A0A077ZMD7_TRITR Loading...

Activating signal cointegrator 1

AlphaFold DB , UniProt , Accession A0A077ZMD7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 437 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.8	Low	67.6	Low	176 Å²	176	107.4 Å²	107.4	87%	0.867	56%	0.555	S	S	*	*				0	128.2	0	-64.4	-159.4	-154.7	0	0	107.6	E5 I6	M1-E5 WeakPolarHBondContact CA-OE2 3.36Å; M1-I6 HydrophobicContact CB-CG1 4.35Å
2	S	67.5	Low	67.5	Low	63 Å²	63	106.7 Å²	106.7	44%	0.441	55%	0.552	S	S	.	*			trans	-74.8	154.2	178.5	89.5	0	0	0	0	110.3	R4 E5 I6	S2-R4 PolarHBondContact O-N 2.69Å; S2-R4 VanDerWaalsContact O-N 3.1Å; S2-R4 PolarHBondContact OG-N 3.31Å; S2-E5 PolarHBondContact N-OE2 3.49Å; S2-E5 WeakPolarHBondContact O-CB 3.5Å; S2-E5 PolarHBondContact O-N 3.08Å; S2-I6 PolarHBondContact O-N 2.86Å
3	T	65.3	Low	67.3	Low	113 Å²	113	106.6 Å²	106.6	69%	0.693	55%	0.553	S	S	*	*	H	α-helix	trans	-54.9	-29.8	178.8	47.5	0	0	0	0	112.9	L7	T3-L7 PolarHBondContact O-N 3.26Å
4	R	71.1	Confident	66.5	Low	209 Å²	209	104.4 Å²	104.4	79%	0.789	55%	0.546	S	S	*	.	H	α-helix	trans	-63.2	-38.8	172.5	-90	-178.3	165.9	167.5	-3.5	113.3	S2 A8	S2-R4 PolarHBondContact O-N 2.69Å; S2-R4 VanDerWaalsContact O-N 3.1Å; S2-R4 PolarHBondContact OG-N 3.31Å; R4-A8 WeakPolarHBondContact O-CB 3.44Å; R4-A8 PolarHBondContact O-N 2.95Å
5	E	69.6	Low	66	Low	106 Å²	106	105.4 Å²	105.4	50%	0.495	55%	0.547	S	S	.	.	H	α-helix	trans	-72.8	-32.8	-178	-64.5	173.7	144.3	0	0	111.8	M1 S2 K9	M1-E5 WeakPolarHBondContact CA-OE2 3.36Å; S2-E5 PolarHBondContact N-OE2 3.49Å; S2-E5 WeakPolarHBondContact O-CB 3.5Å; S2-E5 PolarHBondContact O-N 3.08Å; E5-K9 PolarHBondContact O-N 3.3Å
6	I	67	Low	65.7	Low	102 Å²	102	109.7 Å²	109.7	52%	0.523	56%	0.56	S	S	.	*	H	α-helix	trans	-70.9	-43.7	177.8	-59.8	171.4	0	0	0	110.2	M1 S2 K9 S10	M1-I6 HydrophobicContact CB-CG1 4.35Å; S2-I6 PolarHBondContact O-N 2.86Å; I6-K9 PolarHBondContact O-N 3Å; I6-S10 PolarHBondContact O-N 3.36Å; I6-S10 VanDerWaalsContact O-N 3.14Å
7	L	66.3	Low	65.4	Low	84 Å²	84	113.2 Å²	113.2	44%	0.44	57%	0.571	S	S	.	*	H	α-helix	trans	-66.3	-41.3	177.3	-84.5	160.6	0	0	0	112.6	T3 K9 S10 L11 L405	T3-L7 PolarHBondContact O-N 3.26Å; L7-K9 PolarHBondContact O-N 3.08Å; L7-S10 PolarHBondContact O-N 3.38Å; L7-S10 PolarHBondContact O-OG 3.45Å; L7-L11 PolarHBondContact O-N 3.25Å; L7-L405 HydrophobicContact CD1-CD1 4.49Å
8	A	72	Confident	64.2	Low	50 Å²	50	113.6 Å²	113.6	41%	0.413	57%	0.565	S	S	.	*	H	α-helix	trans	-62.9	-40	177.7	0	0	0	0	0	112.5	R4 L11 L12	R4-A8 WeakPolarHBondContact O-CB 3.44Å; R4-A8 PolarHBondContact O-N 2.95Å; A8-L11 PolarHBondContact O-N 3.15Å; A8-L12 WeakPolarHBondContact O-CG 3.41Å; A8-L12 PolarHBondContact O-N 3.38Å
9	K	73	Confident	63.2	Low	125 Å²	125	115.8 Å²	115.8	54%	0.543	58%	0.579	S	S	.	*	H	α-helix	trans	-64.1	-40.7	172.8	-82.7	-178.9	174.2	178.7	0	112.1	E5 I6 L7 L11 L12 D13	E5-K9 PolarHBondContact O-N 3.3Å; I6-K9 PolarHBondContact O-N 3Å; L7-K9 PolarHBondContact O-N 3.08Å; K9-L11 VanDerWaalsContact C-N 3.33Å; K9-L11 PolarHBondContact O-N 3.46Å; K9-L12 PolarHBondContact O-N 2.95Å; K9-D13 PolarHBondContact O-N 3.26Å
10	S	70.7	Confident	62.4	Low	56 Å²	56	116.4 Å²	116.4	39%	0.392	58%	0.583	S	S	.	*	H	α-helix	trans	-64.6	-34.8	178.1	82.6	0	0	0	0	113.3	I6 L7 V14	I6-S10 PolarHBondContact O-N 3.36Å; I6-S10 VanDerWaalsContact O-N 3.14Å; L7-S10 PolarHBondContact O-N 3.38Å; L7-S10 PolarHBondContact O-OG 3.45Å; S10-V14 VanDerWaalsContact O-CG2 3.28Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 3.12Å
11	L	67.8	Low	61.6	Low	97 Å²	97	114.8 Å²	114.8	51%	0.508	58%	0.575	S	S	.	*	H	α-helix	trans	-69.1	-43.3	176.9	-98.9	160.7	0	0	0	112	L7 A8 K9 D13 V14 E15	L7-L11 PolarHBondContact O-N 3.25Å; A8-L11 PolarHBondContact O-N 3.15Å; K9-L11 VanDerWaalsContact C-N 3.33Å; K9-L11 PolarHBondContact O-N 3.46Å; L11-D13 VanDerWaalsContact C-N 3.3Å; L11-D13 PolarHBondContact O-N 3.12Å; L11-V14 PolarHBondContact O-N 3.19Å; L11-E15 PolarHBondContact O-N 2.99Å; L11-E15 VanDerWaalsContact O-N 3.11Å
12	L	66.5	Low	61.5	Low	99 Å²	99	112 Å²	112	52%	0.518	56%	0.564	S	S	.	*	H	α-helix	trans	-65.3	-33.2	176.5	-70.5	168.4	0	0	0	112.4	A8 K9 V14 K16	A8-L12 WeakPolarHBondContact O-CG 3.41Å; A8-L12 PolarHBondContact O-N 3.38Å; K9-L12 PolarHBondContact O-N 2.95Å; L12-V14 VanDerWaalsContact C-N 3.34Å; L12-K16 PolarHBondContact O-N 3.21Å
13	D	65.3	Low	60.9	Low	106 Å²	106	112.5 Å²	112.5	57%	0.567	57%	0.567	S	S	*	*	H	α-helix	trans	-72.4	-27.2	175.6	-73.8	-21.2	0	0	0	112.5	K9 L11 K17	K9-D13 PolarHBondContact O-N 3.26Å; L11-D13 VanDerWaalsContact C-N 3.3Å; L11-D13 PolarHBondContact O-N 3.12Å; D13-K17 WeakPolarHBondContact O-CB 3.45Å; D13-K17 PolarHBondContact O-N 3.32Å
14	V	56.5	Low	60.4	Low	75 Å²	75	112.4 Å²	112.4	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-76	-41.2	174.7	172.4	0	0	0	0	111.3	S10 L11 L12 K16 K17 Y18	S10-V14 VanDerWaalsContact O-CG2 3.28Å; S10-V14 WeakPolarHBondContact O-CG2 3.45Å; S10-V14 PolarHBondContact O-N 3.12Å; L11-V14 PolarHBondContact O-N 3.19Å; L12-V14 VanDerWaalsContact C-N 3.34Å; V14-K16 PolarHBondContact O-N 2.94Å; V14-K17 PolarHBondContact O-N 3.44Å; V14-Y18 HydrophobicContact CG1-CD2 4.28Å; V14-Y18 PolarHBondContact O-N 3.01Å
15	E	59.1	Low	59.6	Low	120 Å²	120	108 Å²	108	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-64.9	-34.5	176.2	-76.9	178.5	164.8	0	0	113.1	L11	L11-E15 PolarHBondContact O-N 2.99Å; L11-E15 VanDerWaalsContact O-N 3.11Å
16	K	60.4	Low	58.7	Low	174 Å²	174	106.8 Å²	106.8	76%	0.757	55%	0.547	S	S	*	.	H	α-helix	trans	-75.1	-27.2	175.8	-78.8	-180	179.6	175.6	0	113.8	L12 V14	L12-K16 PolarHBondContact O-N 3.21Å; V14-K16 PolarHBondContact O-N 2.94Å
