A0A061IQ01_CRIGR Loading...

C-X-C motif chemokine

AlphaFold DB , UniProt , Accession A0A061IQ01, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene n/a, Length 199 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	39.8	Very low	42.9	Very low	242 Å²	242	159.2 Å²	159.2	100%	1.192	86%	0.864	S	S	*	*				0	99	0	30.1	-161.8	156.6	0	0	108.4
2	S	37.4	Very low	42.8	Very low	113 Å²	113	159.4 Å²	159.4	79%	0.79	86%	0.863	S	S	*	*			trans	-36.9	157.2	164.9	-36.7	0	0	0	0	113.1
3	L	36.1	Very low	43.4	Very low	167 Å²	167	152.9 Å²	152.9	87%	0.874	86%	0.856	S	S	*	*			cis	-158.8	157.8	32.3	-75.5	165	0	0	0	110.5
4	V	39.4	Very low	44	Very low	131 Å²	131	147.3 Å²	147.3	79%	0.794	85%	0.849	S	S	*	*			trans	-97.1	176.6	160.4	-175.6	0	0	0	0	107.2
5	P	61.2	Low	44.6	Very low	115 Å²	115	141.9 Å²	141.9	75%	0.747	82%	0.824	S	S	*	*				-117.2	-175.9	-59.7	38.4	-23.1	0	0	0	112.5
6	C	34.4	Very low	45.2	Very low	132 Å²	132	147.9 Å²	147.9	89%	0.892	83%	0.828	S	S	*	*			trans	-155.7	158.1	146.3	-145.9	0	0	0	0	114
7	R	40.7	Very low	45.9	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	81%	0.814	S	S	*	*			trans	-82	147.6	-153.2	-75.6	164.1	164.5	-150.7	-1.8	117
8	S	44.9	Very low	46.3	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	80%	0.801	S	S	*	*			trans	27.2	128.5	131.7	-147.8	0	0	0	0	121.2
9	A	45	Very low	46.8	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	80%	0.796	S	S	*	*				-156.4	116.3	129.9	0	0	0	0	0	110.7
10	R	48.2	Very low	47.2	Very low	244 Å²	244	139.3 Å²	139.3	92%	0.921	78%	0.783	S	S	*	*			trans	-76.7	129.6	158.7	-67.1	-173.3	-178.7	177.4	0.9	107.3
11	I	44.6	Very low	47.6	Very low	165 Å²	165	141.5 Å²	141.5	85%	0.846	78%	0.779	S	S	*	*			trans	-114.4	122.2	157.3	-64.1	-166.5	0	0	0	109.1
12	L	42.2	Very low	48.4	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	75%	0.751	S	S	*	*			trans	-59.1	143.1	177.7	-176.6	61.2	0	0	0	111.2
13	G	49.8	Very low	49.4	Very low	75 Å²	75	132.9 Å²	132.9	77%	0.773	74%	0.736	S	S	*	*			trans	-63	166.8	178.8	0	0	0	0	0	114.3
14	G	52.3	Low	50.5	Low	74 Å²	74	132 Å²	132	76%	0.763	73%	0.725	S	S	*	*			trans	144.7	125.5	166.9	0	0	0	0	0	112.4
15	S	53.6	Low	51.3	Low	66 Å²	66	131.2 Å²	131.2	46%	0.462	72%	0.716	S	S	.	*			trans	83.9	45.9	158.4	-145.5	0	0	0	0	119.1
16	R	53.5	Low	51.1	Low	239 Å²	239	132.1 Å²	132.1	90%	0.902	71%	0.714	S	S	*	*	S	Bend	trans	-83.5	-14.5	158.9	-66.3	-176.4	124	-159.8	-0.7	113.4
17	S	57.3	Low	52.1	Low	83 Å²	83	132.4 Å²	132.4	58%	0.58	71%	0.706	S	S	*	*	H	α-helix	trans	-84.3	-31.5	-172.1	-171.1	0	0	0	0	113.9	R21	S17-R21 PolarHBondContact O-N 3.14Å
18	L	53.3	Low	52.7	Low	111 Å²	111	127.3 Å²	127.3	58%	0.581	70%	0.696	S	S	*	*	H	α-helix	trans	-76.3	-39.1	-175.7	-69.2	170.8	0	0	0	112.6	A20 R21 L22	L18-A20 PolarHBondContact O-N 3.22Å; L18-R21 PolarHBondContact O-N 3.34Å; L18-L22 PolarHBondContact O-N 3.46Å; L18-L22 VanDerWaalsContact O-N 3.14Å
19	F	54.4	Low	53.4	Low	161 Å²	161	126.7 Å²	126.7	71%	0.706	69%	0.687	S	S	*	*	H	α-helix	trans	-66.3	-35.9	177.1	-80	-81.5	0	0	0	113	R21 A23	F19-R21 VanDerWaalsContact C-N 3.33Å; F19-R21 PolarHBondContact O-N 3.3Å; F19-A23 PolarHBondContact O-N 3.48Å; F19-A23 VanDerWaalsContact O-N 3.14Å
20	A	56	Low	53.8	Low	64 Å²	64	129 Å²	129	53%	0.529	69%	0.686	S	S	.	*	H	α-helix	trans	-67.4	-34	177.5	0	0	0	0	0	112.3	L18 F24	L18-A20 PolarHBondContact O-N 3.22Å; A20-F24 PolarHBondContact O-N 3.44Å
21	R	55.6	Low	54.1	Low	185 Å²	185	122.7 Å²	122.7	70%	0.698	68%	0.677	S	S	*	*	H	α-helix	trans	-77	-34.6	178.1	-71.9	-161.5	165.7	-149.9	-4.7	113.4	S17 L18 F19 F24 L25	S17-R21 PolarHBondContact O-N 3.14Å; L18-R21 PolarHBondContact O-N 3.34Å; F19-R21 VanDerWaalsContact C-N 3.33Å; F19-R21 PolarHBondContact O-N 3.3Å; R21-F24 PolarHBondContact O-N 2.79Å; R21-L25 PolarHBondContact O-N 3.11Å
22	L	56.2	Low	54.6	Low	118 Å²	118	123.3 Å²	123.3	62%	0.618	68%	0.676	S	S	*	*	H	α-helix	trans	-67	-38.2	174	-81	154.2	0	0	0	112	L18 L26	L18-L22 PolarHBondContact O-N 3.46Å; L18-L22 VanDerWaalsContact O-N 3.14Å; L22-L26 PolarHBondContact O-N 3.14Å
23	A	59.5	Low	54.7	Low	57 Å²	57	123.9 Å²	123.9	47%	0.471	67%	0.674	S	S	.	*	H	α-helix	trans	-65.3	-39.3	175	0	0	0	0	0	112.4	F19 L26	F19-A23 PolarHBondContact O-N 3.48Å; F19-A23 VanDerWaalsContact O-N 3.14Å; A23-L26 PolarHBondContact O-N 3.48Å
24	F	58.2	Low	54.6	Low	147 Å²	147	127.8 Å²	127.8	65%	0.645	68%	0.676	S	S	*	*	H	α-helix	trans	-70.7	-33.1	-179.3	-155.6	-96.4	0	0	0	113.3	A20 R21 L26 L28	A20-F24 PolarHBondContact O-N 3.44Å; R21-F24 PolarHBondContact O-N 2.79Å; F24-L26 VanDerWaalsContact C-N 3.33Å; F24-L28 HydrophobicContact CD1-CD1 4.44Å; F24-L28 HydrophobicContact CE1-CD1 4.42Å
25	L	57.3	Low	54.3	Low	116 Å²	116	128.2 Å²	128.2	61%	0.607	67%	0.673	S	S	*	*	H	α-helix	trans	-70.9	-27.2	176.2	-81.3	163.6	0	0	0	113.1	R21	R21-L25 PolarHBondContact O-N 3.11Å
26	L	55.1	Low	54.2	Low	133 Å²	133	134.8 Å²	134.8	70%	0.696	70%	0.696	S	S	*	*	H	α-helix	trans	-75.8	-23.2	179.2	-148.1	77.9	0	0	0	113.1	L22 A23 F24 T29	L22-L26 PolarHBondContact O-N 3.14Å; A23-L26 PolarHBondContact O-N 3.48Å; F24-L26 VanDerWaalsContact C-N 3.33Å; L26-T29 PolarHBondContact O-OG1 3.45Å
27	L	56	Low	53.9	Low	138 Å²	138	126.5 Å²	126.5	72%	0.723	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-18.7	175.7	-89.5	129.1	0	0	0	113.5
28	L	54.4	Low	53.8	Low	129 Å²	129	125.5 Å²	125.5	68%	0.675	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-2	-176.7	-72.9	167.8	0	0	0	114.1	F24	F24-L28 HydrophobicContact CD1-CD1 4.44Å; F24-L28 HydrophobicContact CE1-CD1 4.42Å
29	T	58.6	Low	53.7	Low	102 Å²	102	126.9 Å²	126.9	63%	0.626	70%	0.703	S	S	*	*			trans	-108.3	25.7	-178.4	58.2	0	0	0	0	113.6	L26 P31	L26-T29 PolarHBondContact O-OG1 3.45Å; T29-P31 VanDerWaalsContact O-CD 3.24Å; T29-P31 WeakPolarHBondContact O-CD 3.41Å
30	L	53	Low	53.5	Low	140 Å²	140	123.7 Å²	123.7	73%	0.733	71%	0.707	S	S	*	*			trans	-79.7	114.9	164.6	-103	75.3	0	0	0	108.9	Q32	L30-Q32 PolarHBondContact O-N 3.29Å
31	P	55.5	Low	53.2	Low	112 Å²	112	125 Å²	125	73%	0.727	72%	0.717	S	S	*	*			trans	-64.7	108.9	171.2	24.9	-30.1	0	0	0	108.6	T29 H33	T29-P31 VanDerWaalsContact O-CD 3.24Å; T29-P31 WeakPolarHBondContact O-CD 3.41Å; P31-H33 PolarHBondContact O-N 3.11Å
32	Q	54.5	Low	52.8	Low	177 Å²	177	121.4 Å²	121.4	83%	0.827	73%	0.728	S	S	*	*			trans	-69	86.5	162.4	-66.5	-174	-46.5	0	0	107.2	L30 L34	L30-Q32 PolarHBondContact O-N 3.29Å; Q32-L34 PolarHBondContact O-N 2.79Å
33	H	44.8	Very low	52.3	Low	175 Å²	175	119.8 Å²	119.8	81%	0.81	73%	0.731	S	S	*	*			trans	-69.3	85.4	167.1	-135.7	-78.6	0	0	0	107	P31 A35	P31-H33 PolarHBondContact O-N 3.11Å; H33-A35 PolarHBondContact O-N 3.44Å
34	L	47.1	Very low	51.6	Low	156 Å²	156	121.2 Å²	121.2	82%	0.817	74%	0.743	S	S	*	*			trans	-66.9	87.9	162.2	-83.7	164.1	0	0	0	106.5	Q32 E36	Q32-L34 PolarHBondContact O-N 2.79Å; L34-E36 PolarHBondContact O-N 3.42Å
35	A	47.6	Very low	51	Low	84 Å²	84	119.4 Å²	119.4	69%	0.694	76%	0.755	S	S	*	*			trans	-61.8	111.9	157.3	0	0	0	0	0	106.8	H33 G37	H33-A35 PolarHBondContact O-N 3.44Å; A35-G37 PolarHBondContact O-N 3.4Å
36	E	50.8	Low	50.8	Low	203 Å²	203	118.2 Å²	118.2	95%	0.949	75%	0.753	S	S	*	*			trans	-60.6	91.2	162.2	-78.8	-167.9	114	0	0	108.6	L34	L34-E36 PolarHBondContact O-N 3.42Å
37	G	47.3	Very low	50.8	Low	66 Å²	66	119.5 Å²	119.5	68%	0.68	76%	0.755	S	S	*	*			trans	-104.1	120.2	156.1	0	0	0	0	0	107.2	A35	A35-G37 PolarHBondContact O-N 3.4Å
38	G	54.5	Low	51.4	Low	61 Å²	61	117.1 Å²	117.1	63%	0.629	74%	0.743	S	S	*	*			trans	-50	167.4	-174.3	0	0	0	0	0	115.7	A40	G38-A40 PolarHBondContact O-N 2.87Å
39	P	51.3	Low	52.7	Low	140 Å²	140	119.1 Å²	119.1	91%	0.909	74%	0.741	S	S	*	*			trans	-62.9	95.9	-171.8	24.4	-32	0	0	0	111.5	A41	P39-A41 PolarHBondContact O-N 2.86Å; P39-A41 VanDerWaalsContact O-N 3.11Å
40	A	49.6	Very low	54.3	Low	95 Å²	95	115.2 Å²	115.2	79%	0.785	72%	0.718	S	S	*	*			trans	-72.4	98.5	160.4	0	0	0	0	0	106.5	G38 A42	G38-A40 PolarHBondContact O-N 2.87Å; A40-A42 PolarHBondContact O-N 2.88Å; A40-A42 VanDerWaalsContact O-N 3.11Å
41	A	50.3	Low	56.2	Low	90 Å²	90	112.9 Å²	112.9	74%	0.744	71%	0.709	S	S	*	*			trans	-47	120.9	169.6	0	0	0	0	0	109	P39 A43	P39-A41 PolarHBondContact O-N 2.86Å; P39-A41 VanDerWaalsContact O-N 3.11Å; A41-A43 PolarHBondContact O-N 3.01Å
42	A	46.9	Very low	58	Low	111 Å²	111	108.2 Å²	108.2	92%	0.917	68%	0.679	S	S	*	*			trans	-66.7	78	167	0	0	0	0	0	108.4	A40	A40-A42 PolarHBondContact O-N 2.88Å; A40-A42 VanDerWaalsContact O-N 3.11Å
43	A	45.4	Very low	59.7	Low	83 Å²	83	107.8 Å²	107.8	69%	0.686	68%	0.681	S	S	*	*			trans	-85.9	133.5	162.1	0	0	0	0	0	107.3	A41 A45	A41-A43 PolarHBondContact O-N 3.01Å; A43-A45 PolarHBondContact O-N 2.67Å
44	A	45.3	Very low	61.8	Low	88 Å²	88	103.9 Å²	103.9	73%	0.727	67%	0.674	S	S	*	*			trans	-37.2	134.7	178.5	0	0	0	0	0	112.4	T46	A44-T46 PolarHBondContact O-N 3.18Å
45	A	45	Very low	63.9	Low	109 Å²	109	100.3 Å²	100.3	90%	0.901	66%	0.659	S	S	*	*			trans	-67.8	73.2	-179.3	0	0	0	0	0	111.8	A43	A43-A45 PolarHBondContact O-N 2.67Å
46	T	54.8	Low	65.9	Low	90 Å²	90	99 Å²	99	55%	0.552	64%	0.642	S	S	*	*			trans	-71.9	125.8	146.6	47.9	0	0	0	0	106.3	A44 L48	A44-T46 PolarHBondContact O-N 3.18Å; T46-L48 WeakPolarHBondContact O-CG 3.48Å; T46-L48 PolarHBondContact O-N 3.27Å; T46-L48 WeakPolarHBondContact OG1-CD2 3.24Å
47	E	54.4	Low	67.2	Low	161 Å²	161	93.9 Å²	93.9	75%	0.752	63%	0.627	S	S	*	*			trans	-52.5	102.8	168.4	-88.3	-173.4	161.6	0	0	108.8	R49	E47-R49 PolarHBondContact O-N 2.9Å; E47-R49 IonicContact OE2-NH2 3.87Å
48	L	68.6	Low	68.9	Low	87 Å²	87	101 Å²	101	46%	0.455	63%	0.633	S	S	.	*			trans	-74.3	112.8	-177.4	-64.2	-178	0	0	0	108.3	T46 C50 P77	T46-L48 WeakPolarHBondContact O-CG 3.48Å; T46-L48 PolarHBondContact O-N 3.27Å; T46-L48 WeakPolarHBondContact OG1-CD2 3.24Å; L48-C50 PolarHBondContact O-N 3.25Å; L48-P77 HydrophobicContact CD1-CG 4Å; L48-P77 VanDerWaalsContact CD2-CD 3.48Å; L48-P77 HydrophobicContact CD2-CG 4.13Å
49	R	82.5	Confident	70.5	Confident	172 Å²	172	99.4 Å²	99.4	65%	0.649	61%	0.609	S	S	*	*			trans	-95	50.2	177	-62.7	-173.5	178.2	-165.3	-0.5	110.3	E47 Q75	E47-R49 PolarHBondContact O-N 2.9Å; E47-R49 IonicContact OE2-NH2 3.87Å; R49-Q75 PolarHBondContact N-O 3.32Å
50	C	91.1	Very high	72.2	Confident	19 Å²	19	96.8 Å²	96.8	13%	0.128	59%	0.588	C	S	.	*			trans	-62.3	139.2	170.6	-65	0	0	0	0	109.5	L48 C52 C76 E80	L48-C50 PolarHBondContact O-N 3.25Å; C50-C52 VanDerWaalsContact C-N 3.32Å; C50-C76 VanDerWaalsContact CA-SG 3.56Å; C50-C76 HydrophobicContact CB-CB 3.97Å; C50-C76 WeakPolarHBondContact CB-SG 3.2Å; C50-C76 WeakPolarHBondContact SG-CB 3.3Å; C50-C76 CovalentContact SG-SG 2.04Å; C50-C76 PolarHBondContact SG-SG 3.43Å; C50-E80 WeakPolarHBondContact CB-OE1 3.43Å
51	V	92.2	Very high	74.1	Confident	92 Å²	92	93.2 Å²	93.2	56%	0.558	56%	0.557	S	S	*	*	S	Bend	trans	-70.9	-36.5	177.4	-178.7	0	0	0	0	110.2	I70 E80 I82	V51-I70 HydrophobicContact CG2-CD1 4.48Å; V51-E80 PolarHBondContact N-OE1 2.73Å; V51-E80 PolarHBondContact N-OE2 3.46Å; V51-I82 HydrophobicContact CB-CD1 4.18Å; V51-I82 HydrophobicContact CG1-CD1 3.68Å
