8	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-36.3	177.5	0	0	0	0	0	112.5	V51 K53 V59 I99	V51-A55 VanDerWaalsContact O-CB 3.28Å; V51-A55 WeakPolarHBondContact O-CB 3.47Å; V51-A55 PolarHBondContact O-N 3.35Å; K53-A55 VanDerWaalsContact C-N 3.35Å; K53-A55 PolarHBondContact O-N 2.91Å; A55-V59 WeakPolarHBondContact O-CB 3.5Å; A55-V59 WeakPolarHBondContact O-CG2 3.34Å; A55-V59 PolarHBondContact O-N 2.9Å; A55-I99 HydrophobicContact CB-CD1 4.01Å; A55-I99 HydrophobicContact CB-CG2 4.47Å
56	V	91.2	Very high	90.8	Very high	49 Å²	49	51.9 Å²	51.9	30%	0.297	29%	0.291	S	S	.	.	H	α-helix	trans	-67	-48.5	177.5	169.3	0	0	0	0	111.9	A52 K53 T54 S60 R96 T100	A52-V56 VanDerWaalsContact O-CG2 3.28Å; A52-V56 WeakPolarHBondContact O-CG2 3.45Å; A52-V56 PolarHBondContact O-N 3.39Å; K53-V56 PolarHBondContact O-N 3.26Å; K53-V56 VanDerWaalsContact O-N 3.1Å; T54-V56 VanDerWaalsContact C-N 3.25Å; T54-V56 PolarHBondContact O-N 3.29Å; V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.36Å; V56-S60 PolarHBondContact O-N 3.43Å; V56-S60 VanDerWaalsContact O-N 3.09Å; V56-S60 PolarHBondContact O-OG 3.33Å; V56-R96 HydrophobicContact CG2-CG 3.93Å; V56-T100 HydrophobicContact CG2-CG2 4.49Å; V56-T100 WeakPolarHBondContact CG2-OG1 3.47Å
57	E	92.7	Very high	91.6	Very high	112 Å²	112	57 Å²	57	52%	0.523	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-51.2	-179.2	-69.2	169.5	179.1	0	0	110.6	K53 T54 S60 S61	K53-E57 WeakPolarHBondContact CE-OE1 3.07Å; K53-E57 IonicContact NZ-OE1 2.81Å; K53-E57 PolarHBondContact O-N 2.88Å; K53-E57 VanDerWaalsContact O-N 3.1Å; T54-E57 PolarHBondContact O-N 3.19Å; E57-S60 PolarHBondContact O-N 3.48Å; E57-S61 PolarHBondContact O-N 3.04Å
58	T	92.2	Very high	92.3	Very high	65 Å²	65	60.2 Å²	60.2	40%	0.399	32%	0.315	S	S	.	.	H	α-helix	trans	-60.3	-51.7	-179.8	-57.1	0	0	0	0	111.8	T54 S60 S61 I62	T54-T58 WeakPolarHBondContact O-CB 3.15Å; T54-T58 PolarHBondContact O-N 2.83Å; T54-T58 PolarHBondContact O-OG1 2.89Å; T58-S60 VanDerWaalsContact C-N 3.28Å; T58-S60 PolarHBondContact O-N 3.19Å; T58-S61 PolarHBondContact O-N 3.39Å; T58-I62 HydrophobicContact CG2-CG1 4.35Å; T58-I62 WeakPolarHBondContact O-CG1 3.43Å; T58-I62 PolarHBondContact O-N 3.22Å
59	V	96.3	Very high	93	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-63.8	-36.6	-178.5	169.9	0	0	0	0	111.3	A55 I62 V63 I92 I93 R96 I116	A55-V59 WeakPolarHBondContact O-CB 3.5Å; A55-V59 WeakPolarHBondContact O-CG2 3.34Å; A55-V59 PolarHBondContact O-N 2.9Å; V59-I62 PolarHBondContact O-N 2.9Å; V59-V63 HydrophobicContact CG1-CG2 4.24Å; V59-V63 WeakPolarHBondContact O-CB 3.35Å; V59-V63 VanDerWaalsContact O-CG2 3.23Å; V59-V63 WeakPolarHBondContact O-CG2 3.26Å; V59-V63 PolarHBondContact O-N 3.27Å; V59-I92 HydrophobicContact CG1-CB 4.39Å; V59-I92 HydrophobicContact CG1-CD1 4.31Å; V59-I92 HydrophobicContact CG1-CG1 4.08Å; V59-I93 HydrophobicContact CG1-CG1 4.38Å; V59-R96 HydrophobicContact CB-CB 4.26Å; V59-R96 HydrophobicContact CB-CG 4.29Å; V59-R96 HydrophobicContact CG1-CB 4.11Å; V59-R96 HydrophobicContact CG1-CG 4.47Å; V59-R96 HydrophobicContact CG2-CB 4.18Å; V59-I116 HydrophobicContact CG2-CD1 4.38Å; V59-I116 HydrophobicContact CG2-CG2 3.7Å
60	S	97.1	Very high	93.5	Very high	47 Å²	47	60 Å²	60	33%	0.329	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-41.1	177.2	-55.5	0	0	0	0	111.4	V56 E57 T58 M64 R96	V56-S60 VanDerWaalsContact O-CB 3.27Å; V56-S60 WeakPolarHBondContact O-CB 3.36Å; V56-S60 PolarHBondContact O-N 3.43Å; V56-S60 VanDerWaalsContact O-N 3.09Å; V56-S60 PolarHBondContact O-OG 3.33Å; E57-S60 PolarHBondContact O-N 3.48Å; T58-S60 VanDerWaalsContact C-N 3.28Å; T58-S60 PolarHBondContact O-N 3.19Å; S60-M64 VanDerWaalsContact O-CG 3.25Å; S60-M64 WeakPolarHBondContact O-CG 3.47Å; S60-M64 PolarHBondContact O-N 2.93Å; S60-M64 VanDerWaalsContact O-N 3.17Å; S60-R96 PolarHBondContact OG-NH1 2.96Å
61	S	96.8	Very high	94	Very high	75 Å²	75	62.1 Å²	62.1	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-50	175	-168.9	0	0	0	0	111.8	E57 T58 V63 M64 E65	E57-S61 PolarHBondContact O-N 3.04Å; T58-S61 PolarHBondContact O-N 3.39Å; S61-V63 PolarHBondContact O-N 2.91Å; S61-M64 PolarHBondContact O-N 3Å; S61-M64 VanDerWaalsContact O-N 3.16Å; S61-E65 PolarHBondContact O-N 2.92Å
62	I	97.6	Very high	94.7	Very high	19 Å²	19	63.3 Å²	63.3	10%	0.097	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-43.9	-178.9	-66.1	-62.2	0	0	0	111.8	T58 V59 M64 E65 W66 I92 V120	T58-I62 HydrophobicContact CG2-CG1 4.35Å; T58-I62 WeakPolarHBondContact O-CG1 3.43Å; T58-I62 PolarHBondContact O-N 3.22Å; V59-I62 PolarHBondContact O-N 2.9Å; I62-M64 VanDerWaalsContact C-N 3.29Å; I62-M64 PolarHBondContact O-N 3.23Å; I62-E65 PolarHBondContact O-N 3.46Å; I62-W66 HydrophobicContact CG2-CD2 3.78Å; I62-W66 VanDerWaalsContact CG2-CE2 3.44Å; I62-W66 HydrophobicContact CG2-CE3 4.33Å; I62-W66 HydrophobicContact CG2-CG 4.17Å; I62-W66 HydrophobicContact CG2-CH2 4.29Å; I62-W66 HydrophobicContact CG2-CZ2 3.73Å; I62-W66 WeakPolarHBondContact O-CB 3.43Å; I62-W66 PolarHBondContact O-N 3.49Å; I62-I92 HydrophobicContact CG2-CD1 4.14Å; I62-V120 HydrophobicContact CD1-CG1 3.81Å; I62-V120 HydrophobicContact CG1-CG1 3.99Å; I62-V120 HydrophobicContact CG1-CG2 4.39Å; I62-V120 HydrophobicContact CG2-CG1 4.06Å; I62-V120 HydrophobicContact CG2-CG2 4.02Å
63	V	98	Very high	95.3	Very high	26 Å²	26	63.8 Å²	63.8	16%	0.158	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-40.1	177.6	168.9	0	0	0	0	111.2	V59 S61 R67 M89 I92 I93	V59-V63 HydrophobicContact CG1-CG2 4.24Å; V59-V63 WeakPolarHBondContact O-CB 3.35Å; V59-V63 VanDerWaalsContact O-CG2 3.23Å; V59-V63 WeakPolarHBondContact O-CG2 3.26Å; V59-V63 PolarHBondContact O-N 3.27Å; S61-V63 PolarHBondContact O-N 2.91Å; V63-R67 WeakPolarHBondContact O-CB 3.44Å; V63-R67 PolarHBondContact O-N 3.21Å; V63-M89 HydrophobicContact CG1-SD 4.33Å; V63-M89 HydrophobicContact CG2-CB 4.44Å; V63-M89 HydrophobicContact CG2-CG 4.42Å; V63-I92 HydrophobicContact CG2-CD1 3.91Å; V63-I92 HydrophobicContact CG2-CG1 4.27Å; V63-I93 HydrophobicContact CG1-CD1 4.23Å; V63-I93 HydrophobicContact CG2-CD1 3.96Å; V63-I93 HydrophobicContact CG2-CG1 3.87Å
64	M	98	Very high	95.6	Very high	119 Å²	119	66 Å²	66	59%	0.586	33%	0.329	S	S	*	.	H	α-helix	trans	-67.2	-41.3	177.8	-73.2	-62.4	-62.2	0	0	112.1	S60 S61 I62 R67 K68	S60-M64 VanDerWaalsContact O-CG 3.25Å; S60-M64 WeakPolarHBondContact O-CG 3.47Å; S60-M64 PolarHBondContact O-N 2.93Å; S60-M64 VanDerWaalsContact O-N 3.17Å; S61-M64 PolarHBondContact O-N 3Å; S61-M64 VanDerWaalsContact O-N 3.16Å; I62-M64 VanDerWaalsContact C-N 3.29Å; I62-M64 PolarHBondContact O-N 3.23Å; M64-R67 PolarHBondContact O-N 3.28Å; M64-K68 PolarHBondContact O-N 3.08Å; M64-K68 VanDerWaalsContact O-N 3.1Å
65	E	97.9	Very high	95.9	Very high	83 Å²	83	68.8 Å²	68.8	39%	0.388	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-53.7	176.4	-178.2	175.5	-169.4	0	0	111.6	S61 I62 R67 K68 I69	S61-E65 PolarHBondContact O-N 2.92Å; I62-E65 PolarHBondContact O-N 3.46Å; E65-R67 PolarHBondContact O-N 3.16Å; E65-K68 WeakPolarHBondContact O-CA 3.36Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.47Å; E65-I69 HydrophobicContact CG-CD1 4.27Å; E65-I69 WeakPolarHBondContact O-CG1 3.36Å; E65-I69 PolarHBondContact O-N 3.44Å
66	W	98.3	Very high	96.3	Very high	0 Å²	0	76.1 Å²	76.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.2	-36.6	178.3	-69.8	3.9	0	0	0	112	I62 K68 I69 C70 V85 M88 M89 I92 V120 N124 L127	I62-W66 HydrophobicContact CG2-CD2 3.78Å; I62-W66 VanDerWaalsContact CG2-CE2 3.44Å; I62-W66 HydrophobicContact CG2-CE3 4.33Å; I62-W66 HydrophobicContact CG2-CG 4.17Å; I62-W66 HydrophobicContact CG2-CH2 4.29Å; I62-W66 HydrophobicContact CG2-CZ2 3.73Å; I62-W66 WeakPolarHBondContact O-CB 3.43Å; I62-W66 PolarHBondContact O-N 3.49Å; W66-K68 VanDerWaalsContact C-N 3.31Å; W66-K68 PolarHBondContact O-N 3Å; W66-I69 PolarHBondContact O-N 3.27Å; W66-C70 PolarHBondContact O-N 2.9Å; W66-C70 PolarHBondContact O-SG 3.08Å; W66-V85 HydrophobicContact CB-CG1 4.44Å; W66-V85 HydrophobicContact CE3-CG1 4.21Å; W66-M88 HydrophobicContact CH2-CB 4.47Å; W66-M88 HydrophobicContact CH2-CE 4.25Å; W66-M88 HydrophobicContact CZ3-CB 3.86Å; W66-M89 VanDerWaalsContact C-CE 3.46Å; W66-M89 HydrophobicContact CB-CE 3.24Å; W66-M89 HydrophobicContact CE3-CE 4.39Å; W66-M89 HydrophobicContact CE3-CG 3.78Å; W66-M89 HydrophobicContact CG-CE 4.41Å; W66-M89 HydrophobicContact CZ3-CG 4.4Å; W66-I92 HydrophobicContact CH2-CD1 4.36Å; W66-I92 HydrophobicContact CZ3-CD1 4.02Å; W66-V120 HydrophobicContact CZ2-CB 4.38Å; W66-V120 HydrophobicContact CZ2-CG1 4.25Å; W66-V120 WeakPolarHBondContact CZ2-O 3.27Å; W66-N124 PolarHBondContact NE1-OD1 2.98Å; W66-L127 HydrophobicContact CB-CD1 3.79Å; W66-L127 HydrophobicContact CD2-CD1 3.65Å; W66-L127 HydrophobicContact CE3-CD1 4.45Å; W66-L127 HydrophobicContact CG-CD1 3.3Å
67	R	97.7	Very high	96.2	Very high	158 Å²	158	76.8 Å²	76.8	60%	0.596	38%	0.378	S	S	*	.	H	α-helix	trans	-60.5	-43.1	174.6	-177.2	-176.7	-158.2	164.5	7	111.3	V63 M64 E65 C70 Q71 M89	V63-R67 WeakPolarHBondContact O-CB 3.44Å; V63-R67 PolarHBondContact O-N 3.21Å; M64-R67 PolarHBondContact O-N 3.28Å; E65-R67 PolarHBondContact O-N 3.16Å; R67-C70 PolarHBondContact O-N 2.9Å; R67-Q71 WeakPolarHBondContact O-CB 3.39Å; R67-Q71 PolarHBondContact O-N 3.39Å; R67-M89 HydrophobicContact CB-CE 4.31Å; R67-M89 VanDerWaalsContact N-CE 3.33Å