17	K	60.5	Low	57.8	Low	170 Å²	170	104.5 Å²	104.5	74%	0.739	54%	0.543	S	S	*	.	H	α-helix	trans	-86.4	-24.9	-174.9	-158.8	171.2	-169	172.1	0	112.8	D13 V14	D13-K17 WeakPolarHBondContact O-CB 3.45Å; D13-K17 PolarHBondContact O-N 3.32Å; V14-K17 PolarHBondContact O-N 3.44Å
18	Y	44.3	Very low	57.1	Low	119 Å²	119	108 Å²	108	47%	0.467	56%	0.555	S	S	.	*	S	Bend	trans	-119.7	109.1	175.6	-63.5	-82.8	0	0	0	107.3	V14 I20 K421	V14-Y18 HydrophobicContact CG1-CD2 4.28Å; V14-Y18 PolarHBondContact O-N 3.01Å; Y18-I20 WeakPolarHBondContact O-CG1 3.47Å; Y18-I20 PolarHBondContact O-N 2.96Å; Y18-K421 PolarHBondContact OH-NZ 3.33Å
19	N	44.8	Very low	56	Low	156 Å²	156	115 Å²	115	83%	0.834	57%	0.571	S	S	*	*			trans	-59.5	77.6	170.2	-85.6	-19.8	0	0	0	109.6	I21	N19-I21 VanDerWaalsContact C-N 3.27Å; N19-I21 PolarHBondContact O-N 3.43Å
20	I	46.8	Very low	54.7	Low	128 Å²	128	117.3 Å²	117.3	66%	0.656	58%	0.581	S	S	*	*			trans	-74	91.8	175.6	-64.1	165	0	0	0	105.2	Y18 D22	Y18-I20 WeakPolarHBondContact O-CG1 3.47Å; Y18-I20 PolarHBondContact O-N 2.96Å; I20-D22 PolarHBondContact O-N 3.04Å
21	I	47.2	Very low	53.7	Low	82 Å²	82	122.7 Å²	122.7	42%	0.421	60%	0.6	S	S	.	*			trans	-66.9	125	173.1	-60.4	167.9	0	0	0	106.7	N19 E25 I26	N19-I21 VanDerWaalsContact C-N 3.27Å; N19-I21 PolarHBondContact O-N 3.43Å; I21-E25 HydrophobicContact CG2-CB 3.88Å; I21-I26 HydrophobicContact CG2-CD1 4.48Å; I21-I26 HydrophobicContact CG2-CG1 4.06Å
22	D	50	Low	52.1	Low	117 Å²	117	127.6 Å²	127.6	63%	0.626	62%	0.617	S	S	*	*			trans	-58.3	139	-177.8	-139.7	-18	0	0	0	110.7	I20 D24 E25	I20-D22 PolarHBondContact O-N 3.04Å; D22-D24 PolarHBondContact O-N 2.96Å; D22-E25 PolarHBondContact O-N 3.44Å
23	S	55.4	Low	50.5	Low	74 Å²	74	126 Å²	126	52%	0.517	62%	0.624	S	S	.	*	H	α-helix	trans	-60.7	-22.5	-171.1	-61.7	0	0	0	0	112.4	A27	S23-A27 PolarHBondContact O-N 3Å
24	D	53.2	Low	49	Very low	112 Å²	112	130.9 Å²	130.9	60%	0.599	64%	0.641	S	S	*	*	H	α-helix	trans	-75.5	-25.6	177.8	-70.5	-7.7	0	0	0	113.4	D22 K28	D22-D24 PolarHBondContact O-N 2.96Å; D24-K28 WeakPolarHBondContact O-CG 3.21Å; D24-K28 PolarHBondContact O-N 3.05Å
25	E	54.8	Low	48.1	Very low	115 Å²	115	135.4 Å²	135.4	54%	0.537	66%	0.657	S	S	.	*	H	α-helix	trans	-75.3	-33.5	173	-79.2	-151.4	142.7	0	0	112.2	I21 D22 K28 R29	I21-E25 HydrophobicContact CG2-CB 3.88Å; D22-E25 PolarHBondContact O-N 3.44Å; E25-K28 PolarHBondContact O-N 3.37Å; E25-R29 PolarHBondContact O-N 2.84Å; E25-R29 VanDerWaalsContact O-N 3.1Å
26	I	50	Low	46.9	Very low	81 Å²	81	135.4 Å²	135.4	42%	0.415	67%	0.667	S	S	.	*	H	α-helix	trans	-71.4	-35.4	178.1	-57.7	173.7	0	0	0	110.4	I21 R29 K30	I21-I26 HydrophobicContact CG2-CD1 4.48Å; I21-I26 HydrophobicContact CG2-CG1 4.06Å; I26-R29 PolarHBondContact O-N 3.31Å; I26-K30 PolarHBondContact O-N 3.42Å
27	A	49.5	Very low	45.8	Very low	54 Å²	54	136.2 Å²	136.2	45%	0.446	67%	0.671	S	S	.	*	H	α-helix	trans	-66.7	-38.9	173.5	0	0	0	0	0	112.4	S23	S23-A27 PolarHBondContact O-N 3Å
28	K	51.2	Low	44.5	Very low	159 Å²	159	133.6 Å²	133.6	69%	0.691	67%	0.674	S	S	*	*	H	α-helix	trans	-70.7	-29.2	176.4	-73.1	173.5	-176.3	172.2	0	113.4	D24 E25	D24-K28 WeakPolarHBondContact O-CG 3.21Å; D24-K28 PolarHBondContact O-N 3.05Å; E25-K28 PolarHBondContact O-N 3.37Å
29	R	49.6	Very low	44.2	Very low	195 Å²	195	137 Å²	137	74%	0.736	69%	0.691	S	S	*	*	H	α-helix	trans	-75.4	-26.8	176.5	-84.3	178.6	158.5	176.3	-4.4	114.1	E25 I26	E25-R29 PolarHBondContact O-N 2.84Å; E25-R29 VanDerWaalsContact O-N 3.1Å; I26-R29 PolarHBondContact O-N 3.31Å
30	K	46	Very low	43.6	Very low	174 Å²	174	134.2 Å²	134.2	76%	0.757	69%	0.69	S	S	*	*	H	α-helix	trans	-81.5	-11.5	179.4	-76.8	-175.9	174.7	-178.3	0	114.9	I26	I26-K30 PolarHBondContact O-N 3.42Å
31	Q	47.6	Very low	43.2	Very low	170 Å²	170	132.5 Å²	132.5	79%	0.794	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	0.9	179.3	-70.2	-177	-5.7	0	0	114.7
32	K	36.1	Very low	42.7	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.865	71%	0.709	S	S	*	*			trans	-101.2	50.6	173.1	-73.5	-175.4	176.6	178.3	0	112.3
33	G	32.9	Very low	42.1	Very low	65 Å²	65	140 Å²	140	67%	0.67	72%	0.72	S	S	*	*			trans	-89.3	115.4	167.9	0	0	0	0	0	110.4	Q35	G33-Q35 PolarHBondContact O-N 3.46Å
34	K	33.2	Very low	41.3	Very low	209 Å²	209	144 Å²	144	91%	0.909	73%	0.731	S	S	*	*			trans	-53.4	123	179.4	-78.8	173.6	175.1	172	0	111.3
35	Q	37.2	Very low	40.5	Very low	171 Å²	171	148.2 Å²	148.2	80%	0.799	74%	0.744	S	S	*	*			trans	-51.4	131.5	166.3	-73.2	-92.4	-30.6	0	0	110.7	G33 K37	G33-Q35 PolarHBondContact O-N 3.46Å; Q35-K37 PolarHBondContact O-N 3.48Å; Q35-K37 VanDerWaalsContact O-N 3.09Å
36	P	33.5	Very low	39.7	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	75%	0.754	S	S	*	*			trans	-69.5	108.6	173.2	27.8	-29.8	0	0	0	108.4	S38	P36-S38 PolarHBondContact O-N 3.48Å
37	K	37.3	Very low	39.2	Very low	192 Å²	192	154.3 Å²	154.3	84%	0.835	77%	0.773	S	S	*	*			trans	-65	105.7	171.2	-77	-175.2	175.6	-178.6	0	108.5	Q35 K39	Q35-K37 PolarHBondContact O-N 3.48Å; Q35-K37 VanDerWaalsContact O-N 3.09Å; K37-K39 PolarHBondContact O-N 2.87Å
38	S	34.3	Very low	38.9	Very low	115 Å²	115	157 Å²	157	80%	0.804	78%	0.783	S	S	*	*			trans	-58.2	95.7	166.6	54.3	0	0	0	0	110	P36 A40	P36-S38 PolarHBondContact O-N 3.48Å; S38-A40 PolarHBondContact O-N 2.99Å
39	K	37.7	Very low	38.8	Very low	189 Å²	189	156.8 Å²	156.8	82%	0.822	79%	0.785	S	S	*	*			trans	-89.1	82.6	161.4	-79.5	-173.3	177.2	-179.8	0	107.9	K37 S41	K37-K39 PolarHBondContact O-N 2.87Å; K39-S41 PolarHBondContact O-N 3.42Å