52	C	93.1	Very high	75.8	Confident	13 Å²	13	96.8 Å²	96.8	9%	0.088	56%	0.555	C	S	.	*			trans	-93.8	110	-177.1	-67.3	0	0	0	0	111.8	C50 E80 C92	C50-C52 VanDerWaalsContact C-N 3.32Å; C52-E80 VanDerWaalsContact CB-OE1 3.31Å; C52-E80 WeakPolarHBondContact CB-OE1 3.14Å; C52-E80 PolarHBondContact N-OE1 3.37Å; C52-C92 WeakPolarHBondContact CA-SG 3.49Å; C52-C92 HydrophobicContact CB-CB 3.59Å; C52-C92 WeakPolarHBondContact CB-SG 3.32Å; C52-C92 WeakPolarHBondContact SG-CB 3.04Å; C52-C92 CovalentContact SG-SG 2.03Å; C52-C92 PolarHBondContact SG-SG 3.45Å
53	L	90.5	Very high	77.9	Confident	168 Å²	168	96 Å²	96	88%	0.88	53%	0.534	S	S	*	.	S	Bend	trans	-88.6	-28.1	172.7	-58.2	179.9	0	0	0	112.8
54	S	89.3	Confident	80.1	Confident	94 Å²	94	92.1 Å²	92.1	66%	0.657	50%	0.502	S	S	*	.	S	Bend	trans	-140.1	147.8	178.5	61.6	0	0	0	0	110.5	C92	S54-C92 WeakPolarHBondContact O-CB 3.18Å
55	V	91.3	Very high	82.4	Confident	81 Å²	81	89.6 Å²	89.6	49%	0.491	48%	0.481	S	S	.	.			trans	-111.2	142.2	-178.6	-65.3	0	0	0	0	111.2	D94	V55-D94 HydrophobicContact CB-CB 4.4Å; V55-D94 HydrophobicContact CG2-CB 4.46Å
56	T	89.4	Confident	84.6	Confident	55 Å²	55	85 Å²	85	34%	0.337	44%	0.441	S	S	.	.	B	Isolated β-bridge	trans	-101.3	114.8	172.2	-56.8	0	0	0	0	108.6	R58 C92 L93	T56-R58 PolarHBondContact O-N 3.15Å; T56-C92 WeakPolarHBondContact CB-O 3.34Å; T56-C92 PolarHBondContact N-O 2.8Å; T56-L93 WeakPolarHBondContact O-CD2 3.32Å
57	P	79.5	Confident	86.5	Confident	97 Å²	97	80.7 Å²	80.7	63%	0.63	42%	0.415	S	S	*	.			trans	-75.4	-23.5	-170.8	27.6	-35	0	0	0	113.5
58	R	81.9	Confident	88.4	Confident	214 Å²	214	74.6 Å²	74.6	81%	0.808	39%	0.387	S	S	*	.			trans	-132.8	128	-172.8	-155.7	174.9	-154.1	-116.9	5.6	112.3	T56	T56-R58 PolarHBondContact O-N 3.15Å
59	I	87.5	Confident	89.7	Confident	28 Å²	28	70.5 Å²	70.5	14%	0.144	37%	0.365	C	S	.	.			trans	-145.9	144.4	171.3	-164.1	138.2	0	0	0	111.3	P61 I64 L85 V91 L93	I59-P61 WeakPolarHBondContact O-CD 3.5Å; I59-I64 HydrophobicContact CG2-CD1 3.96Å; I59-L85 HydrophobicContact CD1-CD1 3.83Å; I59-L85 HydrophobicContact CD1-CD2 3.36Å; I59-L85 HydrophobicContact CD1-CG 4.17Å; I59-L85 HydrophobicContact CG1-CD2 4.21Å; I59-V91 HydrophobicContact CD1-CG2 3.68Å; I59-L93 HydrophobicContact CB-CD2 4.22Å; I59-L93 HydrophobicContact CG2-CD1 3.85Å; I59-L93 HydrophobicContact CG2-CD2 3.8Å
60	N	88.3	Confident	90.2	Very high	85 Å²	85	63.7 Å²	63.7	46%	0.455	34%	0.341	S	S	.	.			trans	-75.2	120.5	171.7	-173	-26.2	0	0	0	108.4	K62 M63	N60-K62 PolarHBondContact O-N 3.27Å; N60-K62 VanDerWaalsContact O-N 3.09Å; N60-K62 WeakPolarHBondContact OD1-CB 3.14Å; N60-K62 PolarHBondContact OD1-N 2.89Å; N60-M63 HydrophobicContact CB-CG 4.3Å; N60-M63 HydrophobicContact CB-SD 4.09Å; N60-M63 PolarHBondContact O-N 3.18Å; N60-M63 VanDerWaalsContact O-N 3.1Å
61	P	88.1	Confident	90.3	Very high	21 Å²	21	64 Å²	64	14%	0.136	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-47.2	-46.3	176.6	-26.1	30.9	0	0	0	110.7	I59 M63 I64 V103 K106 R159	I59-P61 WeakPolarHBondContact O-CD 3.5Å; P61-M63 PolarHBondContact O-N 3.24Å; P61-I64 WeakPolarHBondContact O-CB 3.23Å; P61-I64 WeakPolarHBondContact O-CG1 3.33Å; P61-I64 PolarHBondContact O-N 3.06Å; P61-V103 HydrophobicContact CB-CG1 4.37Å; P61-V103 HydrophobicContact CG-CB 4.42Å; P61-V103 HydrophobicContact CG-CG1 4.37Å; P61-V103 HydrophobicContact CG-CG2 4.01Å; P61-K106 HydrophobicContact CB-CD 4.45Å; P61-K106 HydrophobicContact CG-CD 4.01Å; P61-R159 PolarHBondContact O-NH1 3.37Å; P61-R159 PolarHBondContact O-NH2 2.83Å
62	K	87.4	Confident	90.3	Very high	164 Å²	164	61.7 Å²	61.7	71%	0.713	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-53.5	-22.3	-174	-65.4	-175.5	179.3	-179.5	0	115.5	N60 K86 R159	N60-K62 PolarHBondContact O-N 3.27Å; N60-K62 VanDerWaalsContact O-N 3.09Å; N60-K62 WeakPolarHBondContact OD1-CB 3.14Å; N60-K62 PolarHBondContact OD1-N 2.89Å; K62-K86 WeakPolarHBondContact O-CE 3Å; K62-K86 PolarHBondContact O-NZ 3.31Å; K62-R159 VanDerWaalsContact C-NH1 3.3Å; K62-R159 PolarHBondContact O-NH1 2.88Å
63	M	90.4	Very high	90.1	Very high	95 Å²	95	62.6 Å²	62.6	47%	0.468	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-83.7	-18.4	178	-63	173.5	69.4	0	0	114	N60 P61 L85 K86	N60-M63 HydrophobicContact CB-CG 4.3Å; N60-M63 HydrophobicContact CB-SD 4.09Å; N60-M63 PolarHBondContact O-N 3.18Å; N60-M63 VanDerWaalsContact O-N 3.1Å; P61-M63 PolarHBondContact O-N 3.24Å; M63-L85 HydrophobicContact CB-CD2 4.48Å; M63-L85 CarbonylContact O-C 3.3Å; M63-L85 WeakPolarHBondContact O-CA 3.35Å; M63-K86 WeakPolarHBondContact O-CG 3.03Å; M63-K86 PolarHBondContact O-N 2.89Å
64	I	92.4	Very high	89.9	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	130.9	-179.7	-55.6	173.9	0	0	0	110.1	I59 P61 N66 A83 L85 V103 I107 R159	I59-I64 HydrophobicContact CG2-CD1 3.96Å; P61-I64 WeakPolarHBondContact O-CB 3.23Å; P61-I64 WeakPolarHBondContact O-CG1 3.33Å; P61-I64 PolarHBondContact O-N 3.06Å; I64-N66 VanDerWaalsContact CG2-O 3.24Å; I64-N66 WeakPolarHBondContact CG2-O 3.34Å; I64-A83 HydrophobicContact CD1-CB 4.24Å; I64-A83 HydrophobicContact CG1-CB 4.21Å; I64-A83 HydrophobicContact CG2-CB 4.2Å; I64-L85 HydrophobicContact CG1-CD2 3.95Å; I64-V103 HydrophobicContact CD1-CG1 3.44Å; I64-V103 VanDerWaalsContact CD1-CG1 3.44Å; I64-I107 HydrophobicContact CD1-CD1 4.35Å; I64-I107 HydrophobicContact CG2-CD1 4.24Å; I64-R159 WeakPolarHBondContact O-CD 3.21Å; I64-R159 PolarHBondContact O-NE 2.75Å; I64-R159 PolarHBondContact O-NH1 2.8Å
65	A	91.9	Very high	89.7	Confident	36 Å²	36	61.8 Å²	61.8	30%	0.298	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-44.9	173.1	0	0	0	0	0	111.4	K84 K86 R159	A65-K84 WeakPolarHBondContact CA-O 3.09Å; A65-K84 PolarHBondContact N-O 3.3Å; A65-K86 HydrophobicContact CB-CG 4.1Å; A65-R159 PolarHBondContact O-N 3.05Å
66	N	92.3	Very high	89.6	Confident	11 Å²	11	58.3 Å²	58.3	6%	0.059	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.7	176.3	177.2	32.1	0	0	0	109.5	I64 K84 N156 V157 F158	I64-N66 VanDerWaalsContact CG2-O 3.24Å; I64-N66 WeakPolarHBondContact CG2-O 3.34Å; N66-K84 HydrophobicContact CB-CB 4.2Å; N66-K84 HydrophobicContact CB-CG 4.4Å; N66-K84 PolarHBondContact N-O 3.26Å; N66-K84 VanDerWaalsContact N-O 3.14Å; N66-K84 PolarHBondContact O-N 3.42Å; N66-N156 PolarHBondContact ND2-OD1 2.03Å; N66-V157 WeakPolarHBondContact CA-O 3.35Å; N66-V157 VanDerWaalsContact OD1-C 3.3Å; N66-V157 PolarHBondContact OD1-N 2.86Å; N66-V157 PolarHBondContact OD1-O 2.81Å; N66-V157 VanDerWaalsContact OD1-O 3.05Å; N66-F158 HydrophobicContact CB-CD1 3.78Å; N66-F158 HydrophobicContact CB-CE1 3.92Å; N66-F158 WeakPolarHBondContact ND2-CE1 3.45Å
67	L	94.1	Very high	89.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.9	170.3	-170	76.2	0	0	0	109.8	V69 V81 A83 L93 I104 I107 N156 V157	L67-V69 HydrophobicContact CD2-CG2 4.08Å; L67-V69 HydrophobicContact CG-CG2 4.25Å; L67-V81 HydrophobicContact CD1-CG1 3.61Å; L67-V81 HydrophobicContact CD2-CG1 4.41Å; L67-V81 HydrophobicContact CG-CG1 4.14Å; L67-A83 HydrophobicContact CD1-CB 3.89Å; L67-L93 HydrophobicContact CD1-CD1 4.18Å; L67-I104 HydrophobicContact CD2-CD1 3.73Å; L67-I104 HydrophobicContact CD2-CG1 3.48Å; L67-I104 VanDerWaalsContact CD2-CG1 3.48Å; L67-I107 HydrophobicContact CB-CD1 4.24Å; L67-I107 HydrophobicContact CD2-CD1 4.26Å; L67-N156 CarbonylContact O-C 3.55Å; L67-N156 WeakPolarHBondContact O-CA 3.01Å; L67-V157 HydrophobicContact CB-CB 4.37Å; L67-V157 PolarHBondContact N-O 3.07Å; L67-V157 PolarHBondContact O-N 2.97Å
68	E	95.3	Very high	90.1	Very high	33 Å²	33	62.2 Å²	62.2	15%	0.154	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126	174.9	-175.1	168.4	-175.2	0	0	109	I70 V81 I82 F154 V155	E68-I70 HydrophobicContact CG-CG1 4.09Å; E68-V81 CarbonylContact O-C 3.58Å; E68-V81 WeakPolarHBondContact O-CA 3.12Å; E68-I82 HydrophobicContact CB-CB 4.29Å; E68-I82 PolarHBondContact N-O 3.06Å; E68-I82 PolarHBondContact O-N 3.09Å; E68-F154 HydrophobicContact CG-CD2 4.3Å; E68-V155 CarbonylContact C-O 3.59Å; E68-V155 WeakPolarHBondContact CA-O 3.02Å
69	V	94.5	Very high	90.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	109.5	-180	-174	0	0	0	0	107.7	L67 V79 V81 I104 F154 V155 V192 I195 L196	L67-V69 HydrophobicContact CD2-CG2 4.08Å; L67-V69 HydrophobicContact CG-CG2 4.25Å; V69-V79 HydrophobicContact CG1-CG1 4.36Å; V69-V81 HydrophobicContact CG1-CG2 4.38Å; V69-I104 HydrophobicContact CG2-CD1 4.17Å; V69-F154 CarbonylContact O-C 3.49Å; V69-F154 WeakPolarHBondContact O-CA 3.46Å; V69-F154 WeakPolarHBondContact O-CB 3.35Å; V69-V155 PolarHBondContact N-O 3.46Å; V69-V155 PolarHBondContact O-N 3.06Å; V69-V192 HydrophobicContact CG2-CG1 4.17Å; V69-I195 HydrophobicContact CG1-CB 4.23Å; V69-I195 HydrophobicContact CG1-CG2 3.56Å; V69-L196 HydrophobicContact CG1-CD2 3.9Å
70	I	94.1	Very high	90.9	Very high	30 Å²	30	51.7 Å²	51.7	15%	0.154	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127	-175.5	-54.6	176.1	0	0	0	108.5	V51 E68 V79 E80 I82 F154	V51-I70 HydrophobicContact CG2-CD1 4.48Å; E68-I70 HydrophobicContact CG-CG1 4.09Å; I70-V79 WeakPolarHBondContact O-CA 3.35Å; I70-V79 WeakPolarHBondContact O-CG1 3.02Å; I70-E80 HydrophobicContact CB-CB 4.17Å; I70-E80 HydrophobicContact CD1-CB 4.4Å; I70-E80 PolarHBondContact N-O 3.47Å; I70-E80 PolarHBondContact O-N 3.24Å; I70-I82 HydrophobicContact CD1-CD1 3.78Å; I70-F154 HydrophobicContact CB-CB 4.26Å; I70-F154 HydrophobicContact CG1-CB 3.95Å; I70-F154 HydrophobicContact CG2-CB 4.46Å
71	T	93.8	Very high	91.1	Very high	26 Å²	26	47.7 Å²	47.7	16%	0.16	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-70.5	150.3	177.6	61.5	0	0	0	0	110.8	G73 S153 I195	T71-G73 PolarHBondContact O-N 3.05Å; T71-S153 PolarHBondContact N-O 3.36Å; T71-S153 PolarHBondContact OG1-O 3.24Å; T71-I195 HydrophobicContact CG2-CD1 4.23Å; T71-I195 HydrophobicContact CG2-CG1 4.09Å; T71-I195 HydrophobicContact CG2-CG2 3.8Å
72	A	91.7	Very high	91.5	Very high	43 Å²	43	47.1 Å²	47.1	36%	0.355	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-54.1	139.8	166.6	0	0	0	0	0	110.9	P77 V79	A72-P77 VanDerWaalsContact CB-O 3.32Å; A72-P77 WeakPolarHBondContact CB-O 3.33Å; A72-V79 HydrophobicContact CB-CG2 4.36Å
73	G	88.1	Confident	91.8	Very high	31 Å²	31	39.3 Å²	39.3	32%	0.32	22%	0.223	S	C	.	.			trans	-158.4	-175	-173.6	0	0	0	0	0	113.4	T71 Q75 C76	T71-G73 PolarHBondContact O-N 3.05Å; G73-Q75 PolarHBondContact O-N 2.53Å; G73-C76 PolarHBondContact N-O 3.29Å; G73-C76 CarbonylContact O-C 3.19Å; G73-C76 PolarHBondContact O-N 3.47Å
74	P	86.5	Confident	92.1	Very high	127 Å²	127	38 Å²	38	83%	0.825	22%	0.215	S	C	*	.	S	Bend	trans	-65.8	-26.5	-175.5	26	-34.4	0	0	0	113.4
75	Q	84.9	Confident	92.1	Very high	119 Å²	119	38.6 Å²	38.6	56%	0.556	22%	0.218	S	C	*	.	S	Bend	trans	-85	-25.6	179.6	-59.8	-63.9	-15.3	0	0	112.6	R49 G73	R49-Q75 PolarHBondContact N-O 3.32Å; G73-Q75 PolarHBondContact O-N 2.53Å