68	K	97.8	Very high	96.1	Very high	147 Å²	147	74 Å²	74	64%	0.639	38%	0.379	S	S	*	.	H	α-helix	trans	-63.5	-44.6	177.5	-173.1	-176.7	177.1	-172.5	0	111	M64 E65 W66 Q71 T72	M64-K68 PolarHBondContact O-N 3.08Å; M64-K68 VanDerWaalsContact O-N 3.1Å; E65-K68 WeakPolarHBondContact O-CA 3.36Å; E65-K68 WeakPolarHBondContact O-CB 3.42Å; E65-K68 PolarHBondContact O-N 3.47Å; W66-K68 VanDerWaalsContact C-N 3.31Å; W66-K68 PolarHBondContact O-N 3Å; K68-Q71 PolarHBondContact O-N 3.31Å; K68-T72 PolarHBondContact O-N 3.29Å; K68-T72 PolarHBondContact O-OG1 3.45Å; K68-T72 VanDerWaalsContact O-OG1 3.09Å
69	I	97.3	Very high	96.2	Very high	45 Å²	45	76.1 Å²	76.1	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-50.1	176.5	-62.2	169.7	0	0	0	110.4	E65 W66 Q71 T72 D73 L80 L127 A129	E65-I69 HydrophobicContact CG-CD1 4.27Å; E65-I69 WeakPolarHBondContact O-CG1 3.36Å; E65-I69 PolarHBondContact O-N 3.44Å; W66-I69 PolarHBondContact O-N 3.27Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 3.48Å; I69-T72 PolarHBondContact O-N 3.35Å; I69-D73 WeakPolarHBondContact O-CB 3.41Å; I69-D73 PolarHBondContact O-N 3.37Å; I69-L80 HydrophobicContact CG2-CD1 3.99Å; I69-L127 HydrophobicContact CD1-CB 4.22Å; I69-L127 HydrophobicContact CD1-CD1 4.46Å; I69-L127 HydrophobicContact CG2-CB 4.31Å; I69-L127 HydrophobicContact CG2-CD2 3.97Å; I69-A129 HydrophobicContact CD1-CB 4.25Å
70	C	96.8	Very high	96.1	Very high	4 Å²	4	78.1 Å²	78.1	3%	0.027	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-39.3	177.8	-67.8	0	0	0	0	112.9	W66 R67 Y74 I82 V85 F86	W66-C70 PolarHBondContact O-N 2.9Å; W66-C70 PolarHBondContact O-SG 3.08Å; R67-C70 PolarHBondContact O-N 2.9Å; C70-Y74 WeakPolarHBondContact O-CB 3.5Å; C70-Y74 PolarHBondContact O-N 2.89Å; C70-I82 HydrophobicContact CB-CG1 4.44Å; C70-I82 HydrophobicContact CB-CG2 4.48Å; C70-V85 VanDerWaalsContact SG-CG1 3.59Å; C70-F86 HydrophobicContact CB-CE1 4.47Å
71	Q	96.6	Very high	96	Very high	111 Å²	111	80.1 Å²	80.1	52%	0.519	41%	0.409	S	S	.	.	H	α-helix	trans	-64.3	-48.3	177.2	-179.6	179.4	1	0	0	111.2	R67 K68 I69 D73 Y74 E75	R67-Q71 WeakPolarHBondContact O-CB 3.39Å; R67-Q71 PolarHBondContact O-N 3.39Å; K68-Q71 PolarHBondContact O-N 3.31Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 3.48Å; Q71-D73 VanDerWaalsContact C-N 3.31Å; Q71-D73 PolarHBondContact O-N 2.98Å; Q71-Y74 PolarHBondContact O-N 2.91Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.12Å; Q71-E75 PolarHBondContact NE2-OE1 3.3Å; Q71-E75 WeakPolarHBondContact O-CG 3.32Å; Q71-E75 PolarHBondContact O-N 3.44Å; Q71-E75 VanDerWaalsContact O-N 3.15Å
72	T	97.1	Very high	95.9	Very high	54 Å²	54	78 Å²	78	33%	0.331	39%	0.392	S	S	.	.	H	α-helix	trans	-60.8	-42.4	178.2	-61.2	0	0	0	0	111.2	K68 I69 E75 Q76	K68-T72 PolarHBondContact O-N 3.29Å; K68-T72 PolarHBondContact O-OG1 3.45Å; K68-T72 VanDerWaalsContact O-OG1 3.09Å; I69-T72 PolarHBondContact O-N 3.35Å; T72-E75 PolarHBondContact O-N 2.97Å; T72-Q76 WeakPolarHBondContact O-CB 3.48Å; T72-Q76 VanDerWaalsContact O-CG 3.28Å; T72-Q76 WeakPolarHBondContact O-CG 3.46Å; T72-Q76 PolarHBondContact O-N 2.97Å
73	D	96.4	Very high	95.8	Very high	19 Å²	19	84 Å²	84	10%	0.102	42%	0.419	C	S	.	.	H	α-helix	trans	-64.4	-43.6	177.3	-175.3	64.3	0	0	0	112.6	I69 Q71 E75 Q76 S77 G78 T79 L80	I69-D73 WeakPolarHBondContact O-CB 3.41Å; I69-D73 PolarHBondContact O-N 3.37Å; Q71-D73 VanDerWaalsContact C-N 3.31Å; Q71-D73 PolarHBondContact O-N 2.98Å; D73-E75 PolarHBondContact O-N 3.31Å; D73-Q76 PolarHBondContact O-N 3.22Å; D73-Q76 VanDerWaalsContact O-N 3.11Å; D73-S77 PolarHBondContact O-N 2.91Å; D73-S77 PolarHBondContact OD1-OG 3.44Å; D73-G78 PolarHBondContact O-N 3.49Å; D73-T79 PolarHBondContact OD2-N 3.26Å; D73-T79 VanDerWaalsContact OD2-N 3.12Å; D73-L80 HydrophobicContact CB-CB 4.44Å; D73-L80 HydrophobicContact CB-CD1 3.48Å; D73-L80 VanDerWaalsContact CB-CD1 3.48Å; D73-L80 HydrophobicContact CB-CG 3.92Å; D73-L80 VanDerWaalsContact CG-CG 3.44Å; D73-L80 VanDerWaalsContact OD2-CB 3.26Å; D73-L80 WeakPolarHBondContact OD2-CB 3.42Å; D73-L80 WeakPolarHBondContact OD2-CG 3.33Å; D73-L80 PolarHBondContact OD2-N 3.36Å
74	Y	94.9	Very high	95.7	Very high	179 Å²	179	85.5 Å²	85.5	70%	0.702	43%	0.429	S	S	*	.	H	α-helix	trans	-59.2	-35.6	177.7	-179.4	-95.1	0	0	0	112.7	C70 Q71 I82	C70-Y74 WeakPolarHBondContact O-CB 3.5Å; C70-Y74 PolarHBondContact O-N 2.89Å; Q71-Y74 PolarHBondContact O-N 2.91Å; Y74-I82 HydrophobicContact CD2-CD1 4.17Å
75	E	95.8	Very high	95.7	Very high	130 Å²	130	80 Å²	80	61%	0.607	40%	0.402	S	S	*	.	H	α-helix	trans	-78.1	-21.9	179.1	-69.7	169.9	-168.1	0	0	113.1	Q71 T72 D73	Q71-E75 WeakPolarHBondContact CG-OE1 3.12Å; Q71-E75 PolarHBondContact NE2-OE1 3.3Å; Q71-E75 WeakPolarHBondContact O-CG 3.32Å; Q71-E75 PolarHBondContact O-N 3.44Å; Q71-E75 VanDerWaalsContact O-N 3.15Å; T72-E75 PolarHBondContact O-N 2.97Å; D73-E75 PolarHBondContact O-N 3.31Å
76	Q	95	Very high	95.6	Very high	155 Å²	155	79.9 Å²	79.9	72%	0.724	40%	0.4	S	S	*	.	H	α-helix	trans	-113.8	-54.9	-169.1	-66.8	177.8	4.8	0	0	114.2	T72 D73	T72-Q76 WeakPolarHBondContact O-CB 3.48Å; T72-Q76 VanDerWaalsContact O-CG 3.28Å; T72-Q76 WeakPolarHBondContact O-CG 3.46Å; T72-Q76 PolarHBondContact O-N 2.97Å; D73-Q76 PolarHBondContact O-N 3.22Å; D73-Q76 VanDerWaalsContact O-N 3.11Å
77	S	91	Very high	95.6	Very high	64 Å²	64	81.2 Å²	81.2	45%	0.448	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-36.3	-167.8	100.3	0	0	0	0	113	D73 T79	D73-S77 PolarHBondContact O-N 2.91Å; D73-S77 PolarHBondContact OD1-OG 3.44Å; S77-T79 PolarHBondContact O-N 3.27Å; S77-T79 WeakPolarHBondContact OG-CB 3.4Å; S77-T79 WeakPolarHBondContact OG-CG2 3.33Å; S77-T79 PolarHBondContact OG-N 2.91Å; S77-T79 PolarHBondContact OG-OG1 3.12Å
78	G	90.3	Very high	95.6	Very high	52 Å²	52	74.3 Å²	74.3	54%	0.536	39%	0.389	S	S	.	.			trans	60.4	29.7	-176.2	0	0	0	0	0	113.5	D73	D73-G78 PolarHBondContact O-N 3.49Å
79	T	93.7	Very high	95.6	Very high	111 Å²	111	68 Å²	68	68%	0.681	36%	0.362	S	S	*	.			trans	-95.1	-19.4	-174.8	59.7	0	0	0	0	113.5	D73 S77	D73-T79 PolarHBondContact OD2-N 3.26Å; D73-T79 VanDerWaalsContact OD2-N 3.12Å; S77-T79 PolarHBondContact O-N 3.27Å; S77-T79 WeakPolarHBondContact OG-CB 3.4Å; S77-T79 WeakPolarHBondContact OG-CG2 3.33Å; S77-T79 PolarHBondContact OG-N 2.91Å; S77-T79 PolarHBondContact OG-OG1 3.12Å
80	L	94.8	Very high	95.7	Very high	43 Å²	43	73 Å²	73	23%	0.225	38%	0.382	C	S	.	.	S	Bend	trans	-73	142.2	178.8	-65.7	177.6	0	0	0	111.5	I69 D73 I82 L127	I69-L80 HydrophobicContact CG2-CD1 3.99Å; D73-L80 HydrophobicContact CB-CB 4.44Å; D73-L80 HydrophobicContact CB-CD1 3.48Å; D73-L80 VanDerWaalsContact CB-CD1 3.48Å; D73-L80 HydrophobicContact CB-CG 3.92Å; D73-L80 VanDerWaalsContact CG-CG 3.44Å; D73-L80 VanDerWaalsContact OD2-CB 3.26Å; D73-L80 WeakPolarHBondContact OD2-CB 3.42Å; D73-L80 WeakPolarHBondContact OD2-CG 3.33Å; D73-L80 PolarHBondContact OD2-N 3.36Å; L80-I82 HydrophobicContact CB-CG1 4.37Å; L80-I82 PolarHBondContact O-N 2.97Å; L80-L127 HydrophobicContact CD1-CD2 3.8Å; L80-L127 HydrophobicContact CD2-CD2 4.48Å
81	D	95	Very high	95.7	Very high	89 Å²	89	76.5 Å²	76.5	48%	0.476	40%	0.398	S	S	.	.			trans	-75.6	80.8	165.6	-175.9	-4.4	0	0	0	110.4	Q83 T84 V85	D81-Q83 PolarHBondContact O-N 3.29Å; D81-Q83 PolarHBondContact OD1-N 2.95Å; D81-T84 PolarHBondContact O-N 2.78Å; D81-T84 PolarHBondContact OD1-N 3.23Å; D81-T84 VanDerWaalsContact OD1-N 3.08Å; D81-T84 VanDerWaalsContact OD2-CB 3.3Å; D81-T84 WeakPolarHBondContact OD2-CB 3.2Å; D81-T84 PolarHBondContact OD2-OG1 2.87Å; D81-V85 WeakPolarHBondContact O-CG2 3.44Å; D81-V85 PolarHBondContact O-N 3.29Å; D81-V85 VanDerWaalsContact O-N 3.15Å
82	I	94.3	Very high	95.8	Very high	31 Å²	31	71.2 Å²	71.2	16%	0.159	37%	0.373	C	S	.	.	H	α-helix	trans	-60.2	-31.9	-178.4	-62.3	173.1	0	0	0	111.5	C70 Y74 L80 V85 F86	C70-I82 HydrophobicContact CB-CG1 4.44Å; C70-I82 HydrophobicContact CB-CG2 4.48Å; Y74-I82 HydrophobicContact CD2-CD1 4.17Å; L80-I82 HydrophobicContact CB-CG1 4.37Å; L80-I82 PolarHBondContact O-N 2.97Å; I82-V85 PolarHBondContact O-N 3.15Å; I82-F86 HydrophobicContact CG2-CD1 4.24Å; I82-F86 HydrophobicContact CG2-CD2 3.79Å; I82-F86 HydrophobicContact CG2-CE1 3.93Å; I82-F86 HydrophobicContact CG2-CE2 3.44Å; I82-F86 VanDerWaalsContact CG2-CE2 3.44Å; I82-F86 HydrophobicContact CG2-CG 4.19Å; I82-F86 HydrophobicContact CG2-CZ 3.52Å; I82-F86 WeakPolarHBondContact O-CB 3.32Å; I82-F86 WeakPolarHBondContact O-CG 3.42Å; I82-F86 PolarHBondContact O-N 3.36Å
83	Q	95.6	Very high	95.8	Very high	143 Å²	143	71.6 Å²	71.6	67%	0.668	37%	0.372	S	S	*	.	H	α-helix	trans	-67.7	-43.2	-180	-67.6	-58	-37.4	0	0	111.2	D81 F86 G87	D81-Q83 PolarHBondContact O-N 3.29Å; D81-Q83 PolarHBondContact OD1-N 2.95Å; Q83-F86 PolarHBondContact O-N 3.47Å; Q83-G87 PolarHBondContact O-N 3.11Å
84	T	96.1	Very high	95.9	Very high	58 Å²	58	75 Å²	75	36%	0.356	39%	0.391	S	S	.	.	H	α-helix	trans	-61.6	-45.5	174.2	-67.5	0	0	0	0	111	D81 F86 G87 M88 M126	D81-T84 PolarHBondContact O-N 2.78Å; D81-T84 PolarHBondContact OD1-N 3.23Å; D81-T84 VanDerWaalsContact OD1-N 3.08Å; D81-T84 VanDerWaalsContact OD2-CB 3.3Å; D81-T84 WeakPolarHBondContact OD2-CB 3.2Å; D81-T84 PolarHBondContact OD2-OG1 2.87Å; T84-F86 PolarHBondContact O-N 3.37Å; T84-G87 WeakPolarHBondContact O-CA 3.33Å; T84-G87 PolarHBondContact O-N 2.82Å; T84-G87 VanDerWaalsContact O-N 3.11Å; T84-M88 HydrophobicContact CG2-SD 4.26Å; T84-M88 WeakPolarHBondContact O-CG 3.24Å; T84-M88 PolarHBondContact O-N 2.54Å; T84-M126 HydrophobicContact CG2-CE 3.74Å