40	A	32.8	Very low	38.8	Very low	98 Å²	98	150.7 Å²	150.7	81%	0.81	77%	0.766	S	S	*	*			trans	-69.5	74	158.4	0	0	0	0	0	108.4	S38 K42	S38-A40 PolarHBondContact O-N 2.99Å; A40-K42 PolarHBondContact O-N 2.87Å
41	S	37.6	Very low	38.7	Very low	93 Å²	93	147.1 Å²	147.1	65%	0.65	76%	0.758	S	S	*	*			trans	-78.3	106	162	58.3	0	0	0	0	106.5	K39 L43	K39-S41 PolarHBondContact O-N 3.42Å; S41-L43 VanDerWaalsContact C-N 3.33Å; S41-L43 PolarHBondContact O-N 3.45Å
42	K	37.4	Very low	39.1	Very low	194 Å²	194	146.7 Å²	146.7	84%	0.843	76%	0.762	S	S	*	*			trans	-46	100.1	165.7	-75.3	170.5	174.5	175.1	0	108.1	A40 Q44	A40-K42 PolarHBondContact O-N 2.87Å; K42-Q44 PolarHBondContact O-N 2.88Å
43	L	36.4	Very low	40.2	Very low	162 Å²	162	140.5 Å²	140.5	85%	0.848	74%	0.741	S	S	*	*			trans	-71.5	87.4	165.6	-144.4	77.8	0	0	0	104.4	S41 K45	S41-L43 VanDerWaalsContact C-N 3.33Å; S41-L43 PolarHBondContact O-N 3.45Å; L43-K45 PolarHBondContact O-N 2.97Å
44	Q	38.3	Very low	41.7	Very low	158 Å²	158	143.9 Å²	143.9	74%	0.738	75%	0.748	S	S	*	*			trans	-52.9	115	165.4	-76.6	176.5	-23.6	0	0	105.4	K42 K46	K42-Q44 PolarHBondContact O-N 2.88Å; Q44-K46 PolarHBondContact O-N 3.49Å
45	K	36.5	Very low	43.2	Very low	201 Å²	201	138 Å²	138	87%	0.874	73%	0.729	S	S	*	*			trans	-55.2	90.5	161.4	-74.2	178	175.6	179.7	0	105.6	L43 N47	L43-K45 PolarHBondContact O-N 2.97Å; K45-N47 PolarHBondContact O-N 3.17Å
46	K	39.2	Very low	45	Very low	175 Å²	175	134.8 Å²	134.8	76%	0.761	72%	0.718	S	S	*	*			trans	-65.4	94.1	161.6	-80.2	-174.4	175.6	-176.9	0	103.8	Q44 V48	Q44-K46 PolarHBondContact O-N 3.49Å; K46-V48 PolarHBondContact O-N 3.05Å
47	N	38.5	Very low	46.9	Very low	149 Å²	149	134.7 Å²	134.7	80%	0.797	72%	0.717	S	S	*	*			trans	-51.5	103.5	152.3	-102.9	-9.5	0	0	0	104.4	K45 Q49	K45-N47 PolarHBondContact O-N 3.17Å; N47-Q49 PolarHBondContact O-N 3.41Å
48	V	44.7	Very low	48.5	Very low	109 Å²	109	128.3 Å²	128.3	66%	0.661	71%	0.705	S	S	*	*			trans	-65.9	93.8	166.3	178.7	0	0	0	0	103.5	K46 I50	K46-V48 PolarHBondContact O-N 3.05Å; V48-I50 HydrophobicContact CG1-CG1 4.04Å; V48-I50 PolarHBondContact O-N 3.02Å
49	Q	47.4	Very low	50.5	Low	156 Å²	156	128.7 Å²	128.7	73%	0.729	69%	0.692	S	S	*	*			trans	-63.2	99.5	162.3	-81.2	-179.4	-17.1	0	0	104.9	N47 T51	N47-Q49 PolarHBondContact O-N 3.41Å; Q49-T51 HydrophobicContact CB-CG2 4.05Å; Q49-T51 PolarHBondContact O-N 3.38Å
50	I	51	Low	52.5	Low	67 Å²	67	123.7 Å²	123.7	34%	0.344	67%	0.672	S	S	.	*			trans	-70.6	81.1	168.9	-55.9	171.8	0	0	0	105	V48 E68	V48-I50 HydrophobicContact CG1-CG1 4.04Å; V48-I50 PolarHBondContact O-N 3.02Å; I50-E68 VanDerWaalsContact CG2-O 3.27Å; I50-E68 WeakPolarHBondContact CG2-O 3.39Å
51	T	43.6	Very low	55	Low	98 Å²	98	124.9 Å²	124.9	60%	0.601	66%	0.659	S	S	*	*			trans	-121.1	116.2	178.7	51.1	0	0	0	0	107.9	Q49	Q49-T51 HydrophobicContact CB-CG2 4.05Å; Q49-T51 PolarHBondContact O-N 3.38Å
52	D	55.4	Low	57.3	Low	161 Å²	161	121.1 Å²	121.1	86%	0.861	63%	0.632	S	S	*	*			trans	79	40.7	168.8	-55.8	-15.2	0	0	0	119.1	V54	D52-V54 PolarHBondContact O-N 3.48Å
53	T	59.1	Low	59.5	Low	70 Å²	70	117 Å²	117	43%	0.429	62%	0.62	S	S	.	*			trans	-77.6	115.7	158.6	29.6	0	0	0	0	110.5	T55 E68	T53-T55 PolarHBondContact O-N 3.29Å; T53-T55 VanDerWaalsContact O-N 3.1Å; T53-E68 PolarHBondContact OG1-O 3.23Å
54	V	64.7	Low	61.9	Low	135 Å²	135	109.7 Å²	109.7	82%	0.818	58%	0.582	S	S	*	*			trans	-62.3	108.7	179	178	0	0	0	0	109.6	D52	D52-V54 PolarHBondContact O-N 3.48Å
55	T	65.3	Low	64.1	Low	85 Å²	85	107.7 Å²	107.7	52%	0.521	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-73.4	129.4	173.8	47.9	0	0	0	0	110.9	T53 Q85	T53-T55 PolarHBondContact O-N 3.29Å; T53-T55 VanDerWaalsContact O-N 3.1Å; T55-Q85 VanDerWaalsContact CB-OE1 3.26Å
56	L	73.9	Confident	66.3	Low	105 Å²	105	98.8 Å²	98.8	55%	0.55	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-70.1	140.5	173.3	-65.8	170.3	0	0	0	109.9	G58 Q85	L56-G58 PolarHBondContact O-N 2.86Å; L56-Q85 PolarHBondContact O-NE2 3Å
57	P	73.7	Confident	68.5	Low	117 Å²	117	95 Å²	95	76%	0.76	53%	0.53	S	S	*	.	S	Bend	trans	-64.7	129.5	175.7	26.4	-32.9	0	0	0	110.6	H60	P57-H60 PolarHBondContact O-NE2 2.9Å
58	G	71.4	Confident	70.6	Confident	57 Å²	57	93.4 Å²	93.4	59%	0.588	52%	0.518	S	S	*	.	S	Bend	trans	95.5	174.1	-177.9	0	0	0	0	0	113.6	L56 H60	L56-G58 PolarHBondContact O-N 2.86Å; G58-H60 PolarHBondContact O-CD2 3.41Å
59	K	76.2	Confident	72.5	Confident	123 Å²	123	89.2 Å²	89.2	54%	0.535	49%	0.491	S	S	.	.			trans	-83.7	117.2	178.7	-66.1	-172.6	177.9	-174.3	0	109.6	S88	K59-S88 WeakPolarHBondContact CE-O 3.38Å; K59-S88 PolarHBondContact NZ-O 2.82Å
60	H	79.2	Confident	74.2	Confident	84 Å²	84	86.6 Å²	86.6	39%	0.389	48%	0.479	S	S	.	.			trans	-124.3	142.8	176	-63.2	-76.1	0	0	0	109.3	P57 G58 C62	P57-H60 PolarHBondContact O-NE2 2.9Å; G58-H60 PolarHBondContact O-CD2 3.41Å; H60-C62 PolarHBondContact O-N 3.12Å
61	F	85	Confident	76	Confident	124 Å²	124	86.7 Å²	86.7	54%	0.544	48%	0.483	S	S	.	.			trans	-57.5	129.9	171.9	178	-90	0	0	0	110	D63 S92	F61-D63 HydrophobicContact CE1-CB 4.35Å; F61-D63 WeakPolarHBondContact CE1-OD1 3.38Å; F61-D63 VanDerWaalsContact CE1-OD2 3.22Å; F61-D63 WeakPolarHBondContact CE1-OD2 3.46Å; F61-D63 WeakPolarHBondContact CZ-OD1 3.43Å; F61-S92 VanDerWaalsContact CD2-CB 3.47Å