76	C	89.5	Confident	92.1	Very high	8 Å²	8	44.1 Å²	44.1	5%	0.054	24%	0.236	C	C	.	.			trans	-152.8	116.9	-178.6	-172.2	0	0	0	0	109.6	C50 G73 R78 E80	C50-C76 VanDerWaalsContact CA-SG 3.56Å; C50-C76 HydrophobicContact CB-CB 3.97Å; C50-C76 WeakPolarHBondContact CB-SG 3.2Å; C50-C76 WeakPolarHBondContact SG-CB 3.3Å; C50-C76 CovalentContact SG-SG 2.04Å; C50-C76 PolarHBondContact SG-SG 3.43Å; G73-C76 PolarHBondContact N-O 3.29Å; G73-C76 CarbonylContact O-C 3.19Å; G73-C76 PolarHBondContact O-N 3.47Å; C76-R78 PolarHBondContact O-N 3.06Å; C76-R78 WeakPolarHBondContact SG-CG 3.46Å; C76-E80 VanDerWaalsContact SG-CD 3.58Å
77	P	89.6	Confident	92.1	Very high	85 Å²	85	48.6 Å²	48.6	55%	0.552	26%	0.259	S	S	*	.	S	Bend	trans	-75.8	-9.1	-173.9	30.5	-38	0	0	0	113.3	L48 A72	L48-P77 HydrophobicContact CD1-CG 4Å; L48-P77 VanDerWaalsContact CD2-CD 3.48Å; L48-P77 HydrophobicContact CD2-CG 4.13Å; A72-P77 VanDerWaalsContact CB-O 3.32Å; A72-P77 WeakPolarHBondContact CB-O 3.33Å
78	R	89.8	Confident	91.9	Very high	148 Å²	148	57 Å²	57	56%	0.558	30%	0.299	S	S	*	.	S	Bend	trans	-103.1	152.7	178.7	66.8	-178	91.4	-163.8	4.7	110.2	C76 E80	C76-R78 PolarHBondContact O-N 3.06Å; C76-R78 WeakPolarHBondContact SG-CG 3.46Å; R78-E80 HydrophobicContact CG-CG 4.28Å
79	V	92.2	Very high	91.9	Very high	14 Å²	14	61.5 Å²	61.5	9%	0.085	32%	0.318	C	S	.	.			trans	-69.3	138.6	166.4	174.1	0	0	0	0	108.3	V69 I70 A72 P95 I195 L196	V69-V79 HydrophobicContact CG1-CG1 4.36Å; I70-V79 WeakPolarHBondContact O-CA 3.35Å; I70-V79 WeakPolarHBondContact O-CG1 3.02Å; A72-V79 HydrophobicContact CB-CG2 4.36Å; V79-P95 HydrophobicContact CB-CB 4.43Å; V79-P95 HydrophobicContact CG1-CB 4.19Å; V79-I195 HydrophobicContact CG1-CG2 4.2Å; V79-I195 VanDerWaalsContact CG2-O 3.23Å; V79-I195 WeakPolarHBondContact CG2-O 3.41Å; V79-L196 HydrophobicContact CG1-CD2 4.47Å
80	E	93.4	Very high	91.9	Very high	8 Å²	8	66.6 Å²	66.6	4%	0.037	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.9	178	-53.3	-172.6	96.7	0	0	109.9	C50 V51 C52 I70 C76 R78	C50-E80 WeakPolarHBondContact CB-OE1 3.43Å; V51-E80 PolarHBondContact N-OE1 2.73Å; V51-E80 PolarHBondContact N-OE2 3.46Å; C52-E80 VanDerWaalsContact CB-OE1 3.31Å; C52-E80 WeakPolarHBondContact CB-OE1 3.14Å; C52-E80 PolarHBondContact N-OE1 3.37Å; I70-E80 HydrophobicContact CB-CB 4.17Å; I70-E80 HydrophobicContact CD1-CB 4.4Å; I70-E80 PolarHBondContact N-O 3.47Å; I70-E80 PolarHBondContact O-N 3.24Å; C76-E80 VanDerWaalsContact SG-CD 3.58Å; R78-E80 HydrophobicContact CG-CG 4.28Å
81	V	94.3	Very high	91.9	Very high	0 Å²	0	66 Å²	66	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.2	178.2	-178	0	0	0	0	108.6	L67 E68 V69 C92 L93 P95 M100 L196	L67-V81 HydrophobicContact CD1-CG1 3.61Å; L67-V81 HydrophobicContact CD2-CG1 4.41Å; L67-V81 HydrophobicContact CG-CG1 4.14Å; E68-V81 CarbonylContact O-C 3.58Å; E68-V81 WeakPolarHBondContact O-CA 3.12Å; V69-V81 HydrophobicContact CG1-CG2 4.38Å; V81-C92 CarbonylContact O-C 3.56Å; V81-C92 WeakPolarHBondContact O-CA 3.04Å; V81-L93 HydrophobicContact CB-CB 4.35Å; V81-L93 HydrophobicContact CG1-CB 4.21Å; V81-L93 HydrophobicContact CG1-CD1 4.4Å; V81-L93 PolarHBondContact O-N 3.49Å; V81-P95 HydrophobicContact CG2-CB 3.94Å; V81-M100 HydrophobicContact CG1-CE 4.38Å; V81-M100 HydrophobicContact CG1-SD 3.91Å; V81-L196 HydrophobicContact CG2-CD2 3.45Å; V81-L196 VanDerWaalsContact CG2-CD2 3.45Å
82	I	95	Very high	92	Very high	9 Å²	9	65.8 Å²	65.8	5%	0.046	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.6	-177.7	-53.3	170.2	0	0	0	108.3	V51 E68 I70 E90	V51-I82 HydrophobicContact CB-CD1 4.18Å; V51-I82 HydrophobicContact CG1-CD1 3.68Å; E68-I82 HydrophobicContact CB-CB 4.29Å; E68-I82 PolarHBondContact N-O 3.06Å; E68-I82 PolarHBondContact O-N 3.09Å; I70-I82 HydrophobicContact CD1-CD1 3.78Å; I82-E90 HydrophobicContact CG2-CB 4.43Å
83	A	95	Very high	92	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.1	173.7	0	0	0	0	0	110.6	I64 L67 L85 E90 V91 L93	I64-A83 HydrophobicContact CD1-CB 4.24Å; I64-A83 HydrophobicContact CG1-CB 4.21Å; I64-A83 HydrophobicContact CG2-CB 4.2Å; L67-A83 HydrophobicContact CD1-CB 3.89Å; A83-L85 HydrophobicContact CB-CD2 4.44Å; A83-E90 WeakPolarHBondContact O-CA 3.44Å; A83-V91 HydrophobicContact CB-CG2 4.08Å; A83-V91 PolarHBondContact N-O 2.99Å; A83-V91 PolarHBondContact O-N 3.36Å; A83-L93 HydrophobicContact CB-CD1 3.58Å; A83-L93 HydrophobicContact CB-CG 4.1Å
84	K	95.3	Very high	92.1	Very high	68 Å²	68	64.7 Å²	64.7	30%	0.296	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	120.2	167	-46.7	-164.7	-177.4	-145.8	0	108.3	A65 N66 E90	A65-K84 WeakPolarHBondContact CA-O 3.09Å; A65-K84 PolarHBondContact N-O 3.3Å; N66-K84 HydrophobicContact CB-CB 4.2Å; N66-K84 HydrophobicContact CB-CG 4.4Å; N66-K84 PolarHBondContact N-O 3.26Å; N66-K84 VanDerWaalsContact N-O 3.14Å; N66-K84 PolarHBondContact O-N 3.42Å; K84-E90 HydrophobicContact CB-CG 4.48Å; K84-E90 HydrophobicContact CD-CG 4.35Å; K84-E90 WeakPolarHBondContact CD-OE1 3.38Å; K84-E90 WeakPolarHBondContact CE-OE1 3.21Å; K84-E90 HydrophobicContact CG-CG 4.01Å; K84-E90 IonicContact NZ-OE1 3.99Å; K84-E90 PolarHBondContact NZ-OE1 3.25Å
85	L	93.9	Very high	92.1	Very high	14 Å²	14	59.6 Å²	59.6	7%	0.073	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	162.4	-177.9	-55.9	-176	0	0	0	111.3	I59 M63 I64 A83 N87 Q88 K89 V91	I59-L85 HydrophobicContact CD1-CD1 3.83Å; I59-L85 HydrophobicContact CD1-CD2 3.36Å; I59-L85 HydrophobicContact CD1-CG 4.17Å; I59-L85 HydrophobicContact CG1-CD2 4.21Å; M63-L85 HydrophobicContact CB-CD2 4.48Å; M63-L85 CarbonylContact O-C 3.3Å; M63-L85 WeakPolarHBondContact O-CA 3.35Å; I64-L85 HydrophobicContact CG1-CD2 3.95Å; A83-L85 HydrophobicContact CB-CD2 4.44Å; L85-N87 WeakPolarHBondContact CB-OD1 3.41Å; L85-N87 PolarHBondContact O-N 3.16Å; L85-Q88 WeakPolarHBondContact O-CA 3.43Å; L85-Q88 PolarHBondContact O-N 3.36Å; L85-K89 WeakPolarHBondContact CB-O 3.39Å; L85-K89 HydrophobicContact CD1-CB 4.42Å; L85-K89 WeakPolarHBondContact CG-O 3.49Å; L85-K89 PolarHBondContact N-O 2.8Å; L85-V91 HydrophobicContact CD1-CG1 4.41Å; L85-V91 HydrophobicContact CD1-CG2 4.37Å; L85-V91 HydrophobicContact CD2-CG2 4.38Å; L85-V91 HydrophobicContact CG-CG2 4.38Å
86	K	91.6	Very high	92.1	Very high	151 Å²	151	62.2 Å²	62.2	66%	0.657	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-24.9	178.2	-74.1	179	175	-175.8	0	113.7	K62 M63 A65 Q88	K62-K86 WeakPolarHBondContact O-CE 3Å; K62-K86 PolarHBondContact O-NZ 3.31Å; M63-K86 WeakPolarHBondContact O-CG 3.03Å; M63-K86 PolarHBondContact O-N 2.89Å; A65-K86 HydrophobicContact CB-CG 4.1Å; K86-Q88 PolarHBondContact O-N 3.05Å
87	N	91.9	Very high	91.8	Very high	105 Å²	105	62.5 Å²	62.5	56%	0.561	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	17.4	171.3	67.7	-23.4	0	0	0	112.7	L85 K89	L85-N87 WeakPolarHBondContact CB-OD1 3.41Å; L85-N87 PolarHBondContact O-N 3.16Å; N87-K89 PolarHBondContact O-N 3.47Å; N87-K89 PolarHBondContact OD1-N 2.92Å
88	Q	90.6	Very high	91.4	Very high	179 Å²	179	63.2 Å²	63.2	84%	0.836	31%	0.306	S	S	*	.	S	Bend	trans	63.8	6	179.8	-55.1	-179.3	-13.7	0	0	115.5	L85 K86	L85-Q88 WeakPolarHBondContact O-CA 3.43Å; L85-Q88 PolarHBondContact O-N 3.36Å; K86-Q88 PolarHBondContact O-N 3.05Å
89	K	94.1	Very high	91.1	Very high	126 Å²	126	59.4 Å²	59.4	55%	0.548	30%	0.299	S	S	.	.			trans	-76	137.2	172.8	-174.5	175.7	-178.8	177.8	0	110.3	L85 N87 V91	L85-K89 WeakPolarHBondContact CB-O 3.39Å; L85-K89 HydrophobicContact CD1-CB 4.42Å; L85-K89 WeakPolarHBondContact CG-O 3.49Å; L85-K89 PolarHBondContact N-O 2.8Å; N87-K89 PolarHBondContact O-N 3.47Å; N87-K89 PolarHBondContact OD1-N 2.92Å; K89-V91 HydrophobicContact CD-CG1 4.38Å; K89-V91 HydrophobicContact CG-CG1 4.33Å
90	E	94.6	Very high	90.7	Very high	108 Å²	108	59.2 Å²	59.2	51%	0.505	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.9	171.8	-54.9	-167.2	166.3	0	0	110	I82 A83 K84	I82-E90 HydrophobicContact CG2-CB 4.43Å; A83-E90 WeakPolarHBondContact O-CA 3.44Å; K84-E90 HydrophobicContact CB-CG 4.48Å; K84-E90 HydrophobicContact CD-CG 4.35Å; K84-E90 WeakPolarHBondContact CD-OE1 3.38Å; K84-E90 WeakPolarHBondContact CE-OE1 3.21Å; K84-E90 HydrophobicContact CG-CG 4.01Å; K84-E90 IonicContact NZ-OE1 3.99Å; K84-E90 PolarHBondContact NZ-OE1 3.25Å
91	V	94.6	Very high	90.3	Very high	17 Å²	17	63 Å²	63	10%	0.103	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	135.5	175.5	-63.8	0	0	0	0	109.7	I59 A83 L85 K89 L93	I59-V91 HydrophobicContact CD1-CG2 3.68Å; A83-V91 HydrophobicContact CB-CG2 4.08Å; A83-V91 PolarHBondContact N-O 2.99Å; A83-V91 PolarHBondContact O-N 3.36Å; L85-V91 HydrophobicContact CD1-CG1 4.41Å; L85-V91 HydrophobicContact CD1-CG2 4.37Å; L85-V91 HydrophobicContact CD2-CG2 4.38Å; L85-V91 HydrophobicContact CG-CG2 4.38Å; K89-V91 HydrophobicContact CD-CG1 4.38Å; K89-V91 HydrophobicContact CG-CG1 4.33Å; V91-L93 HydrophobicContact CG2-CD2 3.96Å
92	C	94.8	Very high	90	Very high	22 Å²	22	69.7 Å²	69.7	15%	0.149	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	137	169.5	-72.5	0	0	0	0	109.7	C52 S54 T56 V81	C52-C92 WeakPolarHBondContact CA-SG 3.49Å; C52-C92 HydrophobicContact CB-CB 3.59Å; C52-C92 WeakPolarHBondContact CB-SG 3.32Å; C52-C92 WeakPolarHBondContact SG-CB 3.04Å; C52-C92 CovalentContact SG-SG 2.03Å; C52-C92 PolarHBondContact SG-SG 3.45Å; S54-C92 WeakPolarHBondContact O-CB 3.18Å; T56-C92 WeakPolarHBondContact CB-O 3.34Å; T56-C92 PolarHBondContact N-O 2.8Å; V81-C92 CarbonylContact O-C 3.56Å; V81-C92 WeakPolarHBondContact O-CA 3.04Å
93	L	92.6	Very high	89.6	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.016	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	155.7	-179.8	-52.7	176.8	0	0	0	110.1	T56 I59 L67 V81 A83 V91 P95 M100	T56-L93 WeakPolarHBondContact O-CD2 3.32Å; I59-L93 HydrophobicContact CB-CD2 4.22Å; I59-L93 HydrophobicContact CG2-CD1 3.85Å; I59-L93 HydrophobicContact CG2-CD2 3.8Å; L67-L93 HydrophobicContact CD1-CD1 4.18Å; V81-L93 HydrophobicContact CB-CB 4.35Å; V81-L93 HydrophobicContact CG1-CB 4.21Å; V81-L93 HydrophobicContact CG1-CD1 4.4Å; V81-L93 PolarHBondContact O-N 3.49Å; A83-L93 HydrophobicContact CB-CD1 3.58Å; A83-L93 HydrophobicContact CB-CG 4.1Å; V91-L93 HydrophobicContact CG2-CD2 3.96Å; L93-P95 WeakPolarHBondContact O-CD 3.36Å; L93-M100 HydrophobicContact CB-CE 3.2Å; L93-M100 HydrophobicContact CB-SD 4.47Å; L93-M100 HydrophobicContact CD1-CE 3.61Å; L93-M100 HydrophobicContact CD1-SD 4.2Å; L93-M100 HydrophobicContact CG-CE 3.99Å
94	D	90	Very high	89.2	Confident	48 Å²	48	69.5 Å²	69.5	26%	0.257	34%	0.342	S	S	.	.			trans	-77.6	117.4	178.5	-179.9	0	0	0	0	110.9	V55 E96 A97 M100	V55-D94 HydrophobicContact CB-CB 4.4Å; V55-D94 HydrophobicContact CG2-CB 4.46Å; D94-E96 VanDerWaalsContact C-N 3.34Å; D94-E96 PolarHBondContact OD1-N 3.22Å; D94-A97 HydrophobicContact CB-CB 3.94Å; D94-A97 PolarHBondContact OD1-N 2.79Å; D94-M100 WeakPolarHBondContact O-CE 3.2Å
95	P	87.4	Confident	88.8	Confident	19 Å²	19	67.8 Å²	67.8	12%	0.123	34%	0.335	C	S	.	.	S	Bend	trans	-68.6	-29	177.7	28.6	-35.2	0	0	0	113.5	V79 V81 L93 L196	V79-P95 HydrophobicContact CB-CB 4.43Å; V79-P95 HydrophobicContact CG1-CB 4.19Å; V81-P95 HydrophobicContact CG2-CB 3.94Å; L93-P95 WeakPolarHBondContact O-CD 3.36Å; P95-L196 HydrophobicContact CB-CD2 4.21Å