85	V	96.6	Very high	96	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.03	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-43.5	178.3	178.5	0	0	0	0	111.8	W66 C70 D81 I82 G87 M88 M89 L127	W66-V85 HydrophobicContact CB-CG1 4.44Å; W66-V85 HydrophobicContact CE3-CG1 4.21Å; C70-V85 VanDerWaalsContact SG-CG1 3.59Å; D81-V85 WeakPolarHBondContact O-CG2 3.44Å; D81-V85 PolarHBondContact O-N 3.29Å; D81-V85 VanDerWaalsContact O-N 3.15Å; I82-V85 PolarHBondContact O-N 3.15Å; V85-G87 VanDerWaalsContact C-N 3.32Å; V85-G87 PolarHBondContact O-N 3.44Å; V85-M88 WeakPolarHBondContact O-CB 3.34Å; V85-M88 PolarHBondContact O-N 2.88Å; V85-M89 HydrophobicContact CG1-CE 3.87Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.14Å; V85-L127 HydrophobicContact CG1-CD1 4.12Å; V85-L127 HydrophobicContact CG1-CD2 4.22Å; V85-L127 HydrophobicContact CG2-CD2 3.73Å; V85-L127 HydrophobicContact CG2-CG 4.31Å
86	F	96.9	Very high	96	Very high	79 Å²	79	64.3 Å²	64.3	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-65.6	-33.5	174.8	-73.4	-10.5	0	0	0	113	C70 I82 Q83 T84 M89 K90	C70-F86 HydrophobicContact CB-CE1 4.47Å; I82-F86 HydrophobicContact CG2-CD1 4.24Å; I82-F86 HydrophobicContact CG2-CD2 3.79Å; I82-F86 HydrophobicContact CG2-CE1 3.93Å; I82-F86 HydrophobicContact CG2-CE2 3.44Å; I82-F86 VanDerWaalsContact CG2-CE2 3.44Å; I82-F86 HydrophobicContact CG2-CG 4.19Å; I82-F86 HydrophobicContact CG2-CZ 3.52Å; I82-F86 WeakPolarHBondContact O-CB 3.32Å; I82-F86 WeakPolarHBondContact O-CG 3.42Å; I82-F86 PolarHBondContact O-N 3.36Å; Q83-F86 PolarHBondContact O-N 3.47Å; T84-F86 PolarHBondContact O-N 3.37Å; F86-M89 HydrophobicContact CD1-CE 4.12Å; F86-M89 HydrophobicContact CD1-SD 3.68Å; F86-M89 HydrophobicContact CE1-CE 4.25Å; F86-M89 HydrophobicContact CE1-SD 4.16Å; F86-M89 PolarHBondContact O-N 3.31Å; F86-K90 WeakPolarHBondContact O-CG 3.36Å; F86-K90 PolarHBondContact O-N 3.32Å
87	G	97.9	Very high	96	Very high	29 Å²	29	60.1 Å²	60.1	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-57.9	-49.5	169.1	0	0	0	0	0	111.4	Q83 T84 V85 M89 K90 E91	Q83-G87 PolarHBondContact O-N 3.11Å; T84-G87 WeakPolarHBondContact O-CA 3.33Å; T84-G87 PolarHBondContact O-N 2.82Å; T84-G87 VanDerWaalsContact O-N 3.11Å; V85-G87 VanDerWaalsContact C-N 3.32Å; V85-G87 PolarHBondContact O-N 3.44Å; G87-M89 PolarHBondContact O-N 3.17Å; G87-K90 WeakPolarHBondContact O-CB 3.18Å; G87-K90 PolarHBondContact O-N 3.46Å; G87-E91 WeakPolarHBondContact O-CG 3.49Å; G87-E91 PolarHBondContact O-N 3.04Å
88	M	97.9	Very high	96.1	Very high	12 Å²	12	60.5 Å²	60.5	6%	0.059	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-42.4	178	-61.8	171.8	73.9	0	0	112.2	W66 T84 V85 K90 E91 I92 K119 V122 M126	W66-M88 HydrophobicContact CH2-CB 4.47Å; W66-M88 HydrophobicContact CH2-CE 4.25Å; W66-M88 HydrophobicContact CZ3-CB 3.86Å; T84-M88 HydrophobicContact CG2-SD 4.26Å; T84-M88 WeakPolarHBondContact O-CG 3.24Å; T84-M88 PolarHBondContact O-N 2.54Å; V85-M88 WeakPolarHBondContact O-CB 3.34Å; V85-M88 PolarHBondContact O-N 2.88Å; M88-K90 VanDerWaalsContact C-N 3.34Å; M88-K90 PolarHBondContact O-N 3.09Å; M88-E91 WeakPolarHBondContact O-CB 3.26Å; M88-E91 PolarHBondContact O-N 3.42Å; M88-I92 WeakPolarHBondContact O-CG1 3.32Å; M88-I92 PolarHBondContact O-N 3.48Å; M88-K119 HydrophobicContact CB-CD 4.36Å; M88-K119 HydrophobicContact CE-CD 3.7Å; M88-K119 HydrophobicContact CE-CG 4.22Å; M88-K119 WeakPolarHBondContact CE-O 3.36Å; M88-K119 HydrophobicContact CG-CD 4.12Å; M88-V122 HydrophobicContact CE-CB 4.25Å; M88-V122 HydrophobicContact CE-CG1 4Å; M88-M126 HydrophobicContact CE-SD 4.33Å; M88-M126 HydrophobicContact SD-CE 4.49Å; M88-M126 HydrophobicContact SD-SD 3.91Å
89	M	98.4	Very high	96.1	Very high	14 Å²	14	58 Å²	58	7%	0.069	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-45.7	174	-70.6	177.3	-175.5	0	0	111.8	V63 W66 R67 V85 F86 G87 E91 I92 I93	V63-M89 HydrophobicContact CG1-SD 4.33Å; V63-M89 HydrophobicContact CG2-CB 4.44Å; V63-M89 HydrophobicContact CG2-CG 4.42Å; W66-M89 VanDerWaalsContact C-CE 3.46Å; W66-M89 HydrophobicContact CB-CE 3.24Å; W66-M89 HydrophobicContact CE3-CE 4.39Å; W66-M89 HydrophobicContact CE3-CG 3.78Å; W66-M89 HydrophobicContact CG-CE 4.41Å; W66-M89 HydrophobicContact CZ3-CG 4.4Å; R67-M89 HydrophobicContact CB-CE 4.31Å; R67-M89 VanDerWaalsContact N-CE 3.33Å; V85-M89 HydrophobicContact CG1-CE 3.87Å; V85-M89 WeakPolarHBondContact O-CG 3.41Å; V85-M89 PolarHBondContact O-N 3.14Å; F86-M89 HydrophobicContact CD1-CE 4.12Å; F86-M89 HydrophobicContact CD1-SD 3.68Å; F86-M89 HydrophobicContact CE1-CE 4.25Å; F86-M89 HydrophobicContact CE1-SD 4.16Å; F86-M89 PolarHBondContact O-N 3.31Å; G87-M89 PolarHBondContact O-N 3.17Å; M89-E91 VanDerWaalsContact C-N 3.32Å; M89-E91 PolarHBondContact O-N 3.47Å; M89-I92 VanDerWaalsContact O-CG1 3.26Å; M89-I92 WeakPolarHBondContact O-CG1 3.41Å; M89-I92 PolarHBondContact O-N 2.88Å; M89-I93 WeakPolarHBondContact O-CB 3.36Å; M89-I93 WeakPolarHBondContact O-CD1 3.35Å; M89-I93 WeakPolarHBondContact O-CG1 3.43Å; M89-I93 PolarHBondContact O-N 3.29Å
90	K	98.3	Very high	95.9	Very high	151 Å²	151	56.1 Å²	56.1	66%	0.657	29%	0.289	S	S	*	.	H	α-helix	trans	-61.6	-41.7	178	-73.2	171.9	-176	174.1	0	111.4	F86 G87 M88 N94	F86-K90 WeakPolarHBondContact O-CG 3.36Å; F86-K90 PolarHBondContact O-N 3.32Å; G87-K90 WeakPolarHBondContact O-CB 3.18Å; G87-K90 PolarHBondContact O-N 3.46Å; M88-K90 VanDerWaalsContact C-N 3.34Å; M88-K90 PolarHBondContact O-N 3.09Å; K90-N94 VanDerWaalsContact O-CB 3.29Å; K90-N94 WeakPolarHBondContact O-CB 3.47Å; K90-N94 PolarHBondContact O-N 3.15Å
91	E	98.1	Very high	95.7	Very high	77 Å²	77	56.4 Å²	56.4	36%	0.36	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-52.9	176.7	-71.8	-178.9	178.6	0	0	111.7	G87 M88 M89 I93 N94 W95 K119	G87-E91 WeakPolarHBondContact O-CG 3.49Å; G87-E91 PolarHBondContact O-N 3.04Å; M88-E91 WeakPolarHBondContact O-CB 3.26Å; M88-E91 PolarHBondContact O-N 3.42Å; M89-E91 VanDerWaalsContact C-N 3.32Å; M89-E91 PolarHBondContact O-N 3.47Å; E91-I93 PolarHBondContact O-N 3.47Å; E91-N94 WeakPolarHBondContact O-CB 3.42Å; E91-N94 PolarHBondContact O-N 3.37Å; E91-W95 HydrophobicContact CB-CH2 4.16Å; E91-W95 HydrophobicContact CB-CZ2 4.06Å; E91-W95 HydrophobicContact CB-CZ3 4.49Å; E91-W95 VanDerWaalsContact O-CG 3.3Å; E91-W95 PolarHBondContact O-N 3.27Å; E91-K119 WeakPolarHBondContact OE2-CE 3.48Å; E91-K119 IonicContact OE2-NZ 2.74Å; E91-K119 PolarHBondContact OE2-NZ 3.24Å
92	I	97.9	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-35	-178	64.4	177.7	0	0	0	112.2	V59 I62 V63 W66 M88 M89 N94 W95 R96 K119 V120	V59-I92 HydrophobicContact CG1-CB 4.39Å; V59-I92 HydrophobicContact CG1-CD1 4.31Å; V59-I92 HydrophobicContact CG1-CG1 4.08Å; I62-I92 HydrophobicContact CG2-CD1 4.14Å; V63-I92 HydrophobicContact CG2-CD1 3.91Å; V63-I92 HydrophobicContact CG2-CG1 4.27Å; W66-I92 HydrophobicContact CH2-CD1 4.36Å; W66-I92 HydrophobicContact CZ3-CD1 4.02Å; M88-I92 WeakPolarHBondContact O-CG1 3.32Å; M88-I92 PolarHBondContact O-N 3.48Å; M89-I92 VanDerWaalsContact O-CG1 3.26Å; M89-I92 WeakPolarHBondContact O-CG1 3.41Å; M89-I92 PolarHBondContact O-N 2.88Å; I92-N94 VanDerWaalsContact C-N 3.35Å; I92-W95 HydrophobicContact CG2-CE3 4.17Å; I92-W95 HydrophobicContact CG2-CZ3 4.22Å; I92-W95 PolarHBondContact O-N 2.92Å; I92-R96 WeakPolarHBondContact O-CB 3.35Å; I92-R96 PolarHBondContact O-N 2.96Å; I92-K119 HydrophobicContact CG2-CB 4.01Å; I92-K119 HydrophobicContact CG2-CG 3.73Å; I92-V120 HydrophobicContact CD1-CG2 4.37Å
93	I	98	Very high	94.5	Very high	62 Å²	62	63 Å²	63	32%	0.318	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-42.3	173.6	-71	165.7	0	0	0	110.7	V59 V63 M89 E91 S97	V59-I93 HydrophobicContact CG1-CG1 4.38Å; V63-I93 HydrophobicContact CG1-CD1 4.23Å; V63-I93 HydrophobicContact CG2-CD1 3.96Å; V63-I93 HydrophobicContact CG2-CG1 3.87Å; M89-I93 WeakPolarHBondContact O-CB 3.36Å; M89-I93 WeakPolarHBondContact O-CD1 3.35Å; M89-I93 WeakPolarHBondContact O-CG1 3.43Å; M89-I93 PolarHBondContact O-N 3.29Å; E91-I93 PolarHBondContact O-N 3.47Å; I93-S97 PolarHBondContact O-N 2.81Å
94	N	97.5	Very high	94.1	Very high	90 Å²	90	58 Å²	58	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-43.4	177.6	179.9	53.2	0	0	0	111.6	K90 E91 I92 S97 Q98	K90-N94 VanDerWaalsContact O-CB 3.29Å; K90-N94 WeakPolarHBondContact O-CB 3.47Å; K90-N94 PolarHBondContact O-N 3.15Å; E91-N94 WeakPolarHBondContact O-CB 3.42Å; E91-N94 PolarHBondContact O-N 3.37Å; I92-N94 VanDerWaalsContact C-N 3.35Å; N94-S97 WeakPolarHBondContact O-CB 3.41Å; N94-S97 PolarHBondContact O-N 3.43Å; N94-Q98 PolarHBondContact ND2-NE2 3.5Å; N94-Q98 PolarHBondContact O-N 2.72Å; N94-Q98 VanDerWaalsContact O-N 3.08Å