62	C	85.7	Confident	78	Confident	13 Å²	13	83.7 Å²	83.7	9%	0.088	46%	0.464	C	S	.	.			trans	-135.6	120.6	179.4	-173.9	0	0	0	0	110.6	H60 C64 H69 R80 Q85 E86	H60-C62 PolarHBondContact O-N 3.12Å; C62-C64 VanDerWaalsContact C-N 3.28Å; C62-C64 PolarHBondContact O-N 3.05Å; C62-C64 PolarHBondContact SG-SG 3.04Å; C62-H69 PolarHBondContact SG-ND1 3.45Å; C62-R80 PolarHBondContact O-NH2 3Å; C62-Q85 HydrophobicContact CB-CB 4.16Å; C62-Q85 HydrophobicContact CB-CG 4.1Å; C62-E86 HydrophobicContact CB-CG 3.74Å; C62-E86 PolarHBondContact N-OE1 2.77Å; C62-E86 VanDerWaalsContact O-OE1 3.12Å
63	D	84.8	Confident	79.5	Confident	109 Å²	109	78.6 Å²	78.6	58%	0.583	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	13.5	179.3	-83.5	-14.7	0	0	0	113.8	F61 Q65 R80	F61-D63 HydrophobicContact CE1-CB 4.35Å; F61-D63 WeakPolarHBondContact CE1-OD1 3.38Å; F61-D63 VanDerWaalsContact CE1-OD2 3.22Å; F61-D63 WeakPolarHBondContact CE1-OD2 3.46Å; F61-D63 WeakPolarHBondContact CZ-OD1 3.43Å; D63-Q65 PolarHBondContact O-N 3.17Å; D63-R80 IonicContact OD1-CZ 3.49Å; D63-R80 IonicContact OD1-NH1 3.79Å; D63-R80 IonicContact OD1-NH2 3.04Å; D63-R80 PolarHBondContact OD1-NH2 3.36Å
64	C	87.1	Confident	81	Confident	8 Å²	8	78.8 Å²	78.8	5%	0.054	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-19.5	-177.7	76.5	0	0	0	0	114	C62 G66 T67 E68 C83	C62-C64 VanDerWaalsContact C-N 3.28Å; C62-C64 PolarHBondContact O-N 3.05Å; C62-C64 PolarHBondContact SG-SG 3.04Å; C64-G66 PolarHBondContact O-N 3.1Å; C64-T67 WeakPolarHBondContact O-CB 3.3Å; C64-T67 WeakPolarHBondContact O-CG2 3.31Å; C64-T67 PolarHBondContact O-N 3.43Å; C64-T67 PolarHBondContact O-OG1 3.1Å; C64-E68 HydrophobicContact CB-CB 3.75Å; C64-E68 HydrophobicContact CB-CG 3.97Å; C64-C83 VanDerWaalsContact SG-CB 3.59Å; C64-C83 PolarHBondContact SG-SG 2.96Å
65	Q	84.3	Confident	82.1	Confident	115 Å²	115	72.5 Å²	72.5	54%	0.537	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	32.9	-176.6	-58.1	-170.1	1.9	0	0	114.5	D63 I81	D63-Q65 PolarHBondContact O-N 3.17Å; Q65-I81 HydrophobicContact CB-CB 4.41Å
66	G	82	Confident	83.1	Confident	15 Å²	15	76.4 Å²	76.4	16%	0.155	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	7.5	-179.8	0	0	0	0	0	115.4	C64 H69	C64-G66 PolarHBondContact O-N 3.1Å; G66-H69 CarbonylContact C-O 3.38Å; G66-H69 VanDerWaalsContact CA-O 3.3Å; G66-H69 WeakPolarHBondContact CA-O 3.46Å
67	T	85.3	Confident	83.7	Confident	96 Å²	96	78 Å²	78	59%	0.589	41%	0.414	S	S	*	.	S	Bend	trans	-84.1	-38.3	178.8	58.5	0	0	0	0	113.6	C64	C64-T67 WeakPolarHBondContact O-CB 3.3Å; C64-T67 WeakPolarHBondContact O-CG2 3.31Å; C64-T67 PolarHBondContact O-N 3.43Å; C64-T67 PolarHBondContact O-OG1 3.1Å
68	E	83.3	Confident	84.4	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	39%	0.393	S	S	.	.	S	Bend	trans	-104	-30.3	-177	-61.7	179.1	164.2	0	0	113.4	I50 T53 C64	I50-E68 VanDerWaalsContact CG2-O 3.27Å; I50-E68 WeakPolarHBondContact CG2-O 3.39Å; T53-E68 PolarHBondContact OG1-O 3.23Å; C64-E68 HydrophobicContact CB-CB 3.75Å; C64-E68 HydrophobicContact CB-CG 3.97Å
69	H	83.8	Confident	85.2	Confident	21 Å²	21	74.3 Å²	74.3	10%	0.097	39%	0.39	C	S	.	.	S	Bend	trans	-120.2	147.4	177	-56.4	104.5	0	0	0	107.9	C62 G66 C83	C62-H69 PolarHBondContact SG-ND1 3.45Å; G66-H69 CarbonylContact C-O 3.38Å; G66-H69 VanDerWaalsContact CA-O 3.3Å; G66-H69 WeakPolarHBondContact CA-O 3.46Å; H69-C83 HydrophobicContact CB-CB 3.75Å
70	E	84.3	Confident	85.8	Confident	101 Å²	101	69.6 Å²	69.6	47%	0.472	37%	0.369	S	S	.	.			trans	-54.9	129.9	179	-166.8	178.8	136.1	0	0	110.4	L72 C83 K84	E70-L72 PolarHBondContact O-N 3.03Å; E70-C83 WeakPolarHBondContact O-CA 3.39Å; E70-K84 HydrophobicContact CB-CD 3.8Å; E70-K84 HydrophobicContact CB-CG 4.09Å; E70-K84 HydrophobicContact CG-CD 4.47Å; E70-K84 PolarHBondContact O-N 3.3Å; E70-K84 VanDerWaalsContact OE1-CE 3.26Å; E70-K84 WeakPolarHBondContact OE1-CE 3.49Å; E70-K84 IonicContact OE1-NZ 3.51Å; E70-K84 PolarHBondContact OE1-NZ 3.37Å; E70-K84 VanDerWaalsContact OE2-CE 3.32Å; E70-K84 WeakPolarHBondContact OE2-CE 3.32Å; E70-K84 IonicContact OE2-NZ 2.74Å; E70-K84 PolarHBondContact OE2-NZ 3.26Å
71	P	87.2	Confident	86.3	Confident	68 Å²	68	68.6 Å²	68.6	44%	0.442	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	131.2	178.1	26.2	-33.1	0	0	0	109.3	I81	P71-I81 HydrophobicContact CB-CG2 3.84Å
72	L	86.5	Confident	86.5	Confident	36 Å²	36	62.9 Å²	62.9	19%	0.188	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-67.8	178.1	-169	140	0	0	0	109.2	E70 T82 V98 T100	E70-L72 PolarHBondContact O-N 3.03Å; L72-T82 WeakPolarHBondContact CA-O 3.5Å; L72-T82 WeakPolarHBondContact CB-O 3.47Å; L72-T82 PolarHBondContact N-O 3.47Å; L72-V98 HydrophobicContact CD2-CG1 4.39Å; L72-T100 HydrophobicContact CD1-CG2 4.21Å; L72-T100 HydrophobicContact CD2-CG2 3.97Å; L72-T100 HydrophobicContact CG-CG2 4.04Å
73	M	86.7	Confident	86.7	Confident	53 Å²	53	62.2 Å²	62.2	26%	0.261	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	161	174.3	-77	-59.5	-81.5	0	0	110.4	T82 V98 C99 L101	M73-T82 PolarHBondContact N-O 2.66Å; M73-T82 PolarHBondContact O-N 3.34Å; M73-V98 HydrophobicContact CB-CG1 3.75Å; M73-C99 VanDerWaalsContact CG-O 3.23Å; M73-C99 WeakPolarHBondContact CG-O 3.32Å; M73-L101 HydrophobicContact CE-CD2 3.93Å; M73-L101 HydrophobicContact CE-CG 4.44Å; M73-L101 HydrophobicContact SD-CD2 4.49Å; M73-L101 HydrophobicContact SD-CG 4.37Å
74	N	89.8	Confident	86.8	Confident	75 Å²	75	62.4 Å²	62.4	40%	0.401	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	140.5	168.8	64.1	-43.2	0	0	0	110.9	M76	N74-M76 PolarHBondContact ND2-SD 3.39Å; N74-M76 VanDerWaalsContact ND2-SD 3.4Å; N74-M76 PolarHBondContact O-N 2.91Å