96	E	83.3	Confident	88.5	Confident	174 Å²	174	73.1 Å²	73.1	81%	0.813	36%	0.358	S	S	*	.	S	Bend	trans	-82.5	-19.3	-176.3	-65.9	178.7	-154.6	0	0	111.9	D94	D94-E96 VanDerWaalsContact C-N 3.34Å; D94-E96 PolarHBondContact OD1-N 3.22Å
97	A	84.6	Confident	88.2	Confident	14 Å²	14	66 Å²	66	12%	0.116	33%	0.327	C	S	.	.	S	Bend	trans	-59.7	130.1	179.1	0	0	0	0	0	111.6	D94 V99 M100	D94-A97 HydrophobicContact CB-CB 3.94Å; D94-A97 PolarHBondContact OD1-N 2.79Å; A97-V99 PolarHBondContact O-N 2.89Å; A97-M100 WeakPolarHBondContact O-CB 3.4Å; A97-M100 PolarHBondContact O-N 3.47Å
98	P	80.4	Confident	87.9	Confident	101 Å²	101	61.1 Å²	61.1	66%	0.656	30%	0.301	S	S	*	.	H	α-helix	trans	-63.7	-20.9	179.4	25.5	-34.8	0	0	0	112.8	M100	P98-M100 VanDerWaalsContact C-N 3.27Å
99	V	82.9	Confident	87.5	Confident	68 Å²	68	55.4 Å²	55.4	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-29.1	173.9	-176	0	0	0	0	111	A97 K102 V103	A97-V99 PolarHBondContact O-N 2.89Å; V99-K102 WeakPolarHBondContact O-CB 3.47Å; V99-K102 PolarHBondContact O-N 3.06Å; V99-K102 VanDerWaalsContact O-N 3.14Å; V99-V103 HydrophobicContact CG1-CG2 4.28Å; V99-V103 WeakPolarHBondContact O-CG2 3.36Å; V99-V103 PolarHBondContact O-N 2.98Å
100	M	84.6	Confident	86.5	Confident	9 Å²	9	51.5 Å²	51.5	4%	0.044	26%	0.264	C	S	.	.	H	α-helix	trans	-62.7	-48.9	-176.3	-169.2	47.1	59.3	0	0	112.4	V81 L93 D94 A97 P98 K102 V103 I104 L196	V81-M100 HydrophobicContact CG1-CE 4.38Å; V81-M100 HydrophobicContact CG1-SD 3.91Å; L93-M100 HydrophobicContact CB-CE 3.2Å; L93-M100 HydrophobicContact CB-SD 4.47Å; L93-M100 HydrophobicContact CD1-CE 3.61Å; L93-M100 HydrophobicContact CD1-SD 4.2Å; L93-M100 HydrophobicContact CG-CE 3.99Å; D94-M100 WeakPolarHBondContact O-CE 3.2Å; A97-M100 WeakPolarHBondContact O-CB 3.4Å; A97-M100 PolarHBondContact O-N 3.47Å; P98-M100 VanDerWaalsContact C-N 3.27Å; M100-K102 PolarHBondContact O-N 2.99Å; M100-K102 VanDerWaalsContact O-N 3.16Å; M100-V103 WeakPolarHBondContact O-CA 3.42Å; M100-V103 WeakPolarHBondContact O-CB 3.47Å; M100-V103 PolarHBondContact O-N 2.84Å; M100-V103 HydrophobicContact SD-CB 4.36Å; M100-I104 PolarHBondContact O-N 2.04Å; M100-I104 HydrophobicContact SD-CG1 4.46Å; M100-L196 HydrophobicContact CG-CD1 3.95Å; M100-L196 HydrophobicContact CG-CD2 4.31Å
101	K	85.5	Confident	85.2	Confident	87 Å²	87	46.7 Å²	46.7	38%	0.378	24%	0.244	S	C	.	.	H	α-helix	trans	-54.1	-39.5	175.7	-60.9	-171.6	-175.9	-172.9	0	111	Q105 M193 L196 E197	K101-Q105 WeakPolarHBondContact O-CB 3.39Å; K101-Q105 PolarHBondContact O-N 3.46Å; K101-M193 HydrophobicContact CB-SD 3.97Å; K101-M193 HydrophobicContact CG-SD 4.07Å; K101-M193 WeakPolarHBondContact O-CE 3.43Å; K101-L196 HydrophobicContact CG-CD1 4.28Å; K101-E197 IonicContact NZ-OE1 3.76Å; K101-E197 PolarHBondContact NZ-OE1 2.95Å
102	K	86.4	Confident	83.6	Confident	142 Å²	142	49.7 Å²	49.7	62%	0.617	26%	0.259	S	S	*	.	H	α-helix	trans	-68.9	-35	177	-61.8	178.3	-178.1	175.2	0	112.7	V99 M100 K106	V99-K102 WeakPolarHBondContact O-CB 3.47Å; V99-K102 PolarHBondContact O-N 3.06Å; V99-K102 VanDerWaalsContact O-N 3.14Å; M100-K102 PolarHBondContact O-N 2.99Å; M100-K102 VanDerWaalsContact O-N 3.16Å; K102-K106 WeakPolarHBondContact O-CB 3.4Å; K102-K106 VanDerWaalsContact O-CG 3.29Å; K102-K106 WeakPolarHBondContact O-CG 3.43Å; K102-K106 PolarHBondContact O-N 3.05Å
103	V	87.2	Confident	81.9	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-52.9	176.7	174	0	0	0	0	109.9	P61 I64 V99 M100 Q105 K106 I107	P61-V103 HydrophobicContact CB-CG1 4.37Å; P61-V103 HydrophobicContact CG-CB 4.42Å; P61-V103 HydrophobicContact CG-CG1 4.37Å; P61-V103 HydrophobicContact CG-CG2 4.01Å; I64-V103 HydrophobicContact CD1-CG1 3.44Å; I64-V103 VanDerWaalsContact CD1-CG1 3.44Å; V99-V103 HydrophobicContact CG1-CG2 4.28Å; V99-V103 WeakPolarHBondContact O-CG2 3.36Å; V99-V103 PolarHBondContact O-N 2.98Å; M100-V103 WeakPolarHBondContact O-CA 3.42Å; M100-V103 WeakPolarHBondContact O-CB 3.47Å; M100-V103 PolarHBondContact O-N 2.84Å; M100-V103 HydrophobicContact SD-CB 4.36Å; V103-Q105 VanDerWaalsContact C-N 3.3Å; V103-Q105 PolarHBondContact O-N 3.39Å; V103-K106 PolarHBondContact O-N 3.4Å; V103-I107 HydrophobicContact CG1-CD1 3.95Å; V103-I107 WeakPolarHBondContact O-CG1 3.44Å; V103-I107 PolarHBondContact O-N 2.82Å
104	I	86.6	Confident	80	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-46.1	178.7	-61.3	-162.4	0	0	0	110.5	L67 V69 M100 K106 I107 L108 V192 M193 L196	L67-I104 HydrophobicContact CD2-CD1 3.73Å; L67-I104 HydrophobicContact CD2-CG1 3.48Å; L67-I104 VanDerWaalsContact CD2-CG1 3.48Å; V69-I104 HydrophobicContact CG2-CD1 4.17Å; M100-I104 PolarHBondContact O-N 2.04Å; M100-I104 HydrophobicContact SD-CG1 4.46Å; I104-K106 VanDerWaalsContact C-N 3.32Å; I104-K106 PolarHBondContact O-N 3.47Å; I104-I107 WeakPolarHBondContact O-CB 3.43Å; I104-I107 PolarHBondContact O-N 3.42Å; I104-I107 VanDerWaalsContact O-N 3.08Å; I104-L108 HydrophobicContact CG2-CD1 3.85Å; I104-L108 HydrophobicContact CG2-CG 4.33Å; I104-L108 PolarHBondContact O-N 3.16Å; I104-V192 HydrophobicContact CD1-CG1 3.6Å; I104-V192 HydrophobicContact CG2-CB 4.31Å; I104-V192 HydrophobicContact CG2-CG1 3.66Å; I104-M193 HydrophobicContact CB-CE 3.95Å; I104-M193 HydrophobicContact CG2-CE 3.83Å; I104-L196 HydrophobicContact CD1-CD1 3.52Å; I104-L196 HydrophobicContact CD1-CD2 4.14Å; I104-L196 HydrophobicContact CD1-CG 4.05Å; I104-L196 HydrophobicContact CG1-CD1 4.45Å
105	Q	87.9	Confident	78.1	Confident	32 Å²	32	60.9 Å²	60.9	15%	0.15	31%	0.31	C	S	.	.	H	α-helix	trans	-56.9	-47.3	179.4	-170.4	55.2	39.6	0	0	111.8	K101 V103 I107 L108 D109 K189 M193	K101-Q105 WeakPolarHBondContact O-CB 3.39Å; K101-Q105 PolarHBondContact O-N 3.46Å; V103-Q105 VanDerWaalsContact C-N 3.3Å; V103-Q105 PolarHBondContact O-N 3.39Å; Q105-I107 VanDerWaalsContact C-N 3.29Å; Q105-I107 PolarHBondContact O-N 2.99Å; Q105-L108 PolarHBondContact O-N 3.14Å; Q105-D109 WeakPolarHBondContact CG-OD2 3.4Å; Q105-D109 PolarHBondContact NE2-OD1 2.85Å; Q105-D109 PolarHBondContact NE2-OD2 2.92Å; Q105-D109 VanDerWaalsContact O-CB 3.26Å; Q105-D109 WeakPolarHBondContact O-CB 3.42Å; Q105-D109 PolarHBondContact O-N 2.93Å; Q105-K189 VanDerWaalsContact CD-CE 3.45Å; Q105-M193 HydrophobicContact CB-CE 4.19Å
106	K	87.5	Confident	76.1	Confident	126 Å²	126	68 Å²	68	55%	0.548	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-35.2	177.8	-76.9	175.8	177.2	-178.5	0	112.7	P61 K102 V103 I104 S110	P61-K106 HydrophobicContact CB-CD 4.45Å; P61-K106 HydrophobicContact CG-CD 4.01Å; K102-K106 WeakPolarHBondContact O-CB 3.4Å; K102-K106 VanDerWaalsContact O-CG 3.29Å; K102-K106 WeakPolarHBondContact O-CG 3.43Å; K102-K106 PolarHBondContact O-N 3.05Å; V103-K106 PolarHBondContact O-N 3.4Å; I104-K106 VanDerWaalsContact C-N 3.32Å; I104-K106 PolarHBondContact O-N 3.47Å; K106-S110 PolarHBondContact O-N 3.04Å; K106-S110 PolarHBondContact O-OG 2.79Å
107	I	85.1	Confident	74.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-52.6	176.6	-66.6	165.8	0	0	0	110.3	I64 L67 V103 I104 Q105 S110 V157 R159	I64-I107 HydrophobicContact CD1-CD1 4.35Å; I64-I107 HydrophobicContact CG2-CD1 4.24Å; L67-I107 HydrophobicContact CB-CD1 4.24Å; L67-I107 HydrophobicContact CD2-CD1 4.26Å; V103-I107 HydrophobicContact CG1-CD1 3.95Å; V103-I107 WeakPolarHBondContact O-CG1 3.44Å; V103-I107 PolarHBondContact O-N 2.82Å; I104-I107 WeakPolarHBondContact O-CB 3.43Å; I104-I107 PolarHBondContact O-N 3.42Å; I104-I107 VanDerWaalsContact O-N 3.08Å; Q105-I107 VanDerWaalsContact C-N 3.29Å; Q105-I107 PolarHBondContact O-N 2.99Å; I107-S110 VanDerWaalsContact O-CB 3.28Å; I107-S110 WeakPolarHBondContact O-CB 3.39Å; I107-S110 PolarHBondContact O-N 3.41Å; I107-V157 HydrophobicContact CG2-CG1 3.47Å; I107-V157 VanDerWaalsContact CG2-CG1 3.47Å; I107-R159 HydrophobicContact CG2-CG 4.08Å
108	L	84.9	Confident	72.8	Confident	4 Å²	4	70.5 Å²	70.5	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-40.9	-179.1	-65.4	174.9	0	0	0	112	I104 Q105 S110 A111 V157 V169 K189	I104-L108 HydrophobicContact CG2-CD1 3.85Å; I104-L108 HydrophobicContact CG2-CG 4.33Å; I104-L108 PolarHBondContact O-N 3.16Å; Q105-L108 PolarHBondContact O-N 3.14Å; L108-S110 PolarHBondContact O-N 2.87Å; L108-S110 VanDerWaalsContact O-N 3.12Å; L108-A111 WeakPolarHBondContact O-CB 3.43Å; L108-A111 PolarHBondContact O-N 3.04Å; L108-V157 HydrophobicContact CD2-CG1 3.76Å; L108-V169 HydrophobicContact CD2-CG2 3.86Å; L108-K189 HydrophobicContact CD1-CB 4.23Å
109	D	83.2	Confident	71.3	Confident	58 Å²	58	68.4 Å²	68.4	31%	0.31	33%	0.333	S	S	.	.	H	α-helix	trans	-66.8	-14.7	177.4	-69.8	-22.3	0	0	0	113.5	Q105 A111 N112 K113	Q105-D109 WeakPolarHBondContact CG-OD2 3.4Å; Q105-D109 PolarHBondContact NE2-OD1 2.85Å; Q105-D109 PolarHBondContact NE2-OD2 2.92Å; Q105-D109 VanDerWaalsContact O-CB 3.26Å; Q105-D109 WeakPolarHBondContact O-CB 3.42Å; Q105-D109 PolarHBondContact O-N 2.93Å; D109-A111 PolarHBondContact O-N 3.12Å; D109-N112 PolarHBondContact O-N 3.29Å; D109-K113 PolarHBondContact O-N 3.02Å
110	S	73.1	Confident	69.5	Low	44 Å²	44	71.4 Å²	71.4	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-69.1	-20	172.5	-60.2	0	0	0	0	111.9	K106 I107 L108	K106-S110 PolarHBondContact O-N 3.04Å; K106-S110 PolarHBondContact O-OG 2.79Å; I107-S110 VanDerWaalsContact O-CB 3.28Å; I107-S110 WeakPolarHBondContact O-CB 3.39Å; I107-S110 PolarHBondContact O-N 3.41Å; L108-S110 PolarHBondContact O-N 2.87Å; L108-S110 VanDerWaalsContact O-N 3.12Å
111	A	67.3	Low	67.8	Low	8 Å²	8	73.9 Å²	73.9	7%	0.066	37%	0.368	C	S	.	.	H	α-helix	trans	-65	-51.7	169.8	0	0	0	0	0	110.9	L108 D109 K113 K114 T115 V167 P183 N184	L108-A111 WeakPolarHBondContact O-CB 3.43Å; L108-A111 PolarHBondContact O-N 3.04Å; D109-A111 PolarHBondContact O-N 3.12Å; A111-K113 PolarHBondContact O-N 2.79Å; A111-K113 VanDerWaalsContact O-N 3.16Å; A111-K114 PolarHBondContact O-N 2.9Å; A111-K114 VanDerWaalsContact O-N 3.14Å; A111-T115 PolarHBondContact O-N 2.9Å; A111-T115 PolarHBondContact O-OG1 2.89Å; A111-V167 HydrophobicContact CB-CB 3.89Å; A111-V167 HydrophobicContact CB-CG2 3.72Å; A111-P183 HydrophobicContact CB-CB 4.13Å; A111-P183 HydrophobicContact CB-CG 4.34Å; A111-N184 VanDerWaalsContact CB-OD1 3.3Å; A111-N184 WeakPolarHBondContact CB-OD1 3.27Å
112	N	60.1	Low	66	Low	79 Å²	79	77.1 Å²	77.1	42%	0.422	39%	0.389	S	S	.	.	H	α-helix	trans	-59.8	-30.4	-177.6	-72.9	-44.3	0	0	0	113.9	D109 N184	D109-N112 PolarHBondContact O-N 3.29Å; N112-N184 PolarHBondContact OD1-OD1 2.69Å
113	K	58.3	Low	64.1	Low	148 Å²	148	78.5 Å²	78.5	64%	0.643	40%	0.397	S	S	*	.	H	α-helix	trans	-76	-26.4	-179.5	-69.2	-175.9	-174.2	-172.9	0	113.8	D109 A111	D109-K113 PolarHBondContact O-N 3.02Å; A111-K113 PolarHBondContact O-N 2.79Å; A111-K113 VanDerWaalsContact O-N 3.16Å