95	W	97.4	Very high	93.7	Very high	22 Å²	22	57.6 Å²	57.6	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-42.8	176.2	-63.2	-22.7	0	0	0	112.2	E91 I92 S97 Q98 I99 L112 K115 I116 K119	E91-W95 HydrophobicContact CB-CH2 4.16Å; E91-W95 HydrophobicContact CB-CZ2 4.06Å; E91-W95 HydrophobicContact CB-CZ3 4.49Å; E91-W95 VanDerWaalsContact O-CG 3.3Å; E91-W95 PolarHBondContact O-N 3.27Å; I92-W95 HydrophobicContact CG2-CE3 4.17Å; I92-W95 HydrophobicContact CG2-CZ3 4.22Å; I92-W95 PolarHBondContact O-N 2.92Å; W95-S97 VanDerWaalsContact C-N 3.29Å; W95-S97 PolarHBondContact O-N 3.41Å; W95-Q98 WeakPolarHBondContact O-CB 3.47Å; W95-Q98 PolarHBondContact O-N 3.03Å; W95-Q98 VanDerWaalsContact O-N 3.07Å; W95-I99 PolarHBondContact O-N 3.47Å; W95-I99 VanDerWaalsContact O-N 3.1Å; W95-L112 HydrophobicContact CB-CD1 3.87Å; W95-L112 HydrophobicContact CB-CD2 4.25Å; W95-L112 HydrophobicContact CB-CG 4Å; W95-L112 HydrophobicContact CD2-CD1 4.27Å; W95-L112 HydrophobicContact CG-CD1 3.71Å; W95-L112 HydrophobicContact CG-CG 4.39Å; W95-K115 HydrophobicContact CD2-CD 4.23Å; W95-K115 HydrophobicContact CE3-CD 4.33Å; W95-K115 HydrophobicContact CE3-CG 4.21Å; W95-K115 HydrophobicContact CH2-CD 3.79Å; W95-K115 VanDerWaalsContact CH2-CE 3.46Å; W95-K115 HydrophobicContact CH2-CG 3.8Å; W95-K115 HydrophobicContact CZ2-CD 3.7Å; W95-K115 HydrophobicContact CZ2-CG 4.25Å; W95-K115 HydrophobicContact CZ3-CB 4.5Å; W95-K115 HydrophobicContact CZ3-CD 4.1Å; W95-K115 HydrophobicContact CZ3-CG 3.78Å; W95-I116 HydrophobicContact CB-CD1 3.9Å; W95-I116 HydrophobicContact CB-CG1 3.76Å; W95-I116 HydrophobicContact CD2-CG1 4.5Å; W95-I116 HydrophobicContact CE3-CG1 3.82Å; W95-K119 HydrophobicContact CH2-CB 4.3Å; W95-K119 HydrophobicContact CH2-CG 4.33Å; W95-K119 HydrophobicContact CZ3-CB 3.7Å; W95-K119 HydrophobicContact CZ3-CG 3.98Å
96	R	95.9	Very high	93.2	Very high	64 Å²	64	58.5 Å²	58.5	24%	0.242	30%	0.303	C	S	.	.	H	α-helix	trans	-53.5	-47.4	170.1	-179.2	-157.9	65.7	175.5	3.4	111.1	V56 V59 S60 I92 Q98 I99 T100	V56-R96 HydrophobicContact CG2-CG 3.93Å; V59-R96 HydrophobicContact CB-CB 4.26Å; V59-R96 HydrophobicContact CB-CG 4.29Å; V59-R96 HydrophobicContact CG1-CB 4.11Å; V59-R96 HydrophobicContact CG1-CG 4.47Å; V59-R96 HydrophobicContact CG2-CB 4.18Å; S60-R96 PolarHBondContact OG-NH1 2.96Å; I92-R96 WeakPolarHBondContact O-CB 3.35Å; I92-R96 PolarHBondContact O-N 2.96Å; R96-Q98 PolarHBondContact O-N 3.42Å; R96-I99 PolarHBondContact O-N 2.96Å; R96-I99 VanDerWaalsContact O-N 3.14Å; R96-T100 PolarHBondContact O-N 3.39Å; R96-T100 PolarHBondContact O-OG1 3.22Å
97	S	94.9	Very high	92.9	Very high	67 Å²	67	61.2 Å²	61.2	47%	0.469	32%	0.317	S	S	.	.	H	α-helix	trans	-60.3	-33.5	178.6	-170.5	0	0	0	0	113.1	I93 N94 W95 S101	I93-S97 PolarHBondContact O-N 2.81Å; N94-S97 WeakPolarHBondContact O-CB 3.41Å; N94-S97 PolarHBondContact O-N 3.43Å; W95-S97 VanDerWaalsContact C-N 3.29Å; W95-S97 PolarHBondContact O-N 3.41Å; S97-S101 PolarHBondContact O-N 2.88Å
98	Q	93.2	Very high	92.6	Very high	72 Å²	72	64.5 Å²	64.5	34%	0.336	32%	0.324	S	S	.	.	H	α-helix	trans	-67.7	-44.1	175.1	-69.8	175.3	61.6	0	0	111.2	N94 W95 R96 S101 L104 L112	N94-Q98 PolarHBondContact ND2-NE2 3.5Å; N94-Q98 PolarHBondContact O-N 2.72Å; N94-Q98 VanDerWaalsContact O-N 3.08Å; W95-Q98 WeakPolarHBondContact O-CB 3.47Å; W95-Q98 PolarHBondContact O-N 3.03Å; W95-Q98 VanDerWaalsContact O-N 3.07Å; R96-Q98 PolarHBondContact O-N 3.42Å; Q98-S101 WeakPolarHBondContact O-CB 3.35Å; Q98-S101 PolarHBondContact O-N 3.32Å; Q98-S101 PolarHBondContact O-OG 2.92Å; Q98-L104 HydrophobicContact CB-CD1 4.22Å; Q98-L112 HydrophobicContact CB-CD2 3.74Å
99	I	90.5	Very high	92.3	Very high	0 Å²	0	64 Å²	64	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-49.2	174.7	-61.7	177.2	0	0	0	110.3	A52 A55 W95 R96 S101 L102 V109 L112 N113 I116	A52-I99 HydrophobicContact CB-CG2 3.73Å; A55-I99 HydrophobicContact CB-CD1 4.01Å; A55-I99 HydrophobicContact CB-CG2 4.47Å; W95-I99 PolarHBondContact O-N 3.47Å; W95-I99 VanDerWaalsContact O-N 3.1Å; R96-I99 PolarHBondContact O-N 2.96Å; R96-I99 VanDerWaalsContact O-N 3.14Å; I99-S101 PolarHBondContact O-N 3.06Å; I99-L102 PolarHBondContact O-N 3.18Å; I99-L102 VanDerWaalsContact O-N 3.16Å; I99-V109 HydrophobicContact CG2-CG1 3.98Å; I99-L112 HydrophobicContact CD1-CB 4.41Å; I99-L112 HydrophobicContact CD1-CD2 4.49Å; I99-L112 HydrophobicContact CD1-CG 4.37Å; I99-L112 HydrophobicContact CG1-CB 4.37Å; I99-L112 HydrophobicContact CG1-CD2 3.84Å; I99-L112 HydrophobicContact CG1-CG 4.24Å; I99-N113 HydrophobicContact CD1-CB 4.45Å; I99-I116 HydrophobicContact CD1-CD1 3.7Å
100	T	89.6	Confident	91.9	Very high	70 Å²	70	67.5 Å²	67.5	43%	0.429	34%	0.337	S	S	.	.	H	α-helix	trans	-65.3	-20.7	-179.7	-47.6	0	0	0	0	113.2	V56 R96 L102	V56-T100 HydrophobicContact CG2-CG2 4.49Å; V56-T100 WeakPolarHBondContact CG2-OG1 3.47Å; R96-T100 PolarHBondContact O-N 3.39Å; R96-T100 PolarHBondContact O-OG1 3.22Å; T100-L102 PolarHBondContact O-N 2.82Å
101	S	89.3	Confident	91.6	Very high	50 Å²	50	67.8 Å²	67.8	35%	0.35	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13.7	176.9	79.3	0	0	0	0	113.8	S97 Q98 I99 K103	S97-S101 PolarHBondContact O-N 2.88Å; Q98-S101 WeakPolarHBondContact O-CB 3.35Å; Q98-S101 PolarHBondContact O-N 3.32Å; Q98-S101 PolarHBondContact O-OG 2.92Å; I99-S101 PolarHBondContact O-N 3.06Å; S101-K103 PolarHBondContact O-N 3.15Å; S101-K103 VanDerWaalsContact O-N 3.12Å
102	L	79.2	Confident	91.4	Very high	84 Å²	84	65 Å²	65	44%	0.44	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	24	-178.3	-58	175.9	0	0	0	114.2	F45 V48 T49 I99 T100	F45-L102 HydrophobicContact CE2-CD1 4.47Å; V48-L102 HydrophobicContact CG1-CD2 3.74Å; T49-L102 HydrophobicContact CG2-CD2 4.4Å; I99-L102 PolarHBondContact O-N 3.18Å; I99-L102 VanDerWaalsContact O-N 3.16Å; T100-L102 PolarHBondContact O-N 2.82Å
103	K	85.9	Confident	91.1	Very high	174 Å²	174	66.7 Å²	66.7	76%	0.757	33%	0.334	S	S	*	.			trans	-90.5	-10.7	178.3	-64.9	175.5	-175.4	174.8	0	113.6	S101	S101-K103 PolarHBondContact O-N 3.15Å; S101-K103 VanDerWaalsContact O-N 3.12Å
104	L	86.6	Confident	90.9	Very high	39 Å²	39	67.4 Å²	67.4	20%	0.204	33%	0.334	C	S	.	.	S	Bend	trans	-96.1	145.9	-175	-61.1	-179.5	0	0	0	110.1	Q98 E108 V109 L112	Q98-L104 HydrophobicContact CB-CD1 4.22Å; L104-E108 HydrophobicContact CB-CB 3.92Å; L104-E108 HydrophobicContact CD2-CB 4.26Å; L104-E108 HydrophobicContact CG-CB 4.47Å; L104-V109 HydrophobicContact CB-CG2 3.69Å; L104-V109 HydrophobicContact CD1-CG2 4.44Å; L104-L112 HydrophobicContact CD1-CD2 3.73Å
105	S	87.8	Confident	90.8	Very high	49 Å²	49	68 Å²	68	34%	0.343	33%	0.332	S	S	.	.			trans	-67.3	161.9	166.5	63.8	0	0	0	0	111.3	E107 E108 V109	S105-E107 PolarHBondContact O-N 2.9Å; S105-E108 WeakPolarHBondContact CB-OE2 3.28Å; S105-E108 PolarHBondContact N-OE2 2.95Å; S105-E108 PolarHBondContact O-N 2.95Å; S105-E108 VanDerWaalsContact O-N 3.11Å; S105-E108 VanDerWaalsContact OG-CD 3.28Å; S105-E108 VanDerWaalsContact OG-CG 3.29Å; S105-E108 WeakPolarHBondContact OG-CG 3.29Å; S105-E108 PolarHBondContact OG-N 3.3Å; S105-E108 PolarHBondContact OG-OE2 3.16Å; S105-V109 WeakPolarHBondContact O-CG2 3.38Å; S105-V109 PolarHBondContact O-N 3.37Å
106	L	86.8	Confident	90.7	Very high	23 Å²	23	67.2 Å²	67.2	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-55.1	-40.2	178.2	177.7	64.1	0	0	0	112.6	F44 E47 V48 V109 K110	F44-L106 HydrophobicContact CD2-CB 3.8Å; F44-L106 HydrophobicContact CD2-CD2 4.11Å; F44-L106 HydrophobicContact CE2-CB 3.21Å; F44-L106 HydrophobicContact CE2-CD2 4.33Å; F44-L106 HydrophobicContact CE2-CG 4.4Å; F44-L106 HydrophobicContact CZ-CB 3.82Å; E47-L106 HydrophobicContact CB-CD1 4.16Å; E47-L106 HydrophobicContact CG-CD1 3.74Å; E47-L106 HydrophobicContact CG-CD2 4.47Å; E47-L106 VanDerWaalsContact OE2-CD2 3.29Å; E47-L106 WeakPolarHBondContact OE2-CD2 3.42Å; V48-L106 HydrophobicContact CG2-CB 4.06Å; V48-L106 HydrophobicContact CG2-CD1 3.91Å; L106-V109 PolarHBondContact O-N 3.43Å; L106-K110 HydrophobicContact CD1-CD 4.47Å; L106-K110 HydrophobicContact CD1-CG 4.45Å; L106-K110 HydrophobicContact CG-CD 4.29Å; L106-K110 WeakPolarHBondContact O-CB 3.48Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.45Å
107	E	89.2	Confident	90.7	Very high	136 Å²	136	64.4 Å²	64.4	64%	0.636	32%	0.32	S	S	*	.	H	α-helix	trans	-65.6	-43.1	178.5	-172.6	56.9	-149.5	0	0	111.6	S105 V109 K110 K111	S105-E107 PolarHBondContact O-N 2.9Å; E107-V109 VanDerWaalsContact C-N 3.33Å; E107-V109 PolarHBondContact O-N 3.48Å; E107-K110 PolarHBondContact O-N 2.89Å; E107-K111 WeakPolarHBondContact O-CB 3.5Å; E107-K111 PolarHBondContact O-N 3.49Å
108	E	92.4	Very high	90.7	Very high	99 Å²	99	62.1 Å²	62.1	46%	0.463	30%	0.303	S	S	.	.	H	α-helix	trans	-64.5	-38.9	175.4	-71.3	166.5	133.3	0	0	111.8	L104 S105 L112	L104-E108 HydrophobicContact CB-CB 3.92Å; L104-E108 HydrophobicContact CD2-CB 4.26Å; L104-E108 HydrophobicContact CG-CB 4.47Å; S105-E108 WeakPolarHBondContact CB-OE2 3.28Å; S105-E108 PolarHBondContact N-OE2 2.95Å; S105-E108 PolarHBondContact O-N 2.95Å; S105-E108 VanDerWaalsContact O-N 3.11Å; S105-E108 VanDerWaalsContact OG-CD 3.28Å; S105-E108 VanDerWaalsContact OG-CG 3.29Å; S105-E108 WeakPolarHBondContact OG-CG 3.29Å; S105-E108 PolarHBondContact OG-N 3.3Å; S105-E108 PolarHBondContact OG-OE2 3.16Å; E108-L112 VanDerWaalsContact O-CB 3.26Å; E108-L112 WeakPolarHBondContact O-CB 3.07Å; E108-L112 PolarHBondContact O-N 3.45Å
109	V	90.8	Very high	90.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.8	-47.3	174.4	170.5	0	0	0	0	110.7	V48 V51 I99 L104 S105 L106 E107 L112 N113	V48-V109 HydrophobicContact CG1-CG2 4.29Å; V51-V109 HydrophobicContact CB-CG1 3.95Å; V51-V109 HydrophobicContact CG1-CG1 3.48Å; V51-V109 VanDerWaalsContact CG1-CG1 3.48Å; I99-V109 HydrophobicContact CG2-CG1 3.98Å; L104-V109 HydrophobicContact CB-CG2 3.69Å; L104-V109 HydrophobicContact CD1-CG2 4.44Å; S105-V109 WeakPolarHBondContact O-CG2 3.38Å; S105-V109 PolarHBondContact O-N 3.37Å; L106-V109 PolarHBondContact O-N 3.43Å; E107-V109 VanDerWaalsContact C-N 3.33Å; E107-V109 PolarHBondContact O-N 3.48Å; V109-L112 PolarHBondContact O-N 2.86Å; V109-N113 WeakPolarHBondContact O-CB 3.42Å; V109-N113 PolarHBondContact O-N 3.1Å