75	C	89	Confident	86.8	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.02	33%	0.332	C	S	.	.			trans	-70.9	118.2	168.2	-176.7	0	0	0	0	109.5	H77 C78 G79 R80 C91 C94 V98	C75-H77 PolarHBondContact O-N 3.16Å; C75-H77 VanDerWaalsContact O-N 3.11Å; C75-C78 VanDerWaalsContact SG-SG 3.69Å; C75-G79 WeakPolarHBondContact O-CA 3.3Å; C75-G79 PolarHBondContact O-N 2.82Å; C75-R80 WeakPolarHBondContact CB-O 3.35Å; C75-R80 PolarHBondContact N-O 2.96Å; C75-C91 HydrophobicContact CB-CB 4.34Å; C75-C94 PolarHBondContact SG-SG 3.05Å; C75-V98 HydrophobicContact CB-CG2 3.85Å
76	M	86.2	Confident	86.9	Confident	167 Å²	167	58 Å²	58	82%	0.823	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.7	-178.2	-63.1	-60.2	-71.3	0	0	114.3	N74	N74-M76 PolarHBondContact ND2-SD 3.39Å; N74-M76 VanDerWaalsContact ND2-SD 3.4Å; N74-M76 PolarHBondContact O-N 2.91Å
77	H	86	Confident	87.1	Confident	138 Å²	138	58.1 Å²	58.1	64%	0.639	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-43.2	180	-171.5	73.2	0	0	0	113.9	C75 N96	C75-H77 PolarHBondContact O-N 3.16Å; C75-H77 VanDerWaalsContact O-N 3.11Å; H77-N96 HydrophobicContact CB-CB 4.19Å; H77-N96 WeakPolarHBondContact CB-ND2 3.28Å; H77-N96 PolarHBondContact CD2-ND2 2.58Å; H77-N96 PolarHBondContact ND1-ND2 3.46Å
78	C	89.8	Confident	87.3	Confident	45 Å²	45	54.1 Å²	54.1	30%	0.304	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-5.7	178.8	69.8	0	0	0	0	114.4	C75 R80 C91 F93 C94	C75-C78 VanDerWaalsContact SG-SG 3.69Å; C78-R80 PolarHBondContact O-N 3.43Å; C78-C91 VanDerWaalsContact SG-SG 3.64Å; C78-F93 HydrophobicContact CB-CD1 3.69Å; C78-F93 HydrophobicContact CB-CE1 4.14Å; C78-C94 HydrophobicContact CB-CB 4.05Å
79	G	88.3	Confident	87.5	Confident	51 Å²	51	48.9 Å²	48.9	53%	0.526	27%	0.265	S	S	.	.			trans	76.1	-3.5	-180	0	0	0	0	0	115.6	C75 I81	C75-G79 WeakPolarHBondContact O-CA 3.3Å; C75-G79 PolarHBondContact O-N 2.82Å; G79-I81 PolarHBondContact O-N 2.9Å
80	R	88.7	Confident	87.7	Confident	25 Å²	25	50.8 Å²	50.8	9%	0.094	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-64.7	132.9	178.3	-178.5	-178.9	172.3	154.2	12.4	111	C62 D63 C75 C78 E86 S92	C62-R80 PolarHBondContact O-NH2 3Å; D63-R80 IonicContact OD1-CZ 3.49Å; D63-R80 IonicContact OD1-NH1 3.79Å; D63-R80 IonicContact OD1-NH2 3.04Å; D63-R80 PolarHBondContact OD1-NH2 3.36Å; C75-R80 WeakPolarHBondContact CB-O 3.35Å; C75-R80 PolarHBondContact N-O 2.96Å; C78-R80 PolarHBondContact O-N 3.43Å; R80-E86 IonicContact CZ-OE1 2.68Å; R80-E86 IonicContact NE-OE1 3.31Å; R80-E86 IonicContact NH2-OE1 3.04Å; R80-E86 PolarHBondContact NH2-OE1 3.47Å; R80-S92 PolarHBondContact NE-OG 3.46Å; R80-S92 PolarHBondContact NH1-OG 2.96Å
81	I	89.6	Confident	87.9	Confident	62 Å²	62	46.3 Å²	46.3	32%	0.318	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	117.9	174.5	-58.9	169.4	0	0	0	109.3	Q65 P71 G79	Q65-I81 HydrophobicContact CB-CB 4.41Å; P71-I81 HydrophobicContact CB-CG2 3.84Å; G79-I81 PolarHBondContact O-N 2.9Å
82	T	88.3	Confident	87.8	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.025	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136.9	173.5	-64.2	0	0	0	0	108.9	L72 M73 E86	L72-T82 WeakPolarHBondContact CA-O 3.5Å; L72-T82 WeakPolarHBondContact CB-O 3.47Å; L72-T82 PolarHBondContact N-O 3.47Å; M73-T82 PolarHBondContact N-O 2.66Å; M73-T82 PolarHBondContact O-N 3.34Å; T82-E86 VanDerWaalsContact CA-OE2 3.28Å; T82-E86 WeakPolarHBondContact CA-OE2 3.38Å; T82-E86 HydrophobicContact CG2-CB 3.67Å; T82-E86 HydrophobicContact CG2-CG 4.5Å; T82-E86 WeakPolarHBondContact CG2-OE2 3.41Å; T82-E86 PolarHBondContact OG1-OE2 3.2Å
83	C	89.4	Confident	87.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	171	-178.9	71.8	0	0	0	0	112	C64 H69 E70 Q85 E86 G87	C64-C83 VanDerWaalsContact SG-CB 3.59Å; C64-C83 PolarHBondContact SG-SG 2.96Å; H69-C83 HydrophobicContact CB-CB 3.75Å; E70-C83 WeakPolarHBondContact O-CA 3.39Å; C83-Q85 PolarHBondContact O-N 3.05Å; C83-Q85 VanDerWaalsContact O-N 3.14Å; C83-E86 PolarHBondContact O-N 3.35Å; C83-E86 VanDerWaalsContact O-N 3.07Å; C83-G87 PolarHBondContact O-N 3.24Å; C83-G87 VanDerWaalsContact O-N 3.09Å
84	K	87.9	Confident	87.9	Confident	112 Å²	112	50.8 Å²	50.8	49%	0.487	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.4	177.8	-76.7	-170.5	-179.7	173.8	0	114.5	E70 G87	E70-K84 HydrophobicContact CB-CD 3.8Å; E70-K84 HydrophobicContact CB-CG 4.09Å; E70-K84 HydrophobicContact CG-CD 4.47Å; E70-K84 PolarHBondContact O-N 3.3Å; E70-K84 VanDerWaalsContact OE1-CE 3.26Å; E70-K84 WeakPolarHBondContact OE1-CE 3.49Å; E70-K84 IonicContact OE1-NZ 3.51Å; E70-K84 PolarHBondContact OE1-NZ 3.37Å; E70-K84 VanDerWaalsContact OE2-CE 3.32Å; E70-K84 WeakPolarHBondContact OE2-CE 3.32Å; E70-K84 IonicContact OE2-NZ 2.74Å; E70-K84 PolarHBondContact OE2-NZ 3.26Å; K84-G87 PolarHBondContact O-N 3.28Å
85	Q	85.7	Confident	87.6	Confident	14 Å²	14	49 Å²	49	7%	0.065	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-33.9	177.2	-178.1	58.9	47.9	0	0	113.3	T55 L56 C62 C83	T55-Q85 VanDerWaalsContact CB-OE1 3.26Å; L56-Q85 PolarHBondContact O-NE2 3Å; C62-Q85 HydrophobicContact CB-CB 4.16Å; C62-Q85 HydrophobicContact CB-CG 4.1Å; C83-Q85 PolarHBondContact O-N 3.05Å; C83-Q85 VanDerWaalsContact O-N 3.14Å
86	E	87.3	Confident	87.4	Confident	16 Å²	16	52.3 Å²	52.3	8%	0.075	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-36.7	174.9	-62.3	-169	133.5	0	0	110.6	C62 R80 T82 C83 S92	C62-E86 HydrophobicContact CB-CG 3.74Å; C62-E86 PolarHBondContact N-OE1 2.77Å; C62-E86 VanDerWaalsContact O-OE1 3.12Å; R80-E86 IonicContact CZ-OE1 2.68Å; R80-E86 IonicContact NE-OE1 3.31Å; R80-E86 IonicContact NH2-OE1 3.04Å; R80-E86 PolarHBondContact NH2-OE1 3.47Å; T82-E86 VanDerWaalsContact CA-OE2 3.28Å; T82-E86 WeakPolarHBondContact CA-OE2 3.38Å; T82-E86 HydrophobicContact CG2-CB 3.67Å; T82-E86 HydrophobicContact CG2-CG 4.5Å; T82-E86 WeakPolarHBondContact CG2-OE2 3.41Å; T82-E86 PolarHBondContact OG1-OE2 3.2Å; C83-E86 PolarHBondContact O-N 3.35Å; C83-E86 VanDerWaalsContact O-N 3.07Å; E86-S92 PolarHBondContact OE1-OG 3.21Å