114	K	54.2	Low	62.2	Low	80 Å²	80	87 Å²	87	35%	0.348	43%	0.434	S	S	.	.	H	α-helix	trans	-90.5	-29.3	-179	-93.9	-171.3	174.5	-171.1	0	112.8	A111 K116 R117 N118 P160	A111-K114 PolarHBondContact O-N 2.9Å; A111-K114 VanDerWaalsContact O-N 3.14Å; K114-K116 PolarHBondContact O-N 2.8Å; K114-R117 PolarHBondContact O-N 2.81Å; K114-N118 VanDerWaalsContact O-CB 3.28Å; K114-N118 WeakPolarHBondContact O-CB 3.31Å; K114-N118 PolarHBondContact O-N 2.85Å; K114-N118 PolarHBondContact O-OD1 3.19Å; K114-P160 HydrophobicContact CD-CG 4.44Å
115	T	50.3	Low	60	Low	81 Å²	81	91.2 Å²	91.2	50%	0.497	46%	0.463	S	S	.	.	H	α-helix	trans	-56.8	-38.9	171.7	-49.3	0	0	0	0	111.4	A111 A119	A111-T115 PolarHBondContact O-N 2.9Å; A111-T115 PolarHBondContact O-OG1 2.89Å; T115-A119 WeakPolarHBondContact O-CB 2.96Å; T115-A119 PolarHBondContact O-N 3.29Å
116	K	45.8	Very low	58.4	Low	169 Å²	169	95.6 Å²	95.6	74%	0.735	50%	0.495	S	S	*	.	H	α-helix	trans	-69	-36.9	173.1	-77.1	-171.5	175	-173	0	114.1	K114 L120	K114-K116 PolarHBondContact O-N 2.8Å; K116-L120 WeakPolarHBondContact O-CB 3.2Å; K116-L120 PolarHBondContact O-N 2.85Å; K116-L120 VanDerWaalsContact O-N 3.13Å
117	R	49.1	Very low	56.5	Low	182 Å²	182	93.9 Å²	93.9	69%	0.687	50%	0.495	S	S	*	.	H	α-helix	trans	-77.9	-33.6	178.9	-76.3	-177.6	176.9	160.9	-2.4	113.1	K114 A121	K114-R117 PolarHBondContact O-N 2.81Å; R117-A121 WeakPolarHBondContact O-CB 3.42Å; R117-A121 PolarHBondContact O-N 2.81Å
118	N	48	Very low	55	Low	58 Å²	58	101.8 Å²	101.8	31%	0.31	54%	0.537	S	S	.	.	H	α-helix	trans	-80.6	-32.7	178.8	-62.1	-2	0	0	0	110.8	K114 A121 L122	K114-N118 VanDerWaalsContact O-CB 3.28Å; K114-N118 WeakPolarHBondContact O-CB 3.31Å; K114-N118 PolarHBondContact O-N 2.85Å; K114-N118 PolarHBondContact O-OD1 3.19Å; N118-A121 PolarHBondContact O-N 2.84Å; N118-L122 WeakPolarHBondContact O-CB 2.98Å; N118-L122 WeakPolarHBondContact O-CD1 3.38Å; N118-L122 PolarHBondContact O-N 2.75Å
119	A	49.2	Very low	53.4	Low	57 Å²	57	108 Å²	108	47%	0.471	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-41.8	165.5	0	0	0	0	0	111.3	T115 A121 E123	T115-A119 WeakPolarHBondContact O-CB 2.96Å; T115-A119 PolarHBondContact O-N 3.29Å; A119-A121 VanDerWaalsContact C-N 3.28Å; A119-A121 PolarHBondContact O-N 2.81Å; A119-E123 PolarHBondContact O-N 2.03Å
120	L	45.7	Very low	52	Low	131 Å²	131	111.3 Å²	111.3	69%	0.686	59%	0.592	S	S	*	*	H	α-helix	trans	-68.6	-24.1	173.9	-133.2	81.5	0	0	0	113.8	K116	K116-L120 WeakPolarHBondContact O-CB 3.2Å; K116-L120 PolarHBondContact O-N 2.85Å; K116-L120 VanDerWaalsContact O-N 3.13Å
121	A	48.1	Very low	50.9	Low	60 Å²	60	113.7 Å²	113.7	50%	0.496	60%	0.602	S	S	.	*	H	α-helix	trans	-92.2	-24.5	178.8	0	0	0	0	0	113	R117 N118 A119 E123 K124	R117-A121 WeakPolarHBondContact O-CB 3.42Å; R117-A121 PolarHBondContact O-N 2.81Å; N118-A121 PolarHBondContact O-N 2.84Å; A119-A121 VanDerWaalsContact C-N 3.28Å; A119-A121 PolarHBondContact O-N 2.81Å; A121-E123 VanDerWaalsContact C-N 3.28Å; A121-K124 PolarHBondContact O-N 3.17Å
122	L	48.6	Very low	50.4	Low	156 Å²	156	118.8 Å²	118.8	82%	0.817	63%	0.634	S	S	*	*	H	α-helix	trans	-72.9	-20.8	170.6	-107.8	89.1	0	0	0	112.5	N118 K124	N118-L122 WeakPolarHBondContact O-CB 2.98Å; N118-L122 WeakPolarHBondContact O-CD1 3.38Å; N118-L122 PolarHBondContact O-N 2.75Å; L122-K124 VanDerWaalsContact C-N 3.35Å
123	E	45.6	Very low	50.2	Low	171 Å²	171	125.3 Å²	125.3	80%	0.799	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	4.8	175.4	-68	-167.3	128.6	0	0	114	A119 A121	A119-E123 PolarHBondContact O-N 2.03Å; A121-E123 VanDerWaalsContact C-N 3.28Å
124	K	48.7	Very low	50.1	Low	181 Å²	181	123.7 Å²	123.7	79%	0.787	65%	0.652	S	S	*	*	S	Bend	trans	-134.2	24.4	-172.1	-136.5	-177.6	-174.6	-179.2	0	118.2	A121 L122	A121-K124 PolarHBondContact O-N 3.17Å; L122-K124 VanDerWaalsContact C-N 3.35Å
125	S	40.2	Very low	50.4	Low	89 Å²	89	125.7 Å²	125.7	62%	0.622	66%	0.663	S	S	*	*			trans	-126.2	98.8	169.6	-157.6	0	0	0	0	112.6	T127	S125-T127 VanDerWaalsContact C-N 3.34Å
126	P	54.2	Low	51.3	Low	125 Å²	125	126.3 Å²	126.3	81%	0.812	66%	0.663	S	S	*	*			trans	-94.2	62.9	160.6	37.8	-27.6	0	0	0	109
127	T	47.1	Very low	53	Low	90 Å²	90	126.9 Å²	126.9	55%	0.552	66%	0.66	S	S	*	*	S	Bend	trans	-148.7	133.2	156.3	56.3	0	0	0	0	109.7	S125 D129	S125-T127 VanDerWaalsContact C-N 3.34Å; T127-D129 WeakPolarHBondContact CB-OD2 3.24Å; T127-D129 PolarHBondContact O-N 3.23Å; T127-D129 PolarHBondContact OG1-OD2 2.77Å
128	N	53.6	Low	54.9	Low	167 Å²	167	120.1 Å²	120.1	89%	0.893	64%	0.64	S	S	*	*			trans	-75.5	63.6	177.3	-65.3	-64.4	0	0	0	110.5
129	D	50.8	Low	57	Low	134 Å²	134	123.9 Å²	123.9	72%	0.717	65%	0.65	S	S	*	*			trans	-116	67.8	171.3	-58.9	-57.8	0	0	0	108.9	T127 D131	T127-D129 WeakPolarHBondContact CB-OD2 3.24Å; T127-D129 PolarHBondContact O-N 3.23Å; T127-D129 PolarHBondContact OG1-OD2 2.77Å; D129-D131 PolarHBondContact O-N 2.81Å
130	V	53.6	Low	58.9	Low	127 Å²	127	122.4 Å²	122.4	77%	0.77	64%	0.636	S	S	*	*			trans	-76.7	105.3	168.9	-178.9	0	0	0	0	106.5	P132	V130-P132 WeakPolarHBondContact O-CD 3.39Å
131	D	51.5	Low	60.8	Low	94 Å²	94	121.5 Å²	121.5	50%	0.503	64%	0.638	S	S	.	*			trans	-53.3	109	168.1	-178.4	-13.8	0	0	0	108.6	D129 Y133 L134	D129-D131 PolarHBondContact O-N 2.81Å; D131-Y133 PolarHBondContact O-N 2.87Å; D131-Y133 WeakPolarHBondContact OD1-CB 3.43Å; D131-Y133 PolarHBondContact OD1-N 2.76Å; D131-L134 HydrophobicContact CB-CB 4.46Å; D131-L134 PolarHBondContact O-N 3.4Å
132	P	56.1	Low	62.6	Low	116 Å²	116	124.6 Å²	124.6	75%	0.753	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-11.9	-175	-18.4	31.6	0	0	0	113	V130	V130-P132 WeakPolarHBondContact O-CD 3.39Å
133	Y	55.4	Low	64.6	Low	215 Å²	215	121.9 Å²	121.9	84%	0.843	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-7.5	-177.2	-149.2	-100.4	0	0	0	113.4	D131 E135	D131-Y133 PolarHBondContact O-N 2.87Å; D131-Y133 WeakPolarHBondContact OD1-CB 3.43Å; D131-Y133 PolarHBondContact OD1-N 2.76Å; Y133-E135 VanDerWaalsContact C-N 3.33Å; Y133-E135 PolarHBondContact O-N 3.42Å
134	L	57.4	Low	66.6	Low	115 Å²	115	117.1 Å²	117.1	60%	0.602	61%	0.614	S	S	*	*			trans	-94	35.4	180	-130	93	0	0	0	113.4	D131 L136	D131-L134 HydrophobicContact CB-CB 4.46Å; D131-L134 PolarHBondContact O-N 3.4Å; L134-L136 PolarHBondContact O-N 3.4Å
135	E	60.1	Low	68.3	Low	122 Å²	122	114.5 Å²	114.5	57%	0.57	61%	0.613	S	S	*	*			trans	-57.8	109.4	171.4	-80.1	-174.7	156.3	0	0	110	Y133 R137	Y133-E135 VanDerWaalsContact C-N 3.33Å; Y133-E135 PolarHBondContact O-N 3.42Å; E135-R137 PolarHBondContact O-N 3.36Å; E135-R137 IonicContact OE2-CZ 2.69Å; E135-R137 IonicContact OE2-NE 3.72Å; E135-R137 IonicContact OE2-NH2 2.85Å; E135-R137 PolarHBondContact OE2-NH2 3.12Å
136	L	69.1	Low	70.1	Confident	94 Å²	94	113.8 Å²	113.8	49%	0.492	62%	0.62	S	S	.	*			trans	-70.9	99.2	176	-69	170.7	0	0	0	109.3	L134 C138 H163 A165	L134-L136 PolarHBondContact O-N 3.4Å; L136-C138 VanDerWaalsContact C-N 3.33Å; L136-C138 PolarHBondContact O-N 3.2Å; L136-H163 CarbonylContact C-O 3.56Å; L136-H163 VanDerWaalsContact C-O 3.3Å; L136-H163 VanDerWaalsContact CA-O 3.23Å; L136-H163 WeakPolarHBondContact CA-O 3.38Å; L136-A165 HydrophobicContact CD1-CB 4.32Å; L136-A165 HydrophobicContact CD2-CB 4.33Å
137	R	81.8	Confident	71.7	Confident	181 Å²	181	109.1 Å²	109.1	68%	0.683	59%	0.588	S	S	*	*			trans	-89.2	68.4	175.6	-63.3	-179.4	-177.5	-178.4	0	110.5	E135 H163	E135-R137 PolarHBondContact O-N 3.36Å; E135-R137 IonicContact OE2-CZ 2.69Å; E135-R137 IonicContact OE2-NE 3.72Å; E135-R137 IonicContact OE2-NH2 2.85Å; E135-R137 PolarHBondContact OE2-NH2 3.12Å; R137-H163 CarbonylContact C-O 3.5Å; R137-H163 PolarHBondContact N-O 2.94Å
138	C	88.3	Confident	73.7	Confident	39 Å²	39	107.8 Å²	107.8	26%	0.264	58%	0.581	S	S	.	*			trans	-65.3	149	168.8	-65	0	0	0	0	110.3	L136 C140 C164 E168	L136-C138 VanDerWaalsContact C-N 3.33Å; L136-C138 PolarHBondContact O-N 3.2Å; C138-C140 VanDerWaalsContact C-N 3.32Å; C138-C164 HydrophobicContact CB-CB 4.02Å; C138-C164 WeakPolarHBondContact CB-SG 2.97Å; C138-C164 WeakPolarHBondContact SG-CB 3.18Å; C138-C164 CovalentContact SG-SG 2.05Å; C138-C164 PolarHBondContact SG-SG 3.34Å; C138-E168 WeakPolarHBondContact CB-OE1 3.44Å
139	R	91.8	Very high	75.4	Confident	138 Å²	138	102.2 Å²	102.2	52%	0.521	55%	0.551	S	S	.	*	S	Bend	trans	-75.2	-25.8	177.4	-61.9	87.4	167.6	-179.1	-1.2	112.1	P141 E168 I170	R139-P141 WeakPolarHBondContact O-CD 3.46Å; R139-E168 WeakPolarHBondContact CA-OE1 3.45Å; R139-E168 WeakPolarHBondContact CD-OE2 3.44Å; R139-E168 IonicContact CZ-OE2 3.77Å; R139-E168 PolarHBondContact N-OE1 3.32Å; R139-E168 PolarHBondContact N-OE2 2.86Å; R139-E168 IonicContact NE-OE2 2.98Å; R139-E168 IonicContact NH1-OE2 3.64Å; R139-E168 PolarHBondContact NH1-OE2 3.41Å; R139-I170 HydrophobicContact CB-CD1 3.9Å
140	C	90.3	Very high	77.3	Confident	26 Å²	26	99.9 Å²	99.9	18%	0.176	55%	0.545	C	S	.	.			trans	-99	102.2	-177	-70.2	0	0	0	0	111.2	C138 E168 C180	C138-C140 VanDerWaalsContact C-N 3.32Å; C140-E168 PolarHBondContact N-OE1 2.98Å; C140-C180 WeakPolarHBondContact CA-SG 3.37Å; C140-C180 HydrophobicContact CB-CB 3.59Å; C140-C180 WeakPolarHBondContact CB-SG 3.09Å; C140-C180 WeakPolarHBondContact SG-CB 3.2Å; C140-C180 CovalentContact SG-SG 2.03Å; C140-C180 PolarHBondContact SG-SG 2.93Å
141	P	85.6	Confident	79.1	Confident	112 Å²	112	100 Å²	100	73%	0.727	53%	0.532	S	S	*	.	S	Bend	trans	-78.1	-30.7	171.8	30.3	-34.4	0	0	0	112.3	R139	R139-P141 WeakPolarHBondContact O-CD 3.46Å
142	N	86.1	Confident	81.2	Confident	124 Å²	124	95.6 Å²	95.6	66%	0.663	51%	0.508	S	S	*	.	S	Bend	trans	-135.8	146.8	-177.2	-64.5	-67.8	0	0	0	110	C180	N142-C180 WeakPolarHBondContact O-CB 3.47Å
143	I	89.1	Confident	82.9	Confident	99 Å²	99	91.9 Å²	91.9	51%	0.508	49%	0.485	S	S	.	.			trans	-109.4	136.3	176.9	-65	164.3	0	0	0	109.1	D182	I143-D182 HydrophobicContact CG2-CB 3.81Å; I143-D182 VanDerWaalsContact CG2-N 3.33Å
144	V	88.8	Confident	84.8	Confident	71 Å²	71	83.8 Å²	83.8	43%	0.43	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-108	140.9	175.3	-177.7	0	0	0	0	109.6	T179 C180	V144-T179 WeakPolarHBondContact CG2-OG1 3.42Å; V144-C180 PolarHBondContact N-O 3.38Å
145	T	84.4	Confident	86.6	Confident	127 Å²	127	78.3 Å²	78.3	78%	0.779	43%	0.425	S	S	*	.			trans	-100.8	138.4	175.4	56.3	0	0	0	0	111.1
146	G	77.1	Confident	88.3	Confident	74 Å²	74	73.4 Å²	73.4	76%	0.763	40%	0.403	S	S	*	.			trans	77.6	91.9	166.5	0	0	0	0	0	114
147	I	87.9	Confident	89.5	Confident	26 Å²	26	69 Å²	69	13%	0.133	38%	0.38	C	S	.	.			trans	-125.3	130.5	175.6	-56.1	-162.5	0	0	0	109.3	I152 L173 T179 L181	I147-I152 HydrophobicContact CG2-CD1 4.33Å; I147-I152 HydrophobicContact CG2-CG1 4.07Å; I147-L173 HydrophobicContact CG2-CD2 3.77Å; I147-T179 HydrophobicContact CD1-CG2 3.08Å; I147-L181 HydrophobicContact CD1-CD2 3.57Å; I147-L181 HydrophobicContact CG1-CD2 3.88Å
148	P	89.8	Confident	90	Very high	63 Å²	63	62 Å²	62	41%	0.409	36%	0.355	S	S	.	.			trans	-71.3	134.7	176.9	30.2	-34.6	0	0	0	110.3	S150 R151	P148-S150 PolarHBondContact O-N 2.96Å; P148-R151 HydrophobicContact CG-CB 4.16Å; P148-R151 HydrophobicContact CG-CG 3.86Å; P148-R151 PolarHBondContact O-N 3.08Å; P148-R151 VanDerWaalsContact O-N 3.15Å