110	K	90.3	Very high	91.1	Very high	89 Å²	89	60.9 Å²	60.9	39%	0.387	30%	0.296	S	S	.	.	H	α-helix	trans	-60	-47.1	177.2	-76.7	178.1	177.3	176.3	0	111.7	E47 L106 E107 L112 N113 Y114	E47-K110 WeakPolarHBondContact OE1-CE 3.41Å; E47-K110 IonicContact OE1-NZ 2.72Å; E47-K110 PolarHBondContact OE1-NZ 3.03Å; L106-K110 HydrophobicContact CD1-CD 4.47Å; L106-K110 HydrophobicContact CD1-CG 4.45Å; L106-K110 HydrophobicContact CG-CD 4.29Å; L106-K110 WeakPolarHBondContact O-CB 3.48Å; L106-K110 WeakPolarHBondContact O-CG 3.33Å; L106-K110 PolarHBondContact O-N 3.45Å; E107-K110 PolarHBondContact O-N 2.89Å; K110-L112 VanDerWaalsContact C-N 3.33Å; K110-L112 PolarHBondContact O-N 2.86Å; K110-N113 PolarHBondContact O-N 3.42Å; K110-Y114 PolarHBondContact O-N 3.43Å
111	K	93	Very high	91.4	Very high	156 Å²	156	57.6 Å²	57.6	68%	0.678	28%	0.276	S	S	*	.	H	α-helix	trans	-61.1	-41.5	176.6	-175.5	176.5	-178.9	176.6	0	112.3	E107 Y114 K115	E107-K111 WeakPolarHBondContact O-CB 3.5Å; E107-K111 PolarHBondContact O-N 3.49Å; K111-Y114 PolarHBondContact O-N 3.1Å; K111-K115 PolarHBondContact O-N 3.32Å
112	L	94.4	Very high	91.8	Very high	19 Å²	19	55.9 Å²	55.9	10%	0.099	26%	0.264	C	S	.	.	H	α-helix	trans	-71.8	-35.7	179.2	-165.6	58.4	0	0	0	111.7	W95 Q98 I99 L104 E108 V109 K110 K115 I116	W95-L112 HydrophobicContact CB-CD1 3.87Å; W95-L112 HydrophobicContact CB-CD2 4.25Å; W95-L112 HydrophobicContact CB-CG 4Å; W95-L112 HydrophobicContact CD2-CD1 4.27Å; W95-L112 HydrophobicContact CG-CD1 3.71Å; W95-L112 HydrophobicContact CG-CG 4.39Å; Q98-L112 HydrophobicContact CB-CD2 3.74Å; I99-L112 HydrophobicContact CD1-CB 4.41Å; I99-L112 HydrophobicContact CD1-CD2 4.49Å; I99-L112 HydrophobicContact CD1-CG 4.37Å; I99-L112 HydrophobicContact CG1-CB 4.37Å; I99-L112 HydrophobicContact CG1-CD2 3.84Å; I99-L112 HydrophobicContact CG1-CG 4.24Å; L104-L112 HydrophobicContact CD1-CD2 3.73Å; E108-L112 VanDerWaalsContact O-CB 3.26Å; E108-L112 WeakPolarHBondContact O-CB 3.07Å; E108-L112 PolarHBondContact O-N 3.45Å; V109-L112 PolarHBondContact O-N 2.86Å; K110-L112 VanDerWaalsContact C-N 3.33Å; K110-L112 PolarHBondContact O-N 2.86Å; L112-K115 HydrophobicContact CD1-CD 4.28Å; L112-K115 WeakPolarHBondContact O-CB 3.34Å; L112-K115 PolarHBondContact O-N 3.33Å; L112-I116 WeakPolarHBondContact O-CG1 3.27Å; L112-I116 PolarHBondContact O-N 3.25Å
113	N	91.7	Very high	92.6	Very high	35 Å²	35	52 Å²	52	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-43.1	173.1	-165.8	60.1	0	0	0	111.7	V51 I99 V109 K110 K115 I116 A117	V51-N113 HydrophobicContact CG1-CB 4.3Å; I99-N113 HydrophobicContact CD1-CB 4.45Å; V109-N113 WeakPolarHBondContact O-CB 3.42Å; V109-N113 PolarHBondContact O-N 3.1Å; K110-N113 PolarHBondContact O-N 3.42Å; N113-K115 VanDerWaalsContact C-N 3.29Å; N113-K115 PolarHBondContact O-N 2.99Å; N113-I116 WeakPolarHBondContact O-CB 3.46Å; N113-I116 PolarHBondContact O-N 3.21Å; N113-A117 PolarHBondContact O-N 3.1Å
114	Y	93.5	Very high	93.1	Very high	78 Å²	78	44 Å²	44	31%	0.306	21%	0.209	S	C	.	.	H	α-helix	trans	-57	-43.9	171.1	180	-92.9	0	0	0	111.8	K110 K111 I116 A117 L118 Y137 R161	K110-Y114 PolarHBondContact O-N 3.43Å; K111-Y114 PolarHBondContact O-N 3.1Å; Y114-I116 VanDerWaalsContact C-N 3.34Å; Y114-I116 PolarHBondContact O-N 3.06Å; Y114-A117 WeakPolarHBondContact O-CB 3.37Å; Y114-A117 PolarHBondContact O-N 2.85Å; Y114-L118 HydrophobicContact CE1-CD2 4.41Å; Y114-L118 PolarHBondContact O-N 3.14Å; Y114-Y137 VanDerWaalsContact CD2-C 3.46Å; Y114-Y137 WeakPolarHBondContact CD2-O 3.3Å; Y114-R161 WeakPolarHBondContact OH-CD 3.49Å
115	K	95.1	Very high	93.5	Very high	101 Å²	101	47.7 Å²	47.7	44%	0.439	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-40.1	177.8	-164.1	-176.1	-173	-175.8	0	112.3	W95 K111 L112 N113 K119	W95-K115 HydrophobicContact CD2-CD 4.23Å; W95-K115 HydrophobicContact CE3-CD 4.33Å; W95-K115 HydrophobicContact CE3-CG 4.21Å; W95-K115 HydrophobicContact CH2-CD 3.79Å; W95-K115 VanDerWaalsContact CH2-CE 3.46Å; W95-K115 HydrophobicContact CH2-CG 3.8Å; W95-K115 HydrophobicContact CZ2-CD 3.7Å; W95-K115 HydrophobicContact CZ2-CG 4.25Å; W95-K115 HydrophobicContact CZ3-CB 4.5Å; W95-K115 HydrophobicContact CZ3-CD 4.1Å; W95-K115 HydrophobicContact CZ3-CG 3.78Å; K111-K115 PolarHBondContact O-N 3.32Å; L112-K115 HydrophobicContact CD1-CD 4.28Å; L112-K115 WeakPolarHBondContact O-CB 3.34Å; L112-K115 PolarHBondContact O-N 3.33Å; N113-K115 VanDerWaalsContact C-N 3.29Å; N113-K115 PolarHBondContact O-N 2.99Å; K115-K119 WeakPolarHBondContact O-CB 3.28Å; K115-K119 PolarHBondContact O-N 3.13Å; K115-K119 VanDerWaalsContact O-N 3.08Å
116	I	95.7	Very high	93.9	Very high	6 Å²	6	48.7 Å²	48.7	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-52.7	172.3	-69.6	166.7	0	0	0	109.4	V59 W95 I99 L112 N113 Y114 L118 K119 V120	V59-I116 HydrophobicContact CG2-CD1 4.38Å; V59-I116 HydrophobicContact CG2-CG2 3.7Å; W95-I116 HydrophobicContact CB-CD1 3.9Å; W95-I116 HydrophobicContact CB-CG1 3.76Å; W95-I116 HydrophobicContact CD2-CG1 4.5Å; W95-I116 HydrophobicContact CE3-CG1 3.82Å; I99-I116 HydrophobicContact CD1-CD1 3.7Å; L112-I116 WeakPolarHBondContact O-CG1 3.27Å; L112-I116 PolarHBondContact O-N 3.25Å; N113-I116 WeakPolarHBondContact O-CB 3.46Å; N113-I116 PolarHBondContact O-N 3.21Å; Y114-I116 VanDerWaalsContact C-N 3.34Å; Y114-I116 PolarHBondContact O-N 3.06Å; I116-L118 PolarHBondContact O-N 2.85Å; I116-K119 PolarHBondContact O-N 3.19Å; I116-K119 VanDerWaalsContact O-N 3.16Å; I116-V120 HydrophobicContact CG2-CG2 4.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.28Å; I116-V120 PolarHBondContact O-N 3.47Å
117	A	94.8	Very high	94.3	Very high	6 Å²	6	48.4 Å²	48.4	5%	0.05	22%	0.219	C	C	.	.	H	α-helix	trans	-54.6	-48.6	-179.8	0	0	0	0	0	112.1	N113 Y114 K119 V120 D121	N113-A117 PolarHBondContact O-N 3.1Å; Y114-A117 WeakPolarHBondContact O-CB 3.37Å; Y114-A117 PolarHBondContact O-N 2.85Å; A117-K119 PolarHBondContact O-N 2.81Å; A117-V120 PolarHBondContact O-N 2.95Å; A117-D121 PolarHBondContact O-N 3.22Å
118	L	94.9	Very high	94.5	Very high	19 Å²	19	45.2 Å²	45.2	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-44.6	177.2	179.9	63	0	0	0	112.8	Y114 I116 V120 D121 V122 R161 E165	Y114-L118 HydrophobicContact CE1-CD2 4.41Å; Y114-L118 PolarHBondContact O-N 3.14Å; I116-L118 PolarHBondContact O-N 2.85Å; L118-V120 VanDerWaalsContact C-N 3.33Å; L118-V120 PolarHBondContact O-N 2.74Å; L118-D121 PolarHBondContact O-N 2.85Å; L118-V122 WeakPolarHBondContact O-CG2 3.31Å; L118-V122 PolarHBondContact O-N 2.65Å; L118-V122 VanDerWaalsContact O-N 3.08Å; L118-R161 HydrophobicContact CD1-CG 3.62Å; L118-E165 HydrophobicContact CD1-CB 4.06Å; L118-E165 HydrophobicContact CD1-CG 4.21Å; L118-E165 HydrophobicContact CD2-CB 4.47Å; L118-E165 HydrophobicContact CD2-CG 4.07Å; L118-E165 HydrophobicContact CG-CB 4.41Å; L118-E165 HydrophobicContact CG-CG 4.02Å
119	K	96.5	Very high	94.7	Very high	41 Å²	41	41.7 Å²	41.7	18%	0.178	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-37.3	178.3	-173.7	66.3	60.7	154.9	0	112	M88 E91 I92 W95 K115 I116 A117 G123	M88-K119 HydrophobicContact CB-CD 4.36Å; M88-K119 HydrophobicContact CE-CD 3.7Å; M88-K119 HydrophobicContact CE-CG 4.22Å; M88-K119 WeakPolarHBondContact CE-O 3.36Å; M88-K119 HydrophobicContact CG-CD 4.12Å; E91-K119 WeakPolarHBondContact OE2-CE 3.48Å; E91-K119 IonicContact OE2-NZ 2.74Å; E91-K119 PolarHBondContact OE2-NZ 3.24Å; I92-K119 HydrophobicContact CG2-CB 4.01Å; I92-K119 HydrophobicContact CG2-CG 3.73Å; W95-K119 HydrophobicContact CH2-CB 4.3Å; W95-K119 HydrophobicContact CH2-CG 4.33Å; W95-K119 HydrophobicContact CZ3-CB 3.7Å; W95-K119 HydrophobicContact CZ3-CG 3.98Å; K115-K119 WeakPolarHBondContact O-CB 3.28Å; K115-K119 PolarHBondContact O-N 3.13Å; K115-K119 VanDerWaalsContact O-N 3.08Å; I116-K119 PolarHBondContact O-N 3.19Å; I116-K119 VanDerWaalsContact O-N 3.16Å; A117-K119 PolarHBondContact O-N 2.81Å; K119-G123 PolarHBondContact O-N 2.91Å
120	V	96.7	Very high	94.9	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.024	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-45.3	174.4	171.3	0	0	0	0	110.4	I62 W66 I92 I116 A117 L118 V122 G123 N124	I62-V120 HydrophobicContact CD1-CG1 3.81Å; I62-V120 HydrophobicContact CG1-CG1 3.99Å; I62-V120 HydrophobicContact CG1-CG2 4.39Å; I62-V120 HydrophobicContact CG2-CG1 4.06Å; I62-V120 HydrophobicContact CG2-CG2 4.02Å; W66-V120 HydrophobicContact CZ2-CB 4.38Å; W66-V120 HydrophobicContact CZ2-CG1 4.25Å; W66-V120 WeakPolarHBondContact CZ2-O 3.27Å; I92-V120 HydrophobicContact CD1-CG2 4.37Å; I116-V120 HydrophobicContact CG2-CG2 4.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.28Å; I116-V120 PolarHBondContact O-N 3.47Å; A117-V120 PolarHBondContact O-N 2.95Å; L118-V120 VanDerWaalsContact C-N 3.33Å; L118-V120 PolarHBondContact O-N 2.74Å; V120-V122 VanDerWaalsContact C-N 3.33Å; V120-V122 PolarHBondContact O-N 3.09Å; V120-G123 PolarHBondContact O-N 2.89Å; V120-G123 VanDerWaalsContact O-N 3.11Å; V120-N124 WeakPolarHBondContact O-CB 3.26Å; V120-N124 PolarHBondContact O-N 3.26Å; V120-N124 PolarHBondContact O-OD1 3.04Å