87	G	86.6	Confident	87.5	Confident	18 Å²	18	47 Å²	47	19%	0.186	27%	0.272	C	S	.	.			trans	69.8	175.2	-178.5	0	0	0	0	0	113.4	C83 K84	C83-G87 PolarHBondContact O-N 3.24Å; C83-G87 VanDerWaalsContact O-N 3.09Å; K84-G87 PolarHBondContact O-N 3.28Å
88	S	88.2	Confident	87.7	Confident	13 Å²	13	40.7 Å²	40.7	9%	0.091	24%	0.243	C	C	.	.	S	Bend	trans	-67.6	132.4	176.8	-55.2	0	0	0	0	111.8	K59 V98 E103	K59-S88 WeakPolarHBondContact CE-O 3.38Å; K59-S88 PolarHBondContact NZ-O 2.82Å; S88-V98 CarbonylContact C-O 3.47Å; S88-V98 VanDerWaalsContact CA-O 3.31Å; S88-V98 WeakPolarHBondContact CA-O 3.31Å; S88-E103 WeakPolarHBondContact CB-OE2 3.24Å; S88-E103 PolarHBondContact OG-OE1 3.47Å; S88-E103 PolarHBondContact OG-OE2 2.83Å
89	G	87.5	Confident	87.6	Confident	5 Å²	5	39.2 Å²	39.2	5%	0.052	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.1	-169.8	-176.3	0	0	0	0	0	112.7	C91 V98	G89-C91 PolarHBondContact O-N 3.21Å; G89-V98 PolarHBondContact N-O 2.87Å; G89-V98 PolarHBondContact O-N 2.71Å
90	P	88.8	Confident	87.6	Confident	61 Å²	61	38.7 Å²	38.7	40%	0.396	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	130.9	174.3	26.9	-34.3	0	0	0	110.1	S92 G95 L121	P90-S92 PolarHBondContact O-N 3.22Å; P90-G95 VanDerWaalsContact CB-O 3.28Å; P90-G95 WeakPolarHBondContact CB-O 3.36Å; P90-L121 VanDerWaalsContact CD-O 3.3Å; P90-L121 WeakPolarHBondContact CD-O 3.41Å
91	C	88.9	Confident	87.5	Confident	6 Å²	6	43.2 Å²	43.2	4%	0.041	25%	0.245	C	C	.	.			trans	-54.3	129.9	176.6	178.3	0	0	0	0	109.7	C75 C78 G89 F93 G95 N96 V98	C75-C91 HydrophobicContact CB-CB 4.34Å; C78-C91 VanDerWaalsContact SG-SG 3.64Å; G89-C91 PolarHBondContact O-N 3.21Å; C91-F93 PolarHBondContact O-N 3.22Å; C91-F93 PolarHBondContact SG-N 3.18Å; C91-G95 VanDerWaalsContact O-CA 3.26Å; C91-G95 WeakPolarHBondContact O-CA 3.37Å; C91-G95 PolarHBondContact O-N 2.83Å; C91-N96 VanDerWaalsContact CB-O 3.24Å; C91-N96 WeakPolarHBondContact CB-O 3.16Å; C91-N96 PolarHBondContact N-O 3.01Å; C91-V98 HydrophobicContact CB-CG2 4.1Å
92	S	85.5	Confident	87.3	Confident	52 Å²	52	47.7 Å²	47.7	36%	0.364	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.1	177.8	40.8	0	0	0	0	114.3	F61 R80 E86 P90	F61-S92 VanDerWaalsContact CD2-CB 3.47Å; R80-S92 PolarHBondContact NE-OG 3.46Å; R80-S92 PolarHBondContact NH1-OG 2.96Å; E86-S92 PolarHBondContact OE1-OG 3.21Å; P90-S92 PolarHBondContact O-N 3.22Å
93	F	85.7	Confident	87.3	Confident	156 Å²	156	49.5 Å²	49.5	68%	0.684	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-52.2	179.5	-174.8	-100.3	0	0	0	113.4	C78 C91	C78-F93 HydrophobicContact CB-CD1 3.69Å; C78-F93 HydrophobicContact CB-CE1 4.14Å; C91-F93 PolarHBondContact O-N 3.22Å; C91-F93 PolarHBondContact SG-N 3.18Å
94	C	88	Confident	87	Confident	43 Å²	43	52.7 Å²	52.7	29%	0.291	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-5.2	-172.6	67.7	0	0	0	0	115	C75 C78 N96	C75-C94 PolarHBondContact SG-SG 3.05Å; C78-C94 HydrophobicContact CB-CB 4.05Å; C94-N96 PolarHBondContact O-N 3.4Å
95	G	83.6	Confident	86.9	Confident	39 Å²	39	50.2 Å²	50.2	40%	0.402	29%	0.288	S	S	.	.			trans	78.2	-6.6	-178.6	0	0	0	0	0	115.6	P90 C91	P90-G95 VanDerWaalsContact CB-O 3.28Å; P90-G95 WeakPolarHBondContact CB-O 3.36Å; C91-G95 VanDerWaalsContact O-CA 3.26Å; C91-G95 WeakPolarHBondContact O-CA 3.37Å; C91-G95 PolarHBondContact O-N 2.83Å
96	N	85.2	Confident	86.8	Confident	71 Å²	71	53.4 Å²	53.4	38%	0.38	31%	0.305	S	S	.	.			trans	-71.2	140.7	178.8	-83.2	-10.3	0	0	0	112.7	H77 C91 C94 V98	H77-N96 HydrophobicContact CB-CB 4.19Å; H77-N96 WeakPolarHBondContact CB-ND2 3.28Å; H77-N96 PolarHBondContact CD2-ND2 2.58Å; H77-N96 PolarHBondContact ND1-ND2 3.46Å; C91-N96 VanDerWaalsContact CB-O 3.24Å; C91-N96 WeakPolarHBondContact CB-O 3.16Å; C91-N96 PolarHBondContact N-O 3.01Å; C94-N96 PolarHBondContact O-N 3.4Å; N96-V98 PolarHBondContact O-N 2.85Å
97	L	88.1	Confident	86.6	Confident	56 Å²	56	54.6 Å²	54.6	29%	0.293	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	124.7	-175.2	-173.3	68.8	0	0	0	111.4	C99 L107 M118 L121 N122	L97-C99 VanDerWaalsContact CG-SG 3.59Å; L97-L107 HydrophobicContact CD2-CD1 3.97Å; L97-M118 HydrophobicContact CD2-CE 3.94Å; L97-M118 HydrophobicContact CD2-SD 3.72Å; L97-L121 HydrophobicContact CD1-CB 3.88Å; L97-N122 HydrophobicContact CD1-CB 4.49Å
98	V	89.6	Confident	86.4	Confident	6 Å²	6	61.1 Å²	61.1	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.4	171.7	-175.4	0	0	0	0	107.7	L72 M73 C75 S88 G89 C91 N96	L72-V98 HydrophobicContact CD2-CG1 4.39Å; M73-V98 HydrophobicContact CB-CG1 3.75Å; C75-V98 HydrophobicContact CB-CG2 3.85Å; S88-V98 CarbonylContact C-O 3.47Å; S88-V98 VanDerWaalsContact CA-O 3.31Å; S88-V98 WeakPolarHBondContact CA-O 3.31Å; G89-V98 PolarHBondContact N-O 2.87Å; G89-V98 PolarHBondContact O-N 2.71Å; C91-V98 HydrophobicContact CB-CG2 4.1Å; N96-V98 PolarHBondContact O-N 2.85Å
99	C	88.3	Confident	86.1	Confident	13 Å²	13	71.4 Å²	71.4	9%	0.088	37%	0.372	C	S	.	.			trans	-123.5	157.9	-177.5	-70.1	0	0	0	0	109.9	M73 L97 E103 E104 L107	M73-C99 VanDerWaalsContact CG-O 3.23Å; M73-C99 WeakPolarHBondContact CG-O 3.32Å; L97-C99 VanDerWaalsContact CG-SG 3.59Å; C99-E103 HydrophobicContact CB-CB 3.89Å; C99-E104 HydrophobicContact CB-CB 4.37Å; C99-L107 HydrophobicContact CB-CD1 4.48Å; C99-L107 VanDerWaalsContact SG-CD1 3.51Å