149	L	89.2	Confident	90.1	Very high	49 Å²	49	61.9 Å²	61.9	26%	0.257	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-56	-37.3	-179.6	-71.9	166	0	0	0	113.6	R151 I152 I191 Y199	L149-R151 PolarHBondContact O-N 3.06Å; L149-I152 HydrophobicContact CD2-CD1 4.17Å; L149-I152 WeakPolarHBondContact O-CB 3.43Å; L149-I152 PolarHBondContact O-N 3.38Å; L149-I191 HydrophobicContact CD2-CB 3.81Å; L149-I191 HydrophobicContact CD2-CG1 3.65Å; L149-I191 HydrophobicContact CD2-CG2 3.51Å; L149-I191 HydrophobicContact CG-CG1 4.28Å; L149-Y199 HydrophobicContact CB-CE2 4.46Å; L149-Y199 HydrophobicContact CD1-CD1 4.03Å; L149-Y199 HydrophobicContact CD1-CE1 3.22Å; L149-Y199 HydrophobicContact CD1-CE2 4.15Å; L149-Y199 WeakPolarHBondContact CD1-OH 3.3Å; L149-Y199 HydrophobicContact CD2-CE1 4.24Å; L149-Y199 HydrophobicContact CD2-CE2 3.81Å; L149-Y199 VanDerWaalsContact CD2-CZ 3.46Å; L149-Y199 WeakPolarHBondContact CD2-OH 3.26Å; L149-Y199 HydrophobicContact CG-CE1 4.24Å; L149-Y199 HydrophobicContact CG-CE2 4.36Å
150	S	90.1	Very high	89.9	Confident	86 Å²	86	57 Å²	57	60%	0.601	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-62.3	-23.8	-178.7	55.5	0	0	0	0	113.9	P148 K174	P148-S150 PolarHBondContact O-N 2.96Å; S150-K174 WeakPolarHBondContact O-CE 3.14Å; S150-K174 PolarHBondContact O-NZ 2.83Å
151	R	92.4	Very high	89.6	Confident	129 Å²	129	58 Å²	58	49%	0.487	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-87.8	-13.6	178	-70.8	-177.6	62.4	-172.8	-4.9	113	P148 L149 L173 K174 E177	P148-R151 HydrophobicContact CG-CB 4.16Å; P148-R151 HydrophobicContact CG-CG 3.86Å; P148-R151 PolarHBondContact O-N 3.08Å; P148-R151 VanDerWaalsContact O-N 3.15Å; L149-R151 PolarHBondContact O-N 3.06Å; R151-L173 HydrophobicContact CB-CD2 4.28Å; R151-L173 CarbonylContact O-C 3.56Å; R151-L173 WeakPolarHBondContact O-CA 3.18Å; R151-L173 WeakPolarHBondContact O-CB 3.45Å; R151-K174 PolarHBondContact O-N 3.09Å; R151-E177 IonicContact NH2-OE2 2.67Å
152	I	94.1	Very high	89.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	136.6	-177.2	-57.8	177.7	0	0	0	109.2	I147 L149 V155 A171 L173 I191 I195	I147-I152 HydrophobicContact CG2-CD1 4.33Å; I147-I152 HydrophobicContact CG2-CG1 4.07Å; L149-I152 HydrophobicContact CD2-CD1 4.17Å; L149-I152 WeakPolarHBondContact O-CB 3.43Å; L149-I152 PolarHBondContact O-N 3.38Å; I152-V155 HydrophobicContact CG2-CG2 3.68Å; I152-A171 HydrophobicContact CG2-CB 4.49Å; I152-L173 HydrophobicContact CG1-CD2 4.2Å; I152-I191 HydrophobicContact CD1-CG2 3.78Å; I152-I195 HydrophobicContact CG2-CD1 4.31Å
153	S	93.4	Very high	89.3	Confident	38 Å²	38	58.6 Å²	58.6	27%	0.266	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-47.6	172.8	-177.5	0	0	0	0	110.5	T71 T172	T71-S153 PolarHBondContact N-O 3.36Å; T71-S153 PolarHBondContact OG1-O 3.24Å; S153-T172 WeakPolarHBondContact CB-O 3.34Å; S153-T172 PolarHBondContact N-O 2.75Å
154	F	94	Very high	89.2	Confident	46 Å²	46	54 Å²	54	20%	0.202	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	159.8	173.6	58.5	-88.4	0	0	0	111.2	E68 V69 I70 N156 T172	E68-F154 HydrophobicContact CG-CD2 4.3Å; V69-F154 CarbonylContact O-C 3.49Å; V69-F154 WeakPolarHBondContact O-CA 3.46Å; V69-F154 WeakPolarHBondContact O-CB 3.35Å; I70-F154 HydrophobicContact CB-CB 4.26Å; I70-F154 HydrophobicContact CG1-CB 3.95Å; I70-F154 HydrophobicContact CG2-CB 4.46Å; F154-N156 WeakPolarHBondContact CD2-ND2 3.29Å; F154-N156 WeakPolarHBondContact CE2-ND2 3.34Å; F154-T172 HydrophobicContact CD1-CG2 4.26Å; F154-T172 VanDerWaalsContact CE1-CB 3.46Å; F154-T172 HydrophobicContact CE1-CG2 3.51Å; F154-T172 HydrophobicContact CE2-CG2 4.37Å; F154-T172 WeakPolarHBondContact CE2-OG1 3.11Å; F154-T172 HydrophobicContact CZ-CG2 3.59Å; F154-T172 WeakPolarHBondContact CZ-OG1 3.35Å; F154-T172 PolarHBondContact N-O 3Å; F154-T172 PolarHBondContact O-N 3.21Å
155	V	95.3	Very high	88.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.6	178.1	-178.5	0	0	0	0	109.6	E68 V69 I152 V157 V169 I170 A171 V192 I195	E68-V155 CarbonylContact C-O 3.59Å; E68-V155 WeakPolarHBondContact CA-O 3.02Å; V69-V155 PolarHBondContact N-O 3.46Å; V69-V155 PolarHBondContact O-N 3.06Å; I152-V155 HydrophobicContact CG2-CG2 3.68Å; V155-V157 HydrophobicContact CG1-CG2 4.21Å; V155-V169 HydrophobicContact CG1-CG1 3.55Å; V155-I170 CarbonylContact C-O 3.59Å; V155-I170 WeakPolarHBondContact CA-O 3.38Å; V155-A171 HydrophobicContact CG2-CB 4.28Å; V155-V192 HydrophobicContact CG1-CG2 4.2Å; V155-I195 HydrophobicContact CG2-CD1 3.67Å
156	N	95.7	Very high	89	Confident	19 Å²	19	49.9 Å²	49.9	10%	0.102	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.7	168.9	-78.7	-85.1	0	0	0	110.4	N66 L67 F154 F158 V169 I170	N66-N156 PolarHBondContact ND2-OD1 2.03Å; L67-N156 CarbonylContact O-C 3.55Å; L67-N156 WeakPolarHBondContact O-CA 3.01Å; F154-N156 WeakPolarHBondContact CD2-ND2 3.29Å; F154-N156 WeakPolarHBondContact CE2-ND2 3.34Å; N156-F158 HydrophobicContact CB-CD2 4.21Å; N156-F158 HydrophobicContact CB-CE2 3.43Å; N156-F158 VanDerWaalsContact CB-CE2 3.43Å; N156-F158 HydrophobicContact CB-CZ 3.77Å; N156-V169 CarbonylContact O-C 3.48Å; N156-V169 WeakPolarHBondContact O-CA 3.36Å; N156-I170 PolarHBondContact N-O 2.7Å; N156-I170 PolarHBondContact O-N 2.59Å
157	V	94.1	Very high	89.6	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	102.9	177.5	-173.6	0	0	0	0	108.6	N66 L67 I107 L108 V155 V167 E168 V169	N66-V157 WeakPolarHBondContact CA-O 3.35Å; N66-V157 VanDerWaalsContact OD1-C 3.3Å; N66-V157 PolarHBondContact OD1-N 2.86Å; N66-V157 PolarHBondContact OD1-O 2.81Å; N66-V157 VanDerWaalsContact OD1-O 3.05Å; L67-V157 HydrophobicContact CB-CB 4.37Å; L67-V157 PolarHBondContact N-O 3.07Å; L67-V157 PolarHBondContact O-N 2.97Å; I107-V157 HydrophobicContact CG2-CG1 3.47Å; I107-V157 VanDerWaalsContact CG2-CG1 3.47Å; L108-V157 HydrophobicContact CD2-CG1 3.76Å; V155-V157 HydrophobicContact CG1-CG2 4.21Å; V157-V167 HydrophobicContact CG1-CG1 4.35Å; V157-E168 WeakPolarHBondContact CA-O 3.24Å; V157-V169 HydrophobicContact CG1-CG2 4.29Å; V157-V169 HydrophobicContact CG2-CG1 4.49Å; V157-V169 HydrophobicContact CG2-CG2 4.46Å
158	F	92.5	Very high	89.8	Confident	34 Å²	34	45.8 Å²	45.8	15%	0.149	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	135.1	-179.9	-60.3	-86.1	0	0	0	110.9	N66 N156 V167 E168 I170	N66-F158 HydrophobicContact CB-CD1 3.78Å; N66-F158 HydrophobicContact CB-CE1 3.92Å; N66-F158 WeakPolarHBondContact ND2-CE1 3.45Å; N156-F158 HydrophobicContact CB-CD2 4.21Å; N156-F158 HydrophobicContact CB-CE2 3.43Å; N156-F158 VanDerWaalsContact CB-CE2 3.43Å; N156-F158 HydrophobicContact CB-CZ 3.77Å; F158-V167 WeakPolarHBondContact O-CA 3.44Å; F158-V167 WeakPolarHBondContact O-CG1 3.41Å; F158-E168 HydrophobicContact CB-CB 4.2Å; F158-E168 HydrophobicContact CD2-CB 4.28Å; F158-E168 PolarHBondContact N-O 3.4Å; F158-E168 PolarHBondContact O-N 3.16Å; F158-E168 VanDerWaalsContact O-N 3.07Å; F158-I170 HydrophobicContact CD2-CD1 4.22Å; F158-I170 HydrophobicContact CD2-CG1 4.35Å; F158-I170 HydrophobicContact CE2-CD1 3.73Å; F158-I170 HydrophobicContact CE2-CG1 4.07Å
159	R	90.3	Very high	90	Very high	36 Å²	36	42.8 Å²	42.8	14%	0.136	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-76.8	161.1	169.4	-77.9	-165.7	-173.5	151.3	9.2	112.7	P61 K62 I64 A65 I107 G161	P61-R159 PolarHBondContact O-NH1 3.37Å; P61-R159 PolarHBondContact O-NH2 2.83Å; K62-R159 VanDerWaalsContact C-NH1 3.3Å; K62-R159 PolarHBondContact O-NH1 2.88Å; I64-R159 WeakPolarHBondContact O-CD 3.21Å; I64-R159 PolarHBondContact O-NE 2.75Å; I64-R159 PolarHBondContact O-NH1 2.8Å; A65-R159 PolarHBondContact O-N 3.05Å; I107-R159 HydrophobicContact CG2-CG 4.08Å; R159-G161 PolarHBondContact O-N 2.98Å
160	P	87.6	Confident	90.3	Very high	34 Å²	34	41.5 Å²	41.5	22%	0.221	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-52.9	129.8	162.3	-25.9	36.2	0	0	0	110.5	K114 C164 A165 N166 V167	K114-P160 HydrophobicContact CD-CG 4.44Å; P160-C164 CarbonylContact C-O 3.52Å; P160-C164 VanDerWaalsContact CA-O 3.27Å; P160-C164 WeakPolarHBondContact CA-O 2.96Å; P160-A165 VanDerWaalsContact CB-O 3.32Å; P160-A165 WeakPolarHBondContact CB-O 3.37Å; P160-A165 WeakPolarHBondContact CG-O 3.34Å; P160-N166 WeakPolarHBondContact CA-O 3.5Å; P160-V167 HydrophobicContact CG-CG2 4.02Å
161	G	84.3	Confident	90.6	Very high	47 Å²	47	37.4 Å²	37.4	49%	0.485	20%	0.203	S	C	.	.			trans	-120.4	-170.3	173.5	0	0	0	0	0	111.5	R159 H163 C164	R159-G161 PolarHBondContact O-N 2.98Å; G161-H163 VanDerWaalsContact C-N 3.3Å; G161-C164 PolarHBondContact N-O 3.43Å; G161-C164 CarbonylContact O-C 3.57Å
162	V	82.8	Confident	90.7	Very high	120 Å²	120	31.7 Å²	31.7	73%	0.727	18%	0.182	S	C	*	.	S	Bend	trans	-68	-30.9	176.4	-66.3	0	0	0	0	112.4
163	H	83.2	Confident	90.7	Very high	129 Å²	129	32 Å²	32	60%	0.597	18%	0.184	S	C	*	.	S	Bend	trans	-101.4	-2.1	-179.3	-56.1	-57.5	0	0	0	113.8	L136 R137 G161	L136-H163 CarbonylContact C-O 3.56Å; L136-H163 VanDerWaalsContact C-O 3.3Å; L136-H163 VanDerWaalsContact CA-O 3.23Å; L136-H163 WeakPolarHBondContact CA-O 3.38Å; R137-H163 CarbonylContact C-O 3.5Å; R137-H163 PolarHBondContact N-O 2.94Å; G161-H163 VanDerWaalsContact C-N 3.3Å
164	C	85.6	Confident	90.7	Very high	3 Å²	3	37 Å²	37	2%	0.02	20%	0.201	C	C	.	.			trans	-152.2	116.5	174.8	-177.3	0	0	0	0	109.1	C138 P160 G161 N166	C138-C164 HydrophobicContact CB-CB 4.02Å; C138-C164 WeakPolarHBondContact CB-SG 2.97Å; C138-C164 WeakPolarHBondContact SG-CB 3.18Å; C138-C164 CovalentContact SG-SG 2.05Å; C138-C164 PolarHBondContact SG-SG 3.34Å; P160-C164 CarbonylContact C-O 3.52Å; P160-C164 VanDerWaalsContact CA-O 3.27Å; P160-C164 WeakPolarHBondContact CA-O 2.96Å; G161-C164 PolarHBondContact N-O 3.43Å; G161-C164 CarbonylContact O-C 3.57Å; C164-N166 PolarHBondContact O-N 3.14Å
165	A	84.3	Confident	90.5	Very high	22 Å²	22	38.6 Å²	38.6	18%	0.182	23%	0.23	C	C	.	.			trans	-78.3	-11.2	-176.6	0	0	0	0	0	113.3	L136 P160	L136-A165 HydrophobicContact CD1-CB 4.32Å; L136-A165 HydrophobicContact CD2-CB 4.33Å; P160-A165 VanDerWaalsContact CB-O 3.32Å; P160-A165 WeakPolarHBondContact CB-O 3.37Å; P160-A165 WeakPolarHBondContact CG-O 3.34Å
166	N	85.4	Confident	90.3	Very high	89 Å²	89	41 Å²	41	48%	0.476	25%	0.254	S	S	.	.	S	Bend	trans	-95.1	153.1	-174.7	-61	-32.7	0	0	0	111.6	P160 C164	P160-N166 WeakPolarHBondContact CA-O 3.5Å; C164-N166 PolarHBondContact O-N 3.14Å
167	V	89.6	Confident	90.2	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.042	28%	0.275	C	S	.	.			trans	-73.9	139.1	159.7	172.7	0	0	0	0	106.7	A111 V157 F158 P160 V169 P183	A111-V167 HydrophobicContact CB-CB 3.89Å; A111-V167 HydrophobicContact CB-CG2 3.72Å; V157-V167 HydrophobicContact CG1-CG1 4.35Å; F158-V167 WeakPolarHBondContact O-CA 3.44Å; F158-V167 WeakPolarHBondContact O-CG1 3.41Å; P160-V167 HydrophobicContact CG-CG2 4.02Å; V167-V169 HydrophobicContact CG1-CG2 4.44Å; V167-P183 HydrophobicContact CB-CB 3.99Å; V167-P183 HydrophobicContact CB-CG 4.3Å; V167-P183 HydrophobicContact CG1-CB 3.73Å; V167-P183 WeakPolarHBondContact O-CG 3.09Å