121	D	96.1	Very high	95.1	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-41.3	-179.7	-59.2	-22.9	0	0	0	112	A117 L118 R125 R134 R161 I162	A117-D121 PolarHBondContact O-N 3.22Å; L118-D121 PolarHBondContact O-N 2.85Å; D121-R125 PolarHBondContact O-N 3Å; D121-R125 VanDerWaalsContact O-N 3.07Å; D121-R134 IonicContact OD1-CZ 3.13Å; D121-R134 IonicContact OD1-NE 3.19Å; D121-R134 PolarHBondContact OD1-NE 2.83Å; D121-R134 IonicContact OD1-NH2 3.46Å; D121-R134 PolarHBondContact OD1-NH2 3.14Å; D121-R134 VanDerWaalsContact OD2-CD 3.31Å; D121-R134 WeakPolarHBondContact OD2-CD 3.42Å; D121-R134 IonicContact OD2-NE 3.99Å; D121-R134 PolarHBondContact OD2-NE 3.26Å; D121-R134 VanDerWaalsContact OD2-NE 3.13Å; D121-R161 IonicContact OD2-CZ 3.27Å; D121-R161 VanDerWaalsContact OD2-CZ 3.27Å; D121-R161 IonicContact OD2-NH1 2.85Å; D121-R161 PolarHBondContact OD2-NH1 3.48Å; D121-R161 IonicContact OD2-NH2 2.74Å; D121-R161 PolarHBondContact OD2-NH2 2.95Å; D121-I162 HydrophobicContact CB-CD1 3.68Å; D121-I162 HydrophobicContact CB-CG1 3.65Å
122	V	96.3	Very high	95.2	Very high	14 Å²	14	41.5 Å²	41.5	9%	0.085	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-45.8	172.6	173.1	0	0	0	0	111	M88 L118 V120 R125 M126 I162 E165 M166	M88-V122 HydrophobicContact CE-CB 4.25Å; M88-V122 HydrophobicContact CE-CG1 4Å; L118-V122 WeakPolarHBondContact O-CG2 3.31Å; L118-V122 PolarHBondContact O-N 2.65Å; L118-V122 VanDerWaalsContact O-N 3.08Å; V120-V122 VanDerWaalsContact C-N 3.33Å; V120-V122 PolarHBondContact O-N 3.09Å; V122-R125 PolarHBondContact O-N 3.07Å; V122-M126 HydrophobicContact CG1-CG 4.47Å; V122-M126 HydrophobicContact CG1-SD 4.01Å; V122-M126 WeakPolarHBondContact O-CG 3.27Å; V122-M126 PolarHBondContact O-N 3.33Å; V122-I162 HydrophobicContact CG2-CG2 4.18Å; V122-E165 HydrophobicContact CG2-CB 3.94Å; V122-E165 HydrophobicContact CG2-CG 3.71Å; V122-M166 HydrophobicContact CG1-CG 3.77Å; V122-M166 HydrophobicContact CG1-SD 4.34Å; V122-M166 HydrophobicContact CG2-CG 4.18Å
123	G	96.8	Very high	95.2	Very high	1 Å²	1	42 Å²	42	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-41.7	-179.8	0	0	0	0	0	112.5	K119 V120 R125 M126 L127	K119-G123 PolarHBondContact O-N 2.91Å; V120-G123 PolarHBondContact O-N 2.89Å; V120-G123 VanDerWaalsContact O-N 3.11Å; G123-R125 VanDerWaalsContact C-N 3.33Å; G123-R125 PolarHBondContact O-N 3.4Å; G123-M126 PolarHBondContact O-N 3.32Å; G123-L127 WeakPolarHBondContact O-CB 3.36Å; G123-L127 VanDerWaalsContact O-CG 3.24Å; G123-L127 WeakPolarHBondContact O-CG 3.21Å; G123-L127 PolarHBondContact O-N 2.8Å
124	N	96.9	Very high	95.3	Very high	8 Å²	8	41.5 Å²	41.5	4%	0.043	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-45.2	174.3	-76.3	9.3	0	0	0	111	W66 V120 M126 L127 G128 A129 D130	W66-N124 PolarHBondContact NE1-OD1 2.98Å; V120-N124 WeakPolarHBondContact O-CB 3.26Å; V120-N124 PolarHBondContact O-N 3.26Å; V120-N124 PolarHBondContact O-OD1 3.04Å; N124-M126 PolarHBondContact O-N 3Å; N124-L127 CarbonylContact O-C 3.5Å; N124-L127 PolarHBondContact O-N 3.11Å; N124-G128 PolarHBondContact O-N 3.49Å; N124-A129 HydrophobicContact CB-CB 4.02Å; N124-A129 PolarHBondContact O-N 2.94Å; N124-D130 PolarHBondContact ND2-O 3.18Å; N124-D130 VanDerWaalsContact ND2-O 3.14Å
125	R	95.1	Very high	95.2	Very high	115 Å²	115	39.5 Å²	39.5	43%	0.434	22%	0.216	S	C	.	.	H	α-helix	trans	-62.2	-41.4	176.7	-173.6	170.1	-178.7	-146.1	8.1	112.5	D121 V122 G123 L127 G128 I162 M166	D121-R125 PolarHBondContact O-N 3Å; D121-R125 VanDerWaalsContact O-N 3.07Å; V122-R125 PolarHBondContact O-N 3.07Å; G123-R125 VanDerWaalsContact C-N 3.33Å; G123-R125 PolarHBondContact O-N 3.4Å; R125-L127 VanDerWaalsContact C-N 3.32Å; R125-G128 PolarHBondContact O-N 3Å; R125-I162 HydrophobicContact CB-CG2 4.16Å; R125-I162 VanDerWaalsContact CD-CG2 3.47Å; R125-I162 HydrophobicContact CG-CG2 4.46Å; R125-M166 HydrophobicContact CB-SD 4.4Å; R125-M166 HydrophobicContact CG-SD 4.14Å; R125-M166 PolarHBondContact NH1-SD 3.48Å
126	M	94.2	Very high	94.8	Very high	71 Å²	71	39.4 Å²	39.4	35%	0.35	22%	0.224	S	C	.	.	H	α-helix	trans	-66	-34.3	176.8	-70.5	176.8	63.7	0	0	112.9	T84 M88 V122 G123 N124 M166	T84-M126 HydrophobicContact CG2-CE 3.74Å; M88-M126 HydrophobicContact CE-SD 4.33Å; M88-M126 HydrophobicContact SD-CE 4.49Å; M88-M126 HydrophobicContact SD-SD 3.91Å; V122-M126 HydrophobicContact CG1-CG 4.47Å; V122-M126 HydrophobicContact CG1-SD 4.01Å; V122-M126 WeakPolarHBondContact O-CG 3.27Å; V122-M126 PolarHBondContact O-N 3.33Å; G123-M126 PolarHBondContact O-N 3.32Å; N124-M126 PolarHBondContact O-N 3Å; M126-M166 HydrophobicContact CG-CE 3.98Å
127	L	96	Very high	94.4	Very high	16 Å²	16	47.2 Å²	47.2	8%	0.084	25%	0.254	C	S	.	.	H	α-helix	trans	-88.3	-3.7	-178.3	-69.1	171.3	0	0	0	113.6	W66 I69 L80 V85 G123 N124 R125 A129	W66-L127 HydrophobicContact CB-CD1 3.79Å; W66-L127 HydrophobicContact CD2-CD1 3.65Å; W66-L127 HydrophobicContact CE3-CD1 4.45Å; W66-L127 HydrophobicContact CG-CD1 3.3Å; I69-L127 HydrophobicContact CD1-CB 4.22Å; I69-L127 HydrophobicContact CD1-CD1 4.46Å; I69-L127 HydrophobicContact CG2-CB 4.31Å; I69-L127 HydrophobicContact CG2-CD2 3.97Å; L80-L127 HydrophobicContact CD1-CD2 3.8Å; L80-L127 HydrophobicContact CD2-CD2 4.48Å; V85-L127 HydrophobicContact CG1-CD1 4.12Å; V85-L127 HydrophobicContact CG1-CD2 4.22Å; V85-L127 HydrophobicContact CG2-CD2 3.73Å; V85-L127 HydrophobicContact CG2-CG 4.31Å; G123-L127 WeakPolarHBondContact O-CB 3.36Å; G123-L127 VanDerWaalsContact O-CG 3.24Å; G123-L127 WeakPolarHBondContact O-CG 3.21Å; G123-L127 PolarHBondContact O-N 2.8Å; N124-L127 CarbonylContact O-C 3.5Å; N124-L127 PolarHBondContact O-N 3.11Å; R125-L127 VanDerWaalsContact C-N 3.32Å; L127-A129 PolarHBondContact O-N 2.87Å
128	G	94.4	Very high	94	Very high	70 Å²	70	47 Å²	47	72%	0.722	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	24.5	-174	0	0	0	0	0	113.8	N124 R125	N124-G128 PolarHBondContact O-N 3.49Å; R125-G128 PolarHBondContact O-N 3Å
129	A	95.6	Very high	93.7	Very high	25 Å²	25	49.8 Å²	49.8	21%	0.207	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-83.3	171	174.4	0	0	0	0	0	111.5	I69 N124 L127	I69-A129 HydrophobicContact CD1-CB 4.25Å; N124-A129 HydrophobicContact CB-CB 4.02Å; N124-A129 PolarHBondContact O-N 2.94Å; L127-A129 PolarHBondContact O-N 2.87Å
130	D	94.6	Very high	93.4	Very high	141 Å²	141	53.6 Å²	53.6	75%	0.754	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-64.7	140.7	-176.8	-67.9	-38.9	0	0	0	112.6	N124	N124-D130 PolarHBondContact ND2-O 3.18Å; N124-D130 VanDerWaalsContact ND2-O 3.14Å
131	L	94.6	Very high	93.2	Very high	67 Å²	67	54.9 Å²	54.9	35%	0.351	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-75.1	124.1	172.1	179.7	77.4	0	0	0	109.7	H155 T158 V159 I162	L131-H155 WeakPolarHBondContact CD2-CE1 3.36Å; L131-H155 VanDerWaalsContact CD2-ND1 3.29Å; L131-H155 WeakPolarHBondContact CD2-ND1 3.29Å; L131-T158 HydrophobicContact CD1-CG2 3.82Å; L131-T158 HydrophobicContact CG-CG2 4.35Å; L131-V159 HydrophobicContact CD2-CG2 3.79Å; L131-I162 HydrophobicContact CD1-CD1 3.29Å
132	V	94.9	Very high	93	Very high	33 Å²	33	60.1 Å²	60.1	20%	0.2	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-92.3	117	169.7	-177.5	0	0	0	0	108.9	R134 E140 T158	V132-R134 HydrophobicContact CG1-CG 4.38Å; V132-E140 HydrophobicContact CG1-CB 4.06Å; V132-E140 HydrophobicContact CG1-CG 3.59Å; V132-T158 WeakPolarHBondContact O-CG2 3.45Å
133	V	94.7	Very high	92.6	Very high	28 Å²	28	62.5 Å²	62.5	17%	0.17	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73.7	130.4	176.7	-176.9	0	0	0	0	109.2	L141 L151 H155	V133-L141 HydrophobicContact CG1-CB 4.32Å; V133-L141 HydrophobicContact CG1-CD2 3.99Å; V133-L141 WeakPolarHBondContact O-CB 3.49Å; V133-L141 PolarHBondContact O-N 3.1Å; V133-L151 HydrophobicContact CB-CD1 4.35Å; V133-L151 HydrophobicContact CG1-CD1 4.09Å; V133-L151 HydrophobicContact CG2-CD1 4.43Å; V133-H155 HydrophobicContact CG2-CB 4.14Å
134	R	93.7	Very high	92.3	Very high	26 Å²	26	68.5 Å²	68.5	10%	0.098	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-124.9	155.3	-176.4	-62.4	-179	-172.9	-72.8	-9.9	112.5	D121 V132 G138 N139 T158	D121-R134 IonicContact OD1-CZ 3.13Å; D121-R134 IonicContact OD1-NE 3.19Å; D121-R134 PolarHBondContact OD1-NE 2.83Å; D121-R134 IonicContact OD1-NH2 3.46Å; D121-R134 PolarHBondContact OD1-NH2 3.14Å; D121-R134 VanDerWaalsContact OD2-CD 3.31Å; D121-R134 WeakPolarHBondContact OD2-CD 3.42Å; D121-R134 IonicContact OD2-NE 3.99Å; D121-R134 PolarHBondContact OD2-NE 3.26Å; D121-R134 VanDerWaalsContact OD2-NE 3.13Å; V132-R134 HydrophobicContact CG1-CG 4.38Å; R134-G138 WeakPolarHBondContact CD-O 3.23Å; R134-G138 PolarHBondContact NH1-O 3.17Å; R134-G138 VanDerWaalsContact NH1-O 3.1Å; R134-N139 CarbonylContact C-O 3.53Å; R134-N139 WeakPolarHBondContact CA-O 3.44Å; R134-N139 VanDerWaalsContact CB-O 3.29Å; R134-N139 WeakPolarHBondContact CB-O 3.25Å; R134-T158 PolarHBondContact N-OG1 3.34Å; R134-T158 VanDerWaalsContact N-OG1 3.15Å; R134-T158 PolarHBondContact O-OG1 3.23Å
135	D	90.7	Very high	91.9	Very high	35 Å²	35	74 Å²	74	19%	0.187	40%	0.399	C	S	.	.			trans	-73.1	179.9	167.5	73.6	8.4	0	0	0	111.9	Y137 G138 N139 Y154	D135-Y137 PolarHBondContact O-N 3.38Å; D135-Y137 VanDerWaalsContact O-N 3.15Å; D135-Y137 VanDerWaalsContact OD1-CA 3.27Å; D135-Y137 WeakPolarHBondContact OD1-CA 3.47Å; D135-Y137 WeakPolarHBondContact OD1-CB 3.35Å; D135-Y137 PolarHBondContact OD1-N 2.92Å; D135-G138 PolarHBondContact O-N 3.29Å; D135-G138 VanDerWaalsContact O-N 3.16Å; D135-G138 PolarHBondContact OD1-N 3.16Å; D135-N139 PolarHBondContact N-O 2.87Å; D135-N139 PolarHBondContact OD1-N 3.42Å; D135-N139 PolarHBondContact OD1-ND2 2.99Å; D135-N139 WeakPolarHBondContact OD2-CB 3.48Å; D135-N139 PolarHBondContact OD2-ND2 3.01Å; D135-Y154 HydrophobicContact CB-CE1 4.39Å