100	T	89.1	Confident	85.4	Confident	40 Å²	40	73.1 Å²	73.1	25%	0.245	39%	0.389	C	S	.	.			trans	-69.6	162.5	164.8	65.1	0	0	0	0	110.5	L72 E102 E103 E104	L72-T100 HydrophobicContact CD1-CG2 4.21Å; L72-T100 HydrophobicContact CD2-CG2 3.97Å; L72-T100 HydrophobicContact CG-CG2 4.04Å; T100-E102 PolarHBondContact O-N 3.1Å; T100-E103 PolarHBondContact N-OE2 2.92Å; T100-E103 PolarHBondContact O-N 3.11Å; T100-E103 VanDerWaalsContact OG1-CG 3.3Å; T100-E103 WeakPolarHBondContact OG1-CG 3.33Å; T100-E103 PolarHBondContact OG1-N 2.82Å; T100-E103 PolarHBondContact OG1-OE2 3.27Å; T100-E104 WeakPolarHBondContact O-CB 3.3Å; T100-E104 PolarHBondContact O-N 3.39Å
101	L	86.1	Confident	85.1	Confident	121 Å²	121	73 Å²	73	63%	0.634	40%	0.399	S	S	*	.	H	α-helix	trans	-56.5	-34.5	175.8	-67.1	173.3	0	0	0	112.6	M73 A105	M73-L101 HydrophobicContact CE-CD2 3.93Å; M73-L101 HydrophobicContact CE-CG 4.44Å; M73-L101 HydrophobicContact SD-CD2 4.49Å; M73-L101 HydrophobicContact SD-CG 4.37Å; L101-A105 WeakPolarHBondContact O-CB 3.26Å; L101-A105 PolarHBondContact O-N 3.45Å
102	E	86.1	Confident	84.6	Confident	156 Å²	156	80.1 Å²	80.1	73%	0.729	43%	0.432	S	S	*	.	H	α-helix	trans	-69.8	-45.9	177.2	-63.6	179.7	178.5	0	0	111.8	T100 E104 A105 I106	T100-E102 PolarHBondContact O-N 3.1Å; E102-E104 VanDerWaalsContact C-N 3.35Å; E102-A105 PolarHBondContact O-N 3.31Å; E102-I106 WeakPolarHBondContact O-CG1 3.48Å; E102-I106 PolarHBondContact O-N 3.27Å; E102-I106 VanDerWaalsContact O-N 3.1Å
103	E	87.2	Confident	84.3	Confident	41 Å²	41	79.9 Å²	79.9	19%	0.192	44%	0.437	C	S	.	.	H	α-helix	trans	-65.2	-39.8	176.1	-72.1	172.9	155.3	0	0	111.6	S88 C99 T100 A105 I106 L107 L117	S88-E103 WeakPolarHBondContact CB-OE2 3.24Å; S88-E103 PolarHBondContact OG-OE1 3.47Å; S88-E103 PolarHBondContact OG-OE2 2.83Å; C99-E103 HydrophobicContact CB-CB 3.89Å; T100-E103 PolarHBondContact N-OE2 2.92Å; T100-E103 PolarHBondContact O-N 3.11Å; T100-E103 VanDerWaalsContact OG1-CG 3.3Å; T100-E103 WeakPolarHBondContact OG1-CG 3.33Å; T100-E103 PolarHBondContact OG1-N 2.82Å; T100-E103 PolarHBondContact OG1-OE2 3.27Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 3.07Å; E103-I106 PolarHBondContact O-N 3.25Å; E103-L107 WeakPolarHBondContact O-CG 3.34Å; E103-L107 PolarHBondContact O-N 3.38Å; E103-L117 HydrophobicContact CB-CD2 4.01Å; E103-L117 HydrophobicContact CG-CD1 4.43Å; E103-L117 HydrophobicContact CG-CD2 4.16Å
104	E	84.5	Confident	84.1	Confident	68 Å²	68	72.9 Å²	72.9	32%	0.318	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-38.8	175.7	-165.1	-171.4	167.5	0	0	111.2	C99 T100 E102 L107 K108	C99-E104 HydrophobicContact CB-CB 4.37Å; T100-E104 WeakPolarHBondContact O-CB 3.3Å; T100-E104 PolarHBondContact O-N 3.39Å; E102-E104 VanDerWaalsContact C-N 3.35Å; E104-L107 PolarHBondContact O-N 2.57Å; E104-K108 HydrophobicContact CG-CD 4.3Å; E104-K108 WeakPolarHBondContact O-CB 3.3Å; E104-K108 VanDerWaalsContact O-CG 3.31Å; E104-K108 WeakPolarHBondContact O-CG 3.24Å; E104-K108 PolarHBondContact O-N 3.31Å; E104-K108 WeakPolarHBondContact OE1-CE 3.2Å; E104-K108 IonicContact OE1-NZ 2.66Å; E104-K108 PolarHBondContact OE1-NZ 3.42Å
105	A	84.7	Confident	83.6	Confident	60 Å²	60	75.9 Å²	75.9	50%	0.496	42%	0.416	S	S	.	.	H	α-helix	trans	-64.5	-39.2	174.5	0	0	0	0	0	112.3	L101 E102 E103 K108 R109	L101-A105 WeakPolarHBondContact O-CB 3.26Å; L101-A105 PolarHBondContact O-N 3.45Å; E102-A105 PolarHBondContact O-N 3.31Å; E103-A105 VanDerWaalsContact C-N 3.32Å; E103-A105 PolarHBondContact O-N 3.07Å; A105-K108 PolarHBondContact O-N 3.34Å; A105-R109 PolarHBondContact O-N 3.29Å
106	I	84.6	Confident	83.5	Confident	81 Å²	81	78.3 Å²	78.3	42%	0.415	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-44.3	174.6	-64.6	164.3	0	0	0	110.3	E102 E103 K108 R109 G110 A114 L117	E102-I106 WeakPolarHBondContact O-CG1 3.48Å; E102-I106 PolarHBondContact O-N 3.27Å; E102-I106 VanDerWaalsContact O-N 3.1Å; E103-I106 PolarHBondContact O-N 3.25Å; I106-K108 PolarHBondContact O-N 3.43Å; I106-R109 PolarHBondContact O-N 3.41Å; I106-G110 PolarHBondContact O-N 3.1Å; I106-A114 WeakPolarHBondContact O-CB 3.28Å; I106-L117 HydrophobicContact CB-CD2 3.88Å; I106-L117 HydrophobicContact CD1-CD2 4.23Å; I106-L117 HydrophobicContact CG2-CD2 3.78Å
107	L	81.8	Confident	83.4	Confident	40 Å²	40	76.2 Å²	76.2	21%	0.209	41%	0.408	C	S	.	.	H	α-helix	trans	-62.8	-40.3	177.3	-72.2	171.6	0	0	0	112.2	L97 C99 E103 E104 G110 L117 M118	L97-L107 HydrophobicContact CD2-CD1 3.97Å; C99-L107 HydrophobicContact CB-CD1 4.48Å; C99-L107 VanDerWaalsContact SG-CD1 3.51Å; E103-L107 WeakPolarHBondContact O-CG 3.34Å; E103-L107 PolarHBondContact O-N 3.38Å; E104-L107 PolarHBondContact O-N 2.57Å; L107-G110 PolarHBondContact O-N 3.31Å; L107-L117 HydrophobicContact CG-CD2 4.26Å; L107-M118 HydrophobicContact CD1-CE 4.47Å; L107-M118 HydrophobicContact CD2-CB 4.04Å; L107-M118 HydrophobicContact CD2-CE 3.77Å; L107-M118 HydrophobicContact CD2-SD 4.48Å
108	K	82.6	Confident	83.1	Confident	156 Å²	156	76.2 Å²	76.2	68%	0.678	41%	0.408	S	S	*	.	H	α-helix	trans	-67.8	-35.2	177.2	-78.5	171.6	174.8	166.2	0	113.5	E104 A105 I106 G110	E104-K108 HydrophobicContact CG-CD 4.3Å; E104-K108 WeakPolarHBondContact O-CB 3.3Å; E104-K108 VanDerWaalsContact O-CG 3.31Å; E104-K108 WeakPolarHBondContact O-CG 3.24Å; E104-K108 PolarHBondContact O-N 3.31Å; E104-K108 WeakPolarHBondContact OE1-CE 3.2Å; E104-K108 IonicContact OE1-NZ 2.66Å; E104-K108 PolarHBondContact OE1-NZ 3.42Å; A105-K108 PolarHBondContact O-N 3.34Å; I106-K108 PolarHBondContact O-N 3.43Å; K108-G110 VanDerWaalsContact C-N 3.26Å; K108-G110 PolarHBondContact O-N 3.47Å