168	E	92.3	Very high	90.2	Very high	7 Å²	7	52.7 Å²	52.7	3%	0.033	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.3	176.3	-55.7	179.8	96.4	0	0	109	C138 R139 C140 V157 F158	C138-E168 WeakPolarHBondContact CB-OE1 3.44Å; R139-E168 WeakPolarHBondContact CA-OE1 3.45Å; R139-E168 WeakPolarHBondContact CD-OE2 3.44Å; R139-E168 IonicContact CZ-OE2 3.77Å; R139-E168 PolarHBondContact N-OE1 3.32Å; R139-E168 PolarHBondContact N-OE2 2.86Å; R139-E168 IonicContact NE-OE2 2.98Å; R139-E168 IonicContact NH1-OE2 3.64Å; R139-E168 PolarHBondContact NH1-OE2 3.41Å; C140-E168 PolarHBondContact N-OE1 2.98Å; V157-E168 WeakPolarHBondContact CA-O 3.24Å; F158-E168 HydrophobicContact CB-CB 4.2Å; F158-E168 HydrophobicContact CD2-CB 4.28Å; F158-E168 PolarHBondContact N-O 3.4Å; F158-E168 PolarHBondContact O-N 3.16Å; F158-E168 VanDerWaalsContact O-N 3.07Å
169	V	94.3	Very high	90.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.8	174.5	-177.8	0	0	0	0	107.6	L108 V155 N156 V157 V167 C180 L181 P183 I188	L108-V169 HydrophobicContact CD2-CG2 3.86Å; V155-V169 HydrophobicContact CG1-CG1 3.55Å; N156-V169 CarbonylContact O-C 3.48Å; N156-V169 WeakPolarHBondContact O-CA 3.36Å; V157-V169 HydrophobicContact CG1-CG2 4.29Å; V157-V169 HydrophobicContact CG2-CG1 4.49Å; V157-V169 HydrophobicContact CG2-CG2 4.46Å; V167-V169 HydrophobicContact CG1-CG2 4.44Å; V169-C180 CarbonylContact O-C 3.56Å; V169-C180 WeakPolarHBondContact O-CA 3.5Å; V169-L181 HydrophobicContact CB-CB 4.09Å; V169-L181 HydrophobicContact CG1-CB 4.03Å; V169-L181 HydrophobicContact CG1-CD1 4.13Å; V169-L181 PolarHBondContact O-N 3.44Å; V169-P183 HydrophobicContact CG2-CB 4.04Å; V169-I188 HydrophobicContact CB-CG2 4.32Å; V169-I188 HydrophobicContact CG1-CG2 3.86Å; V169-I188 HydrophobicContact CG2-CG2 4.22Å
170	I	95.1	Very high	90.5	Very high	22 Å²	22	50.7 Å²	50.7	11%	0.113	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116	-178.2	-51.6	-175.4	0	0	0	108.1	R139 V155 N156 F158 K178 T179	R139-I170 HydrophobicContact CB-CD1 3.9Å; V155-I170 CarbonylContact C-O 3.59Å; V155-I170 WeakPolarHBondContact CA-O 3.38Å; N156-I170 PolarHBondContact N-O 2.7Å; N156-I170 PolarHBondContact O-N 2.59Å; F158-I170 HydrophobicContact CD2-CD1 4.22Å; F158-I170 HydrophobicContact CD2-CG1 4.35Å; F158-I170 HydrophobicContact CE2-CD1 3.73Å; F158-I170 HydrophobicContact CE2-CG1 4.07Å; I170-K178 HydrophobicContact CG2-CB 4.34Å; I170-T179 CarbonylContact C-O 3.57Å; I170-T179 WeakPolarHBondContact CA-O 3.06Å
171	A	95.6	Very high	90.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	133.3	170.2	0	0	0	0	0	109.7	I152 V155 K178 T179 L181	I152-A171 HydrophobicContact CG2-CB 4.49Å; V155-A171 HydrophobicContact CG2-CB 4.28Å; A171-K178 WeakPolarHBondContact O-CA 3.28Å; A171-T179 HydrophobicContact CB-CG2 4.07Å; A171-T179 PolarHBondContact N-O 3.26Å; A171-T179 PolarHBondContact O-N 2.69Å; A171-L181 HydrophobicContact CB-CD1 3.71Å; A171-L181 HydrophobicContact CB-CG 4.32Å
172	T	95.4	Very high	91	Very high	9 Å²	9	49.4 Å²	49.4	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.2	165.5	-54	0	0	0	0	107.8	S153 F154 E177 K178	S153-T172 WeakPolarHBondContact CB-O 3.34Å; S153-T172 PolarHBondContact N-O 2.75Å; F154-T172 HydrophobicContact CD1-CG2 4.26Å; F154-T172 VanDerWaalsContact CE1-CB 3.46Å; F154-T172 HydrophobicContact CE1-CG2 3.51Å; F154-T172 HydrophobicContact CE2-CG2 4.37Å; F154-T172 WeakPolarHBondContact CE2-OG1 3.11Å; F154-T172 HydrophobicContact CZ-CG2 3.59Å; F154-T172 WeakPolarHBondContact CZ-OG1 3.35Å; F154-T172 PolarHBondContact N-O 3Å; F154-T172 PolarHBondContact O-N 3.21Å; T172-E177 CarbonylContact C-O 3.42Å; T172-E177 WeakPolarHBondContact CA-O 3.42Å; T172-K178 HydrophobicContact CG2-CG 4.27Å
173	L	94.8	Very high	91.3	Very high	9 Å²	9	44.6 Å²	44.6	5%	0.047	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	161.9	178.4	-53.5	-173.9	0	0	0	110.8	I147 R151 I152 G175 G176 E177	I147-L173 HydrophobicContact CG2-CD2 3.77Å; R151-L173 HydrophobicContact CB-CD2 4.28Å; R151-L173 CarbonylContact O-C 3.56Å; R151-L173 WeakPolarHBondContact O-CA 3.18Å; R151-L173 WeakPolarHBondContact O-CB 3.45Å; I152-L173 HydrophobicContact CG1-CD2 4.2Å; L173-G175 PolarHBondContact O-N 2.84Å; L173-G175 VanDerWaalsContact O-N 3.12Å; L173-G176 PolarHBondContact O-N 3.03Å; L173-E177 HydrophobicContact CB-CB 4.42Å; L173-E177 HydrophobicContact CD1-CB 4.29Å; L173-E177 HydrophobicContact CD1-CG 4.5Å; L173-E177 HydrophobicContact CG-CB 4.49Å; L173-E177 PolarHBondContact N-O 3.13Å
174	K	92.4	Very high	91.4	Very high	143 Å²	143	41.4 Å²	41.4	62%	0.622	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.4	177.5	-70.4	177.6	176.6	168.5	0	113.6	S150 R151 G176	S150-K174 WeakPolarHBondContact O-CE 3.14Å; S150-K174 PolarHBondContact O-NZ 2.83Å; R151-K174 PolarHBondContact O-N 3.09Å; K174-G176 VanDerWaalsContact C-N 3.29Å
175	G	90.3	Very high	91.5	Very high	79 Å²	79	42.5 Å²	42.5	81%	0.814	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	3.1	172.4	0	0	0	0	0	114.9	L173 E177	L173-G175 PolarHBondContact O-N 2.84Å; L173-G175 VanDerWaalsContact O-N 3.12Å; G175-E177 VanDerWaalsContact C-N 3.29Å; G175-E177 PolarHBondContact O-N 3.1Å
176	G	90.7	Very high	91.6	Very high	49 Å²	49	46.3 Å²	46.3	51%	0.505	27%	0.272	S	S	.	.	S	Bend	trans	86.2	-12.4	-178.6	0	0	0	0	0	115.1	L173 K174	L173-G176 PolarHBondContact O-N 3.03Å; K174-G176 VanDerWaalsContact C-N 3.29Å
177	E	93.5	Very high	91.7	Very high	115 Å²	115	44.8 Å²	44.8	54%	0.537	27%	0.272	S	S	.	.			trans	-59.6	135.4	175	-175.6	-176.5	-176.1	0	0	111.2	R151 T172 L173 G175	R151-E177 IonicContact NH2-OE2 2.67Å; T172-E177 CarbonylContact C-O 3.42Å; T172-E177 WeakPolarHBondContact CA-O 3.42Å; L173-E177 HydrophobicContact CB-CB 4.42Å; L173-E177 HydrophobicContact CD1-CB 4.29Å; L173-E177 HydrophobicContact CD1-CG 4.5Å; L173-E177 HydrophobicContact CG-CB 4.49Å; L173-E177 PolarHBondContact N-O 3.13Å; G175-E177 VanDerWaalsContact C-N 3.29Å; G175-E177 PolarHBondContact O-N 3.1Å
178	K	94.8	Very high	91.7	Very high	152 Å²	152	44.9 Å²	44.9	66%	0.661	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.8	177.2	-63.4	-179.6	-176.6	174.9	0	110.1	I170 A171 T172	I170-K178 HydrophobicContact CG2-CB 4.34Å; A171-K178 WeakPolarHBondContact O-CA 3.28Å; T172-K178 HydrophobicContact CG2-CG 4.27Å
179	T	94.8	Very high	91.5	Very high	15 Å²	15	48.8 Å²	48.8	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	140.6	-177.4	-178.9	0	0	0	0	110.9	V144 I147 I170 A171	V144-T179 WeakPolarHBondContact CG2-OG1 3.42Å; I147-T179 HydrophobicContact CD1-CG2 3.08Å; I170-T179 CarbonylContact C-O 3.57Å; I170-T179 WeakPolarHBondContact CA-O 3.06Å; A171-T179 HydrophobicContact CB-CG2 4.07Å; A171-T179 PolarHBondContact N-O 3.26Å; A171-T179 PolarHBondContact O-N 2.69Å
180	C	94.6	Very high	91.2	Very high	14 Å²	14	55.7 Å²	55.7	10%	0.095	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	139.2	179.5	-70.8	0	0	0	0	110.7	C140 N142 V144 V169	C140-C180 WeakPolarHBondContact CA-SG 3.37Å; C140-C180 HydrophobicContact CB-CB 3.59Å; C140-C180 WeakPolarHBondContact CB-SG 3.09Å; C140-C180 WeakPolarHBondContact SG-CB 3.2Å; C140-C180 CovalentContact SG-SG 2.03Å; C140-C180 PolarHBondContact SG-SG 2.93Å; N142-C180 WeakPolarHBondContact O-CB 3.47Å; V144-C180 PolarHBondContact N-O 3.38Å; V169-C180 CarbonylContact O-C 3.56Å; V169-C180 WeakPolarHBondContact O-CA 3.5Å
181	L	93.1	Very high	91	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.9	-174.9	-62.7	178.5	0	0	0	109.9	I147 V169 A171 P183 I188	I147-L181 HydrophobicContact CD1-CD2 3.57Å; I147-L181 HydrophobicContact CG1-CD2 3.88Å; V169-L181 HydrophobicContact CB-CB 4.09Å; V169-L181 HydrophobicContact CG1-CB 4.03Å; V169-L181 HydrophobicContact CG1-CD1 4.13Å; V169-L181 PolarHBondContact O-N 3.44Å; A171-L181 HydrophobicContact CB-CD1 3.71Å; A171-L181 HydrophobicContact CB-CG 4.32Å; L181-P183 VanDerWaalsContact O-CD 3.24Å; L181-P183 WeakPolarHBondContact O-CD 2.92Å; L181-I188 HydrophobicContact CB-CD1 3.79Å; L181-I188 HydrophobicContact CB-CG1 4.02Å; L181-I188 HydrophobicContact CB-CG2 4.47Å; L181-I188 HydrophobicContact CD1-CD1 3.96Å; L181-I188 HydrophobicContact CD2-CD1 4.11Å; L181-I188 HydrophobicContact CG-CD1 4.18Å
182	D	89.5	Confident	90.7	Very high	51 Å²	51	55.5 Å²	55.5	27%	0.273	32%	0.318	S	S	.	.			trans	-70.6	111.9	178.2	-179.1	3.6	0	0	0	110.8	I143 N184 A185 I188	I143-D182 HydrophobicContact CG2-CB 3.81Å; I143-D182 VanDerWaalsContact CG2-N 3.33Å; D182-N184 PolarHBondContact O-N 2.74Å; D182-N184 WeakPolarHBondContact OD1-CB 3.49Å; D182-N184 PolarHBondContact OD1-N 2.69Å; D182-N184 PolarHBondContact OD1-ND2 3.5Å; D182-A185 HydrophobicContact CB-CB 3.82Å; D182-A185 PolarHBondContact O-N 2.84Å; D182-A185 PolarHBondContact OD2-N 2.05Å; D182-I188 WeakPolarHBondContact O-CG1 3.4Å
183	P	88.2	Confident	90.4	Very high	18 Å²	18	56.2 Å²	56.2	12%	0.117	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.2	178.7	30	-39.2	0	0	0	113.7	A111 V167 V169 L181	A111-P183 HydrophobicContact CB-CB 4.13Å; A111-P183 HydrophobicContact CB-CG 4.34Å; V167-P183 HydrophobicContact CB-CB 3.99Å; V167-P183 HydrophobicContact CB-CG 4.3Å; V167-P183 HydrophobicContact CG1-CB 3.73Å; V167-P183 WeakPolarHBondContact O-CG 3.09Å; V169-P183 HydrophobicContact CG2-CB 4.04Å; L181-P183 VanDerWaalsContact O-CD 3.24Å; L181-P183 WeakPolarHBondContact O-CD 2.92Å
184	N	85.4	Confident	90.2	Very high	62 Å²	62	60.6 Å²	60.6	33%	0.332	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-17.6	-178.5	-54.3	-62.9	0	0	0	112.5	A111 N112 D182 P186	A111-N184 VanDerWaalsContact CB-OD1 3.3Å; A111-N184 WeakPolarHBondContact CB-OD1 3.27Å; N112-N184 PolarHBondContact OD1-OD1 2.69Å; D182-N184 PolarHBondContact O-N 2.74Å; D182-N184 WeakPolarHBondContact OD1-CB 3.49Å; D182-N184 PolarHBondContact OD1-N 2.69Å; D182-N184 PolarHBondContact OD1-ND2 3.5Å; N184-P186 WeakPolarHBondContact O-CD 3.5Å
185	A	87.6	Confident	90.1	Very high	27 Å²	27	53.9 Å²	53.9	22%	0.223	31%	0.31	C	S	.	.	S	Bend	trans	-67.7	127.3	179.5	0	0	0	0	0	110.7	D182 A187 I188	D182-A185 HydrophobicContact CB-CB 3.82Å; D182-A185 PolarHBondContact O-N 2.84Å; D182-A185 PolarHBondContact OD2-N 2.05Å; A185-A187 PolarHBondContact O-N 3.39Å; A185-I188 HydrophobicContact CB-CG1 4.19Å; A185-I188 PolarHBondContact O-N 3.07Å
186	P	86.9	Confident	90	Very high	102 Å²	102	50.7 Å²	50.7	66%	0.662	28%	0.275	S	S	*	.	H	α-helix	trans	-57.4	-27.9	179.7	-26.4	34.1	0	0	0	113.7	N184 I188 K190	N184-P186 WeakPolarHBondContact O-CD 3.5Å; P186-I188 VanDerWaalsContact C-N 3.32Å; P186-I188 PolarHBondContact O-N 2.83Å; P186-K190 PolarHBondContact O-N 2.85Å
187	A	87.6	Confident	89.7	Confident	56 Å²	56	53.7 Å²	53.7	46%	0.463	28%	0.275	S	S	.	.	H	α-helix	trans	-61.9	-36.4	176.7	0	0	0	0	0	112.5	A185 K190 I191	A185-A187 PolarHBondContact O-N 3.39Å; A187-K190 WeakPolarHBondContact O-CB 3.35Å; A187-K190 PolarHBondContact O-N 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.4Å; A187-I191 PolarHBondContact O-N 3.44Å