136	T	87.2	Confident	91.7	Very high	100 Å²	100	69.9 Å²	69.9	61%	0.613	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.3	178	51.4	0	0	0	0	113.9
137	Y	87.2	Confident	91.7	Very high	169 Å²	169	69.2 Å²	69.2	66%	0.663	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	6.7	-179.1	-52.3	-74.5	0	0	0	112.6	Y114 D135 N139	Y114-Y137 VanDerWaalsContact CD2-C 3.46Å; Y114-Y137 WeakPolarHBondContact CD2-O 3.3Å; D135-Y137 PolarHBondContact O-N 3.38Å; D135-Y137 VanDerWaalsContact O-N 3.15Å; D135-Y137 VanDerWaalsContact OD1-CA 3.27Å; D135-Y137 WeakPolarHBondContact OD1-CA 3.47Å; D135-Y137 WeakPolarHBondContact OD1-CB 3.35Å; D135-Y137 PolarHBondContact OD1-N 2.92Å; Y137-N139 VanDerWaalsContact C-N 3.29Å; Y137-N139 PolarHBondContact O-N 3.45Å
138	G	86.3	Confident	91.7	Very high	1 Å²	1	74.4 Å²	74.4	1%	0.01	42%	0.422	C	S	.	.	S	Bend	trans	78.1	9.7	177.5	0	0	0	0	0	114.4	R134 D135	R134-G138 WeakPolarHBondContact CD-O 3.23Å; R134-G138 PolarHBondContact NH1-O 3.17Å; R134-G138 VanDerWaalsContact NH1-O 3.1Å; D135-G138 PolarHBondContact O-N 3.29Å; D135-G138 VanDerWaalsContact O-N 3.16Å; D135-G138 PolarHBondContact OD1-N 3.16Å
139	N	89.2	Confident	91.7	Very high	78 Å²	78	75.6 Å²	75.6	42%	0.417	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-76.8	142.9	172.3	-51.6	-58.8	0	0	0	109.4	R134 D135 Y137 L141	R134-N139 CarbonylContact C-O 3.53Å; R134-N139 WeakPolarHBondContact CA-O 3.44Å; R134-N139 VanDerWaalsContact CB-O 3.29Å; R134-N139 WeakPolarHBondContact CB-O 3.25Å; D135-N139 PolarHBondContact N-O 2.87Å; D135-N139 PolarHBondContact OD1-N 3.42Å; D135-N139 PolarHBondContact OD1-ND2 2.99Å; D135-N139 WeakPolarHBondContact OD2-CB 3.48Å; D135-N139 PolarHBondContact OD2-ND2 3.01Å; Y137-N139 VanDerWaalsContact C-N 3.29Å; Y137-N139 PolarHBondContact O-N 3.45Å; N139-L141 PolarHBondContact O-N 3.41Å
140	E	91.2	Very high	91.7	Very high	121 Å²	121	78.8 Å²	78.8	57%	0.565	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-62.4	128.6	172	180	169.7	165.5	0	0	110.2	V132 Q142	V132-E140 HydrophobicContact CG1-CB 4.06Å; V132-E140 HydrophobicContact CG1-CG 3.59Å; E140-Q142 PolarHBondContact O-N 3.28Å
141	L	91.8	Very high	91.7	Very high	32 Å²	32	74.9 Å²	74.9	17%	0.168	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-76.1	126.3	-176.1	-167.4	71.8	0	0	0	110.1	V133 N139 A143 C146 L151 Y154	V133-L141 HydrophobicContact CG1-CB 4.32Å; V133-L141 HydrophobicContact CG1-CD2 3.99Å; V133-L141 WeakPolarHBondContact O-CB 3.49Å; V133-L141 PolarHBondContact O-N 3.1Å; N139-L141 PolarHBondContact O-N 3.41Å; L141-A143 PolarHBondContact O-N 3.09Å; L141-C146 HydrophobicContact CD2-CB 4.4Å; L141-L151 HydrophobicContact CD2-CD1 3.71Å; L141-Y154 HydrophobicContact CD1-CD2 4.15Å; L141-Y154 HydrophobicContact CD1-CE2 4.2Å; L141-Y154 HydrophobicContact CD2-CD2 3.57Å; L141-Y154 HydrophobicContact CD2-CE2 4.37Å; L141-Y154 HydrophobicContact CD2-CG 3.88Å
142	Q	90.7	Very high	91.8	Very high	112 Å²	112	78.5 Å²	78.5	52%	0.523	42%	0.415	S	S	.	.			trans	-80.3	111	173	-63.4	-63.3	-45.3	0	0	109.1	E140 D144 N145	E140-Q142 PolarHBondContact O-N 3.28Å; Q142-D144 VanDerWaalsContact CB-OD1 3.24Å; Q142-D144 WeakPolarHBondContact CB-OD1 3.34Å; Q142-D144 PolarHBondContact O-N 2.95Å; Q142-N145 HydrophobicContact CB-CB 4.45Å; Q142-N145 WeakPolarHBondContact CB-ND2 3.49Å; Q142-N145 PolarHBondContact O-N 2.9Å; Q142-N145 VanDerWaalsContact O-N 3.07Å
143	A	88	Confident	91.8	Very high	63 Å²	63	83.2 Å²	83.2	52%	0.521	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-66	-22.8	-171.6	0	0	0	0	0	114	L141 N145	L141-A143 PolarHBondContact O-N 3.09Å; A143-N145 VanDerWaalsContact C-N 3.26Å; A143-N145 PolarHBondContact O-N 3.21Å
144	D	90.8	Very high	91.9	Very high	127 Å²	127	85.6 Å²	85.6	68%	0.679	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-68.5	-24.3	173.8	63.2	-22.8	0	0	0	113.1	Q142	Q142-D144 VanDerWaalsContact CB-OD1 3.24Å; Q142-D144 WeakPolarHBondContact CB-OD1 3.34Å; Q142-D144 PolarHBondContact O-N 2.95Å
145	N	89.8	Confident	92	Very high	124 Å²	124	87.8 Å²	87.8	66%	0.663	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-95.6	8.9	-178.2	-65.2	-54.8	0	0	0	113.2	Q142 A143	Q142-N145 HydrophobicContact CB-CB 4.45Å; Q142-N145 WeakPolarHBondContact CB-ND2 3.49Å; Q142-N145 PolarHBondContact O-N 2.9Å; Q142-N145 VanDerWaalsContact O-N 3.07Å; A143-N145 VanDerWaalsContact C-N 3.26Å; A143-N145 PolarHBondContact O-N 3.21Å
146	C	90.2	Very high	92.2	Very high	28 Å²	28	89.3 Å²	89.3	19%	0.189	46%	0.458	C	S	.	.	S	Bend	trans	-134.3	139.6	-177.8	-75.3	0	0	0	0	111.7	L141 E150	L141-C146 HydrophobicContact CD2-CB 4.4Å; C146-E150 HydrophobicContact CB-CB 4.26Å
147	S	94.4	Very high	92.6	Very high	58 Å²	58	86.8 Å²	86.8	41%	0.406	45%	0.448	S	S	.	.			trans	-67	158.3	164.8	67	0	0	0	0	110.9	T149 E150 L151	S147-T149 PolarHBondContact O-N 3.04Å; S147-E150 VanDerWaalsContact CB-OE2 3.3Å; S147-E150 WeakPolarHBondContact CB-OE2 3.28Å; S147-E150 PolarHBondContact N-OE2 2.94Å; S147-E150 PolarHBondContact O-N 3.09Å; S147-E150 VanDerWaalsContact OG-CD 3.27Å; S147-E150 VanDerWaalsContact OG-CG 3.29Å; S147-E150 WeakPolarHBondContact OG-CG 3.41Å; S147-E150 PolarHBondContact OG-N 3.23Å; S147-E150 PolarHBondContact OG-OE2 3.46Å; S147-L151 PolarHBondContact O-N 3.38Å
148	V	95.4	Very high	93	Very high	125 Å²	125	78.9 Å²	78.9	76%	0.758	42%	0.417	S	S	*	.	H	α-helix	trans	-55.4	-39.3	177.6	178.3	0	0	0	0	111.8	L151 Y152	V148-L151 PolarHBondContact O-N 3.47Å; V148-Y152 WeakPolarHBondContact O-CB 3.46Å; V148-Y152 PolarHBondContact O-N 3.45Å
149	T	95.8	Very high	93.5	Very high	94 Å²	94	81.3 Å²	81.3	58%	0.577	43%	0.431	S	S	*	.	H	α-helix	trans	-66.3	-38.7	177.9	-52.3	0	0	0	0	112	S147 K153	S147-T149 PolarHBondContact O-N 3.04Å; T149-K153 WeakPolarHBondContact O-CG 3.12Å; T149-K153 PolarHBondContact O-N 3.28Å; T149-K153 VanDerWaalsContact O-N 3.17Å
150	E	94.1	Very high	93.7	Very high	92 Å²	92	84 Å²	84	43%	0.43	44%	0.441	S	S	.	.	H	α-helix	trans	-69.2	-45.5	175.6	-72.5	163.5	138.6	0	0	111.3	C146 S147 Y152 K153 Y154	C146-E150 HydrophobicContact CB-CB 4.26Å; S147-E150 VanDerWaalsContact CB-OE2 3.3Å; S147-E150 WeakPolarHBondContact CB-OE2 3.28Å; S147-E150 PolarHBondContact N-OE2 2.94Å; S147-E150 PolarHBondContact O-N 3.09Å; S147-E150 VanDerWaalsContact OG-CD 3.27Å; S147-E150 VanDerWaalsContact OG-CG 3.29Å; S147-E150 WeakPolarHBondContact OG-CG 3.41Å; S147-E150 PolarHBondContact OG-N 3.23Å; S147-E150 PolarHBondContact OG-OE2 3.46Å; E150-Y152 VanDerWaalsContact C-N 3.25Å; E150-Y152 PolarHBondContact O-N 2.92Å; E150-K153 WeakPolarHBondContact O-CB 3.29Å; E150-K153 PolarHBondContact O-N 3.48Å; E150-Y154 VanDerWaalsContact O-CD2 3.22Å; E150-Y154 WeakPolarHBondContact O-CD2 2.94Å; E150-Y154 PolarHBondContact O-N 3.37Å
151	L	95.4	Very high	93.9	Very high	59 Å²	59	80 Å²	80	31%	0.309	42%	0.421	S	S	.	.	H	α-helix	trans	-56.2	-42.9	175.7	179.1	61.4	0	0	0	111.2	V133 L141 S147 V148 K153 Y154 H155	V133-L151 HydrophobicContact CB-CD1 4.35Å; V133-L151 HydrophobicContact CG1-CD1 4.09Å; V133-L151 HydrophobicContact CG2-CD1 4.43Å; L141-L151 HydrophobicContact CD2-CD1 3.71Å; S147-L151 PolarHBondContact O-N 3.38Å; V148-L151 PolarHBondContact O-N 3.47Å; L151-K153 PolarHBondContact O-N 2.95Å; L151-Y154 PolarHBondContact O-N 3Å; L151-H155 WeakPolarHBondContact O-CB 3.45Å; L151-H155 PolarHBondContact O-N 3.33Å
152	Y	96	Very high	94	Very high	143 Å²	143	78.5 Å²	78.5	56%	0.561	41%	0.413	S	S	*	.	H	α-helix	trans	-62.1	-41.6	175.6	-179.6	-109.6	0	0	0	112.6	V148 E150 H155 L156	V148-Y152 WeakPolarHBondContact O-CB 3.46Å; V148-Y152 PolarHBondContact O-N 3.45Å; E150-Y152 VanDerWaalsContact C-N 3.25Å; E150-Y152 PolarHBondContact O-N 2.92Å; Y152-H155 WeakPolarHBondContact O-CB 3.44Å; Y152-H155 PolarHBondContact O-N 2.77Å; Y152-L156 HydrophobicContact CD1-CD1 4.14Å; Y152-L156 HydrophobicContact CE1-CD1 3.5Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.5Å; Y152-L156 HydrophobicContact CE1-CG 4.14Å; Y152-L156 HydrophobicContact CE2-CD1 4.4Å; Y152-L156 HydrophobicContact CE2-CD2 4.25Å; Y152-L156 HydrophobicContact CE2-CG 4.22Å; Y152-L156 WeakPolarHBondContact O-CG 3.36Å; Y152-L156 PolarHBondContact O-N 3.15Å
153	K	96.1	Very high	94.2	Very high	133 Å²	133	74.1 Å²	74.1	58%	0.578	40%	0.396	S	S	*	.	H	α-helix	trans	-62.6	-44.9	175.6	-71.6	172.4	-179.7	179.8	0	111.8	T149 E150 L151 H155 L156 A157	T149-K153 WeakPolarHBondContact O-CG 3.12Å; T149-K153 PolarHBondContact O-N 3.28Å; T149-K153 VanDerWaalsContact O-N 3.17Å; E150-K153 WeakPolarHBondContact O-CB 3.29Å; E150-K153 PolarHBondContact O-N 3.48Å; L151-K153 PolarHBondContact O-N 2.95Å; K153-H155 VanDerWaalsContact C-N 3.33Å; K153-L156 PolarHBondContact O-N 3.29Å; K153-A157 WeakPolarHBondContact O-CB 3.29Å; K153-A157 PolarHBondContact O-N 3.46Å
154	Y	95.9	Very high	94.5	Very high	78 Å²	78	74.9 Å²	74.9	31%	0.306	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-35.4	176.6	-75.9	-66.5	0	0	0	112.5	D135 L141 E150 L151 A157 T158	D135-Y154 HydrophobicContact CB-CE1 4.39Å; L141-Y154 HydrophobicContact CD1-CD2 4.15Å; L141-Y154 HydrophobicContact CD1-CE2 4.2Å; L141-Y154 HydrophobicContact CD2-CD2 3.57Å; L141-Y154 HydrophobicContact CD2-CE2 4.37Å; L141-Y154 HydrophobicContact CD2-CG 3.88Å; E150-Y154 VanDerWaalsContact O-CD2 3.22Å; E150-Y154 WeakPolarHBondContact O-CD2 2.94Å; E150-Y154 PolarHBondContact O-N 3.37Å; L151-Y154 PolarHBondContact O-N 3Å; Y154-A157 PolarHBondContact O-N 3.24Å; Y154-T158 VanDerWaalsContact O-CB 3.29Å; Y154-T158 WeakPolarHBondContact O-CB 3.37Å; Y154-T158 PolarHBondContact O-N 3.17Å; Y154-T158 PolarHBondContact O-OG1 2.85Å