188	I	88.6	Confident	88.7	Confident	9 Å²	9	50.5 Å²	50.5	5%	0.046	27%	0.273	C	S	.	.	H	α-helix	trans	-70	-40.9	-177.3	-60.7	-40.4	0	0	0	111.4	V169 L181 D182 A185 P186 K190 I191 V192	V169-I188 HydrophobicContact CB-CG2 4.32Å; V169-I188 HydrophobicContact CG1-CG2 3.86Å; V169-I188 HydrophobicContact CG2-CG2 4.22Å; L181-I188 HydrophobicContact CB-CD1 3.79Å; L181-I188 HydrophobicContact CB-CG1 4.02Å; L181-I188 HydrophobicContact CB-CG2 4.47Å; L181-I188 HydrophobicContact CD1-CD1 3.96Å; L181-I188 HydrophobicContact CD2-CD1 4.11Å; L181-I188 HydrophobicContact CG-CD1 4.18Å; D182-I188 WeakPolarHBondContact O-CG1 3.4Å; A185-I188 HydrophobicContact CB-CG1 4.19Å; A185-I188 PolarHBondContact O-N 3.07Å; P186-I188 VanDerWaalsContact C-N 3.32Å; P186-I188 PolarHBondContact O-N 2.83Å; I188-K190 VanDerWaalsContact C-N 3.29Å; I188-K190 PolarHBondContact O-N 3.14Å; I188-I191 HydrophobicContact CD1-CD1 3.8Å; I188-I191 WeakPolarHBondContact O-CB 3.37Å; I188-I191 PolarHBondContact O-N 2.81Å; I188-I191 VanDerWaalsContact O-N 3.09Å; I188-V192 PolarHBondContact O-N 2.77Å
189	K	88.7	Confident	87.1	Confident	90 Å²	90	49.9 Å²	49.9	39%	0.391	27%	0.267	S	S	.	.	H	α-helix	trans	-57.5	-44.4	171.7	173.5	178.5	160.8	167.1	0	111.3	Q105 L108 I191 V192 M193	Q105-K189 VanDerWaalsContact CD-CE 3.45Å; L108-K189 HydrophobicContact CD1-CB 4.23Å; K189-I191 VanDerWaalsContact C-N 3.31Å; K189-I191 PolarHBondContact O-N 3.39Å; K189-V192 PolarHBondContact O-N 3.34Å; K189-M193 HydrophobicContact CG-CG 4.41Å; K189-M193 WeakPolarHBondContact O-CB 3.39Å; K189-M193 WeakPolarHBondContact O-CG 3.28Å; K189-M193 PolarHBondContact O-N 2.89Å
190	K	88.6	Confident	86.7	Confident	145 Å²	145	51.6 Å²	51.6	63%	0.63	28%	0.276	S	S	*	.	H	α-helix	trans	-60.7	-43.5	175.1	-68.8	179.5	-177.2	179.1	0	110.6	P186 A187 I188 V192 M193 K194 Y199	P186-K190 PolarHBondContact O-N 2.85Å; A187-K190 WeakPolarHBondContact O-CB 3.35Å; A187-K190 PolarHBondContact O-N 3.3Å; I188-K190 VanDerWaalsContact C-N 3.29Å; I188-K190 PolarHBondContact O-N 3.14Å; K190-V192 PolarHBondContact O-N 2.81Å; K190-M193 PolarHBondContact O-N 3.45Å; K190-K194 WeakPolarHBondContact O-CB 3.32Å; K190-K194 PolarHBondContact O-N 2.84Å; K190-Y199 PolarHBondContact O-OH 3.25Å
191	I	89.4	Confident	86.3	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.087	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-45.8	178	-72.9	164	0	0	0	112.1	L149 I152 A187 I188 K189 I195 Y199	L149-I191 HydrophobicContact CD2-CB 3.81Å; L149-I191 HydrophobicContact CD2-CG1 3.65Å; L149-I191 HydrophobicContact CD2-CG2 3.51Å; L149-I191 HydrophobicContact CG-CG1 4.28Å; I152-I191 HydrophobicContact CD1-CG2 3.78Å; A187-I191 WeakPolarHBondContact O-CG1 3.4Å; A187-I191 PolarHBondContact O-N 3.44Å; I188-I191 HydrophobicContact CD1-CD1 3.8Å; I188-I191 WeakPolarHBondContact O-CB 3.37Å; I188-I191 PolarHBondContact O-N 2.81Å; I188-I191 VanDerWaalsContact O-N 3.09Å; K189-I191 VanDerWaalsContact C-N 3.31Å; K189-I191 PolarHBondContact O-N 3.39Å; I191-I195 HydrophobicContact CG2-CD1 4.27Å; I191-I195 WeakPolarHBondContact O-CG1 3.47Å; I191-I195 PolarHBondContact O-N 3Å; I191-Y199 VanDerWaalsContact C-OH 3.25Å; I191-Y199 WeakPolarHBondContact CA-OH 3.03Å; I191-Y199 PolarHBondContact O-OH 2.94Å
192	V	89.8	Confident	85.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-71	-42.4	-178.7	-178	0	0	0	0	111.2	V69 I104 V155 I188 K189 K190 K194 I195 L196	V69-V192 HydrophobicContact CG2-CG1 4.17Å; I104-V192 HydrophobicContact CD1-CG1 3.6Å; I104-V192 HydrophobicContact CG2-CB 4.31Å; I104-V192 HydrophobicContact CG2-CG1 3.66Å; V155-V192 HydrophobicContact CG1-CG2 4.2Å; I188-V192 PolarHBondContact O-N 2.77Å; K189-V192 PolarHBondContact O-N 3.34Å; K190-V192 PolarHBondContact O-N 2.81Å; V192-K194 VanDerWaalsContact C-N 3.3Å; V192-K194 PolarHBondContact O-N 3.2Å; V192-I195 PolarHBondContact O-N 2.78Å; V192-L196 PolarHBondContact O-N 2.89Å
193	M	89.9	Confident	85.7	Confident	25 Å²	25	56.7 Å²	56.7	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-41.6	-177.6	-71.7	-62.2	165.7	0	0	112.7	K101 I104 Q105 K189 K190 I195 L196 E197	K101-M193 HydrophobicContact CB-SD 3.97Å; K101-M193 HydrophobicContact CG-SD 4.07Å; K101-M193 WeakPolarHBondContact O-CE 3.43Å; I104-M193 HydrophobicContact CB-CE 3.95Å; I104-M193 HydrophobicContact CG2-CE 3.83Å; Q105-M193 HydrophobicContact CB-CE 4.19Å; K189-M193 HydrophobicContact CG-CG 4.41Å; K189-M193 WeakPolarHBondContact O-CB 3.39Å; K189-M193 WeakPolarHBondContact O-CG 3.28Å; K189-M193 PolarHBondContact O-N 2.89Å; K190-M193 PolarHBondContact O-N 3.45Å; M193-I195 PolarHBondContact O-N 3.37Å; M193-L196 VanDerWaalsContact O-CB 3.3Å; M193-L196 WeakPolarHBondContact O-CB 3.44Å; M193-L196 PolarHBondContact O-N 3.25Å; M193-L196 VanDerWaalsContact O-N 3.16Å; M193-L196 HydrophobicContact SD-CD1 4.5Å; M193-E197 WeakPolarHBondContact O-CG 3.19Å; M193-E197 PolarHBondContact O-N 3.47Å
194	K	89.8	Confident	85.5	Confident	100 Å²	100	59.1 Å²	59.1	44%	0.435	31%	0.314	S	S	.	.	H	α-helix	trans	-82.7	-18.6	-167.7	-154.7	-174.6	168.8	-98.4	0	106	K190 V192 E197 G198 Y199	K190-K194 WeakPolarHBondContact O-CB 3.32Å; K190-K194 PolarHBondContact O-N 2.84Å; V192-K194 VanDerWaalsContact C-N 3.3Å; V192-K194 PolarHBondContact O-N 3.2Å; K194-E197 PolarHBondContact O-N 3.05Å; K194-G198 PolarHBondContact O-N 3.39Å; K194-Y199 VanDerWaalsContact C-CD2 3.42Å; K194-Y199 VanDerWaalsContact CA-CE1 3.44Å; K194-Y199 WeakPolarHBondContact CA-OH 3.34Å; K194-Y199 HydrophobicContact CB-CD1 3.76Å; K194-Y199 HydrophobicContact CB-CE1 2.92Å; K194-Y199 HydrophobicContact CB-CE2 4.36Å; K194-Y199 WeakPolarHBondContact CB-OH 3.49Å; K194-Y199 HydrophobicContact CD-CD1 4.13Å; K194-Y199 HydrophobicContact CD-CE1 3.43Å; K194-Y199 VanDerWaalsContact CD-CE1 3.43Å; K194-Y199 HydrophobicContact CG-CD1 3.44Å; K194-Y199 VanDerWaalsContact CG-CD1 3.44Å; K194-Y199 HydrophobicContact CG-CE1 2.97Å; K194-Y199 WeakPolarHBondContact O-CD1 3.23Å; K194-Y199 WeakPolarHBondContact O-CD2 3.41Å; K194-Y199 WeakPolarHBondContact O-CE2 3.08Å; K194-Y199 VanDerWaalsContact O-CZ 3.3Å; K194-Y199 PolarHBondContact O-N 3.03Å
195	I	89.6	Confident	85.6	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.015	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-44.6	166.9	-69.6	166.4	0	0	0	109.1	V69 T71 V79 I152 V155 I191 V192 M193 E197 G198 Y199	V69-I195 HydrophobicContact CG1-CB 4.23Å; V69-I195 HydrophobicContact CG1-CG2 3.56Å; T71-I195 HydrophobicContact CG2-CD1 4.23Å; T71-I195 HydrophobicContact CG2-CG1 4.09Å; T71-I195 HydrophobicContact CG2-CG2 3.8Å; V79-I195 HydrophobicContact CG1-CG2 4.2Å; V79-I195 VanDerWaalsContact CG2-O 3.23Å; V79-I195 WeakPolarHBondContact CG2-O 3.41Å; I152-I195 HydrophobicContact CG2-CD1 4.31Å; V155-I195 HydrophobicContact CG2-CD1 3.67Å; I191-I195 HydrophobicContact CG2-CD1 4.27Å; I191-I195 WeakPolarHBondContact O-CG1 3.47Å; I191-I195 PolarHBondContact O-N 3Å; V192-I195 PolarHBondContact O-N 2.78Å; M193-I195 PolarHBondContact O-N 3.37Å; I195-E197 PolarHBondContact O-N 3.48Å; I195-G198 PolarHBondContact O-N 2.98Å; I195-Y199 HydrophobicContact CB-CE2 3.84Å; I195-Y199 HydrophobicContact CG1-CD2 4.42Å; I195-Y199 HydrophobicContact CG1-CE2 3.44Å; I195-Y199 VanDerWaalsContact CG1-CE2 3.44Å; I195-Y199 PolarHBondContact N-OH 3.24Å
196	L	88.1	Confident	85.4	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-32	176.4	-61.9	179	0	0	0	112.8	V69 V79 V81 P95 M100 K101 I104 V192 M193 G198	V69-L196 HydrophobicContact CG1-CD2 3.9Å; V79-L196 HydrophobicContact CG1-CD2 4.47Å; V81-L196 HydrophobicContact CG2-CD2 3.45Å; V81-L196 VanDerWaalsContact CG2-CD2 3.45Å; P95-L196 HydrophobicContact CB-CD2 4.21Å; M100-L196 HydrophobicContact CG-CD1 3.95Å; M100-L196 HydrophobicContact CG-CD2 4.31Å; K101-L196 HydrophobicContact CG-CD1 4.28Å; I104-L196 HydrophobicContact CD1-CD1 3.52Å; I104-L196 HydrophobicContact CD1-CD2 4.14Å; I104-L196 HydrophobicContact CD1-CG 4.05Å; I104-L196 HydrophobicContact CG1-CD1 4.45Å; V192-L196 PolarHBondContact O-N 2.89Å; M193-L196 VanDerWaalsContact O-CB 3.3Å; M193-L196 WeakPolarHBondContact O-CB 3.44Å; M193-L196 PolarHBondContact O-N 3.25Å; M193-L196 VanDerWaalsContact O-N 3.16Å; M193-L196 HydrophobicContact SD-CD1 4.5Å; L196-G198 PolarHBondContact O-N 2.96Å
197	E	85.3	Confident	85.3	Confident	112 Å²	112	58.1 Å²	58.1	52%	0.523	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-2.5	179.9	-66	167.5	173	0	0	112.5	K101 M193 K194 I195 Y199	K101-E197 IonicContact NZ-OE1 3.76Å; K101-E197 PolarHBondContact NZ-OE1 2.95Å; M193-E197 WeakPolarHBondContact O-CG 3.19Å; M193-E197 PolarHBondContact O-N 3.47Å; K194-E197 PolarHBondContact O-N 3.05Å; I195-E197 PolarHBondContact O-N 3.48Å; E197-Y199 PolarHBondContact O-N 3.2Å
198	G	72.9	Confident	85.1	Confident	47 Å²	47	58.3 Å²	58.3	49%	0.485	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	3.2	175.4	0	0	0	0	0	115.7	K194 I195 L196	K194-G198 PolarHBondContact O-N 3.39Å; I195-G198 PolarHBondContact O-N 2.98Å; L196-G198 PolarHBondContact O-N 2.96Å
199	Y	60.5	Low	84.8	Confident	139 Å²	139	62.7 Å²	62.7	55%	0.545	30%	0.3	S	S	.	.			trans	33.5	0	179.3	-62.5	-79.8	0	0	0	119	L149 K190 I191 K194 I195 E197	L149-Y199 HydrophobicContact CB-CE2 4.46Å; L149-Y199 HydrophobicContact CD1-CD1 4.03Å; L149-Y199 HydrophobicContact CD1-CE1 3.22Å; L149-Y199 HydrophobicContact CD1-CE2 4.15Å; L149-Y199 WeakPolarHBondContact CD1-OH 3.3Å; L149-Y199 HydrophobicContact CD2-CE1 4.24Å; L149-Y199 HydrophobicContact CD2-CE2 3.81Å; L149-Y199 VanDerWaalsContact CD2-CZ 3.46Å; L149-Y199 WeakPolarHBondContact CD2-OH 3.26Å; L149-Y199 HydrophobicContact CG-CE1 4.24Å; L149-Y199 HydrophobicContact CG-CE2 4.36Å; K190-Y199 PolarHBondContact O-OH 3.25Å; I191-Y199 VanDerWaalsContact C-OH 3.25Å; I191-Y199 WeakPolarHBondContact CA-OH 3.03Å; I191-Y199 PolarHBondContact O-OH 2.94Å; K194-Y199 VanDerWaalsContact C-CD2 3.42Å; K194-Y199 VanDerWaalsContact CA-CE1 3.44Å; K194-Y199 WeakPolarHBondContact CA-OH 3.34Å; K194-Y199 HydrophobicContact CB-CD1 3.76Å; K194-Y199 HydrophobicContact CB-CE1 2.92Å; K194-Y199 HydrophobicContact CB-CE2 4.36Å; K194-Y199 WeakPolarHBondContact CB-OH 3.49Å; K194-Y199 HydrophobicContact CD-CD1 4.13Å; K194-Y199 HydrophobicContact CD-CE1 3.43Å; K194-Y199 VanDerWaalsContact CD-CE1 3.43Å; K194-Y199 HydrophobicContact CG-CD1 3.44Å; K194-Y199 VanDerWaalsContact CG-CD1 3.44Å; K194-Y199 HydrophobicContact CG-CE1 2.97Å; K194-Y199 WeakPolarHBondContact O-CD1 3.23Å; K194-Y199 WeakPolarHBondContact O-CD2 3.41Å; K194-Y199 WeakPolarHBondContact O-CE2 3.08Å; K194-Y199 VanDerWaalsContact O-CZ 3.3Å; K194-Y199 PolarHBondContact O-N 3.03Å; I195-Y199 HydrophobicContact CB-CE2 3.84Å; I195-Y199 HydrophobicContact CG1-CD2 4.42Å; I195-Y199 HydrophobicContact CG1-CE2 3.44Å; I195-Y199 VanDerWaalsContact CG1-CE2 3.44Å; I195-Y199 PolarHBondContact N-OH 3.24Å; E197-Y199 PolarHBondContact O-N 3.2Å

Retrieved 199 of 199 residues in 352.5 ms (Link to these results)

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