155	H	95.9	Very high	94.6	Very high	72 Å²	72	73.9 Å²	73.9	33%	0.333	39%	0.393	S	S	.	.	H	α-helix	trans	-58.8	-52.3	172.7	171.6	84	0	0	0	110.7	L131 V133 L151 Y152 K153 A157 T158 V159	L131-H155 WeakPolarHBondContact CD2-CE1 3.36Å; L131-H155 VanDerWaalsContact CD2-ND1 3.29Å; L131-H155 WeakPolarHBondContact CD2-ND1 3.29Å; V133-H155 HydrophobicContact CG2-CB 4.14Å; L151-H155 WeakPolarHBondContact O-CB 3.45Å; L151-H155 PolarHBondContact O-N 3.33Å; Y152-H155 WeakPolarHBondContact O-CB 3.44Å; Y152-H155 PolarHBondContact O-N 2.77Å; K153-H155 VanDerWaalsContact C-N 3.33Å; H155-A157 PolarHBondContact O-N 2.68Å; H155-T158 WeakPolarHBondContact O-CB 3.43Å; H155-T158 PolarHBondContact O-N 2.95Å; H155-V159 WeakPolarHBondContact O-CG2 3.48Å; H155-V159 PolarHBondContact O-N 2.88Å
156	L	95.9	Very high	94.6	Very high	66 Å²	66	71.2 Å²	71.2	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-59	-47.6	177	-68.2	-178	0	0	0	111.8	Y152 K153 T158 V159 E160	Y152-L156 HydrophobicContact CD1-CD1 4.14Å; Y152-L156 HydrophobicContact CE1-CD1 3.5Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.5Å; Y152-L156 HydrophobicContact CE1-CG 4.14Å; Y152-L156 HydrophobicContact CE2-CD1 4.4Å; Y152-L156 HydrophobicContact CE2-CD2 4.25Å; Y152-L156 HydrophobicContact CE2-CG 4.22Å; Y152-L156 WeakPolarHBondContact O-CG 3.36Å; Y152-L156 PolarHBondContact O-N 3.15Å; K153-L156 PolarHBondContact O-N 3.29Å; L156-T158 VanDerWaalsContact C-N 3.28Å; L156-T158 PolarHBondContact O-N 3.32Å; L156-V159 PolarHBondContact O-N 3.37Å; L156-V159 VanDerWaalsContact O-N 3.14Å; L156-E160 WeakPolarHBondContact O-CB 3.43Å; L156-E160 WeakPolarHBondContact O-CG 3.43Å; L156-E160 PolarHBondContact O-N 3.32Å
157	A	95.1	Very high	94.5	Very high	48 Å²	48	73.2 Å²	73.2	40%	0.397	40%	0.403	S	S	.	.	H	α-helix	trans	-61	-36.5	178.3	0	0	0	0	0	112.7	K153 Y154 H155 R161	K153-A157 WeakPolarHBondContact O-CB 3.29Å; K153-A157 PolarHBondContact O-N 3.46Å; Y154-A157 PolarHBondContact O-N 3.24Å; H155-A157 PolarHBondContact O-N 2.68Å; A157-R161 VanDerWaalsContact O-CB 3.27Å; A157-R161 WeakPolarHBondContact O-CB 3.36Å; A157-R161 PolarHBondContact O-N 3.06Å
158	T	95.6	Very high	93.3	Very high	2 Å²	2	77 Å²	77	1%	0.012	42%	0.423	C	S	.	.	H	α-helix	trans	-65.5	-47	174.5	-61.5	0	0	0	0	110.4	L131 V132 R134 Y154 H155 L156 R161 I162	L131-T158 HydrophobicContact CD1-CG2 3.82Å; L131-T158 HydrophobicContact CG-CG2 4.35Å; V132-T158 WeakPolarHBondContact O-CG2 3.45Å; R134-T158 PolarHBondContact N-OG1 3.34Å; R134-T158 VanDerWaalsContact N-OG1 3.15Å; R134-T158 PolarHBondContact O-OG1 3.23Å; Y154-T158 VanDerWaalsContact O-CB 3.29Å; Y154-T158 WeakPolarHBondContact O-CB 3.37Å; Y154-T158 PolarHBondContact O-N 3.17Å; Y154-T158 PolarHBondContact O-OG1 2.85Å; H155-T158 WeakPolarHBondContact O-CB 3.43Å; H155-T158 PolarHBondContact O-N 2.95Å; L156-T158 VanDerWaalsContact C-N 3.28Å; L156-T158 PolarHBondContact O-N 3.32Å; T158-R161 PolarHBondContact O-N 3.49Å; T158-I162 HydrophobicContact CG2-CD1 4Å; T158-I162 VanDerWaalsContact O-CG1 3.26Å; T158-I162 WeakPolarHBondContact O-CG1 3.22Å; T158-I162 PolarHBondContact O-N 3.37Å
159	V	95.6	Very high	93.2	Very high	53 Å²	53	74.6 Å²	74.6	32%	0.321	41%	0.406	S	S	.	.	H	α-helix	trans	-61.5	-45.9	178	172.1	0	0	0	0	111.3	L131 H155 L156 R161 I162 A163	L131-V159 HydrophobicContact CD2-CG2 3.79Å; H155-V159 WeakPolarHBondContact O-CG2 3.48Å; H155-V159 PolarHBondContact O-N 2.88Å; L156-V159 PolarHBondContact O-N 3.37Å; L156-V159 VanDerWaalsContact O-N 3.14Å; V159-R161 VanDerWaalsContact C-N 3.35Å; V159-R161 PolarHBondContact O-N 2.93Å; V159-I162 PolarHBondContact O-N 3.43Å; V159-A163 WeakPolarHBondContact O-CB 3.39Å; V159-A163 PolarHBondContact O-N 2.81Å
160	E	94.9	Very high	93.1	Very high	133 Å²	133	73.5 Å²	73.5	62%	0.621	40%	0.397	S	S	*	.	H	α-helix	trans	-60.1	-43.9	176.8	-74.1	174.1	179.5	0	0	111.7	L156 I162 A163 A164	L156-E160 WeakPolarHBondContact O-CB 3.43Å; L156-E160 WeakPolarHBondContact O-CG 3.43Å; L156-E160 PolarHBondContact O-N 3.32Å; E160-I162 PolarHBondContact O-N 2.87Å; E160-A163 PolarHBondContact O-N 3.47Å; E160-A164 WeakPolarHBondContact O-CB 3.29Å; E160-A164 PolarHBondContact O-N 3.32Å
161	R	94.1	Very high	93	Very high	37 Å²	37	72.5 Å²	72.5	14%	0.14	40%	0.396	C	S	.	.	H	α-helix	trans	-61.8	-42.3	176.6	175.6	174.9	56.6	85.5	5.3	112.1	Y114 L118 D121 A157 T158 V159 E165	Y114-R161 WeakPolarHBondContact OH-CD 3.49Å; L118-R161 HydrophobicContact CD1-CG 3.62Å; D121-R161 IonicContact OD2-CZ 3.27Å; D121-R161 VanDerWaalsContact OD2-CZ 3.27Å; D121-R161 IonicContact OD2-NH1 2.85Å; D121-R161 PolarHBondContact OD2-NH1 3.48Å; D121-R161 IonicContact OD2-NH2 2.74Å; D121-R161 PolarHBondContact OD2-NH2 2.95Å; A157-R161 VanDerWaalsContact O-CB 3.27Å; A157-R161 WeakPolarHBondContact O-CB 3.36Å; A157-R161 PolarHBondContact O-N 3.06Å; T158-R161 PolarHBondContact O-N 3.49Å; V159-R161 VanDerWaalsContact C-N 3.35Å; V159-R161 PolarHBondContact O-N 2.93Å; R161-E165 PolarHBondContact O-N 2.66Å; R161-E165 VanDerWaalsContact O-N 3.13Å
162	I	95	Very high	92.9	Very high	2 Å²	2	73.3 Å²	73.3	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-66.3	-42.7	176.8	-64.1	162.7	0	0	0	110.4	D121 V122 R125 L131 T158 V159 E160 E165 M166	D121-I162 HydrophobicContact CB-CD1 3.68Å; D121-I162 HydrophobicContact CB-CG1 3.65Å; V122-I162 HydrophobicContact CG2-CG2 4.18Å; R125-I162 HydrophobicContact CB-CG2 4.16Å; R125-I162 VanDerWaalsContact CD-CG2 3.47Å; R125-I162 HydrophobicContact CG-CG2 4.46Å; L131-I162 HydrophobicContact CD1-CD1 3.29Å; T158-I162 HydrophobicContact CG2-CD1 4Å; T158-I162 VanDerWaalsContact O-CG1 3.26Å; T158-I162 WeakPolarHBondContact O-CG1 3.22Å; T158-I162 PolarHBondContact O-N 3.37Å; V159-I162 PolarHBondContact O-N 3.43Å; E160-I162 PolarHBondContact O-N 2.87Å; I162-E165 PolarHBondContact O-N 2.84Å; I162-M166 HydrophobicContact CG2-CG 4.34Å; I162-M166 HydrophobicContact CG2-SD 3.89Å; I162-M166 WeakPolarHBondContact O-CB 3.24Å; I162-M166 WeakPolarHBondContact O-CG 3.3Å; I162-M166 PolarHBondContact O-N 3.32Å
163	A	94.7	Very high	92.7	Very high	19 Å²	19	68.9 Å²	68.9	16%	0.157	39%	0.391	C	S	.	.	H	α-helix	trans	-60.2	-46.6	178	0	0	0	0	0	111.5	V159 E160 E165 M166 G167 V168	V159-A163 WeakPolarHBondContact O-CB 3.39Å; V159-A163 PolarHBondContact O-N 2.81Å; E160-A163 PolarHBondContact O-N 3.47Å; A163-E165 PolarHBondContact O-N 3.21Å; A163-M166 CarbonylContact O-C 3.59Å; A163-M166 PolarHBondContact O-N 3.03Å; A163-G167 PolarHBondContact O-N 3.07Å; A163-V168 CarbonylContact C-O 3.57Å; A163-V168 HydrophobicContact CB-CG2 4.02Å; A163-V168 PolarHBondContact O-N 3.25Å
164	A	94.4	Very high	92.5	Very high	79 Å²	79	64.7 Å²	64.7	65%	0.653	38%	0.378	S	S	*	.	H	α-helix	trans	-59.1	-42.1	176	0	0	0	0	0	113	E160 G167	E160-A164 WeakPolarHBondContact O-CB 3.29Å; E160-A164 PolarHBondContact O-N 3.32Å; A164-G167 PolarHBondContact O-N 2.77Å
165	E	92.1	Very high	92.2	Very high	106 Å²	106	63.7 Å²	63.7	50%	0.495	38%	0.383	S	S	.	.	H	α-helix	trans	-69.9	-33.2	177.8	-173.2	67.4	-169.5	0	0	112.5	L118 V122 R161 I162 A163 G167	L118-E165 HydrophobicContact CD1-CB 4.06Å; L118-E165 HydrophobicContact CD1-CG 4.21Å; L118-E165 HydrophobicContact CD2-CB 4.47Å; L118-E165 HydrophobicContact CD2-CG 4.07Å; L118-E165 HydrophobicContact CG-CB 4.41Å; L118-E165 HydrophobicContact CG-CG 4.02Å; V122-E165 HydrophobicContact CG2-CB 3.94Å; V122-E165 HydrophobicContact CG2-CG 3.71Å; R161-E165 PolarHBondContact O-N 2.66Å; R161-E165 VanDerWaalsContact O-N 3.13Å; I162-E165 PolarHBondContact O-N 2.84Å; A163-E165 PolarHBondContact O-N 3.21Å; E165-G167 VanDerWaalsContact C-N 3.29Å
166	M	89.3	Confident	92	Very high	69 Å²	69	63.1 Å²	63.1	34%	0.34	39%	0.387	S	S	.	.	H	α-helix	trans	-77.5	-14.1	174.7	-70.7	-176.7	75.8	0	0	113.3	V122 R125 M126 I162 A163 V168	V122-M166 HydrophobicContact CG1-CG 3.77Å; V122-M166 HydrophobicContact CG1-SD 4.34Å; V122-M166 HydrophobicContact CG2-CG 4.18Å; R125-M166 HydrophobicContact CB-SD 4.4Å; R125-M166 HydrophobicContact CG-SD 4.14Å; R125-M166 PolarHBondContact NH1-SD 3.48Å; M126-M166 HydrophobicContact CG-CE 3.98Å; I162-M166 HydrophobicContact CG2-CG 4.34Å; I162-M166 HydrophobicContact CG2-SD 3.89Å; I162-M166 WeakPolarHBondContact O-CB 3.24Å; I162-M166 WeakPolarHBondContact O-CG 3.3Å; I162-M166 PolarHBondContact O-N 3.32Å; A163-M166 CarbonylContact O-C 3.59Å; A163-M166 PolarHBondContact O-N 3.03Å; M166-V168 HydrophobicContact CB-CG2 3.98Å
167	G	88.5	Confident	91.6	Very high	69 Å²	69	62.8 Å²	62.8	71%	0.711	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	32.3	-174.7	0	0	0	0	0	113.7	A163 A164 E165	A163-G167 PolarHBondContact O-N 3.07Å; A164-G167 PolarHBondContact O-N 2.77Å; E165-G167 VanDerWaalsContact C-N 3.29Å
168	V	70.2	Confident	91.3	Very high	137 Å²	137	64.2 Å²	64.2	83%	0.83	39%	0.39	S	S	*	.			trans	-116.5	0	177.4	-62.9	0	0	0	0	112.8	A163 M166	A163-V168 CarbonylContact C-O 3.57Å; A163-V168 HydrophobicContact CB-CG2 4.02Å; A163-V168 PolarHBondContact O-N 3.25Å; M166-V168 HydrophobicContact CB-CG2 3.98Å

Retrieved 168 of 168 residues in 150.5 ms (Link to these results)

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