109	R	82	Confident	82.7	Confident	229 Å²	229	82.6 Å²	82.6	86%	0.864	44%	0.435	S	S	*	.	H	α-helix	trans	-68.4	-26.4	179.6	-175.7	177.4	-82.3	-167.7	-3.7	112.4	A105 I106	A105-R109 PolarHBondContact O-N 3.29Å; I106-R109 PolarHBondContact O-N 3.41Å
110	G	73.8	Confident	82.5	Confident	40 Å²	40	89.9 Å²	89.9	41%	0.412	47%	0.465	S	S	.	.			trans	70.5	-177	-174.5	0	0	0	0	0	113.1	I106 L107 K108	I106-G110 PolarHBondContact O-N 3.1Å; L107-G110 PolarHBondContact O-N 3.31Å; K108-G110 VanDerWaalsContact C-N 3.26Å; K108-G110 PolarHBondContact O-N 3.47Å
111	G	82	Confident	82.2	Confident	58 Å²	58	88.6 Å²	88.6	60%	0.598	46%	0.456	S	S	*	.	S	Bend	trans	100	-176.6	-177.7	0	0	0	0	0	114.3	G113 A114 F115	G111-G113 VanDerWaalsContact C-N 3.31Å; G111-G113 PolarHBondContact O-N 3.49Å; G111-A114 WeakPolarHBondContact O-CB 3.29Å; G111-A114 PolarHBondContact O-N 3.27Å; G111-A114 VanDerWaalsContact O-N 3.15Å; G111-F115 PolarHBondContact O-N 2.89Å; G111-F115 VanDerWaalsContact O-N 3.12Å
112	E	78.9	Confident	81.8	Confident	157 Å²	157	84.6 Å²	84.6	73%	0.734	44%	0.436	S	S	*	.	H	α-helix	trans	-63.3	-36.6	-175.4	-168.1	175.5	-178	0	0	112.5	A114 F115 L116	E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 2.88Å; E112-F115 PolarHBondContact O-N 3.44Å; E112-L116 HydrophobicContact CG-CD1 4.39Å; E112-L116 WeakPolarHBondContact O-CG 3.23Å; E112-L116 PolarHBondContact O-N 3.07Å
113	G	79.5	Confident	81	Confident	46 Å²	46	82.4 Å²	82.4	47%	0.474	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-38.7	174.1	0	0	0	0	0	113.2	G111 L117	G111-G113 VanDerWaalsContact C-N 3.31Å; G111-G113 PolarHBondContact O-N 3.49Å; G113-L117 VanDerWaalsContact O-CB 3.3Å; G113-L117 WeakPolarHBondContact O-CB 2.94Å; G113-L117 PolarHBondContact O-N 3.14Å
114	A	80.3	Confident	79.8	Confident	10 Å²	10	84.3 Å²	84.3	8%	0.083	46%	0.458	C	S	.	.	H	α-helix	trans	-67.9	-40.2	175.7	0	0	0	0	0	111.5	I106 G111 E112 L117 M118	I106-A114 WeakPolarHBondContact O-CB 3.28Å; G111-A114 WeakPolarHBondContact O-CB 3.29Å; G111-A114 PolarHBondContact O-N 3.27Å; G111-A114 VanDerWaalsContact O-N 3.15Å; E112-A114 VanDerWaalsContact C-N 3.34Å; E112-A114 PolarHBondContact O-N 2.88Å; A114-L117 PolarHBondContact O-N 3.38Å; A114-M118 VanDerWaalsContact O-CB 3.31Å; A114-M118 WeakPolarHBondContact O-CB 3.31Å; A114-M118 PolarHBondContact O-N 2.81Å
115	F	77.2	Confident	78.5	Confident	106 Å²	106	83.5 Å²	83.5	47%	0.465	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-46	176.3	-178.7	-102.9	0	0	0	112.2	G111 E112 M118 K119 L128	G111-F115 PolarHBondContact O-N 2.89Å; G111-F115 VanDerWaalsContact O-N 3.12Å; E112-F115 PolarHBondContact O-N 3.44Å; F115-M118 PolarHBondContact O-N 3.44Å; F115-K119 WeakPolarHBondContact O-CB 3.2Å; F115-K119 PolarHBondContact O-N 3.09Å; F115-L128 HydrophobicContact CD2-CD1 3.84Å; F115-L128 HydrophobicContact CE2-CD1 3.7Å; F115-L128 HydrophobicContact CE2-CG 4.49Å
116	L	83.1	Confident	77.2	Confident	89 Å²	89	90.4 Å²	90.4	47%	0.466	48%	0.481	S	S	.	.	H	α-helix	trans	-63.7	-40.9	176.7	-72.4	171.2	0	0	0	112	E112 K119 K120	E112-L116 HydrophobicContact CG-CD1 4.39Å; E112-L116 WeakPolarHBondContact O-CG 3.23Å; E112-L116 PolarHBondContact O-N 3.07Å; L116-K119 PolarHBondContact O-N 3.19Å; L116-K120 WeakPolarHBondContact O-CG 3.49Å; L116-K120 PolarHBondContact O-N 2.74Å
117	L	82.9	Confident	75.8	Confident	28 Å²	28	92.2 Å²	92.2	15%	0.147	50%	0.496	C	S	.	.	H	α-helix	trans	-66.2	-46.1	177.1	-176.1	61.9	0	0	0	111.3	E103 I106 L107 G113 A114 K119 K120 L121	E103-L117 HydrophobicContact CB-CD2 4.01Å; E103-L117 HydrophobicContact CG-CD1 4.43Å; E103-L117 HydrophobicContact CG-CD2 4.16Å; I106-L117 HydrophobicContact CB-CD2 3.88Å; I106-L117 HydrophobicContact CD1-CD2 4.23Å; I106-L117 HydrophobicContact CG2-CD2 3.78Å; L107-L117 HydrophobicContact CG-CD2 4.26Å; G113-L117 VanDerWaalsContact O-CB 3.3Å; G113-L117 WeakPolarHBondContact O-CB 2.94Å; G113-L117 PolarHBondContact O-N 3.14Å; A114-L117 PolarHBondContact O-N 3.38Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 2.87Å; L117-K120 WeakPolarHBondContact O-CB 3.46Å; L117-K120 PolarHBondContact O-N 3.26Å; L117-K120 VanDerWaalsContact O-N 3.12Å; L117-L121 HydrophobicContact CD1-CD1 3.9Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CD2-CD1 4.45Å; L117-L121 HydrophobicContact CG-CD1 3.79Å; L117-L121 HydrophobicContact CG-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 VanDerWaalsContact O-CG 3.32Å; L117-L121 WeakPolarHBondContact O-CG 2.99Å; L117-L121 PolarHBondContact O-N 2.89Å
118	M	80.8	Confident	74.6	Confident	56 Å²	56	95 Å²	95	28%	0.276	51%	0.511	S	S	.	.	H	α-helix	trans	-58.3	-43.5	175.7	-174.7	62.6	83.4	0	0	111.5	L97 L107 A114 F115 K120 L121 N122	L97-M118 HydrophobicContact CD2-CE 3.94Å; L97-M118 HydrophobicContact CD2-SD 3.72Å; L107-M118 HydrophobicContact CD1-CE 4.47Å; L107-M118 HydrophobicContact CD2-CB 4.04Å; L107-M118 HydrophobicContact CD2-CE 3.77Å; L107-M118 HydrophobicContact CD2-SD 4.48Å; A114-M118 VanDerWaalsContact O-CB 3.31Å; A114-M118 WeakPolarHBondContact O-CB 3.31Å; A114-M118 PolarHBondContact O-N 2.81Å; F115-M118 PolarHBondContact O-N 3.44Å; M118-K120 VanDerWaalsContact C-N 3.31Å; M118-K120 PolarHBondContact O-N 3.41Å; M118-L121 PolarHBondContact O-N 3Å; M118-N122 PolarHBondContact O-N 3.04Å
119	K	81.2	Confident	73.3	Confident	140 Å²	140	92.1 Å²	92.1	61%	0.609	51%	0.508	S	S	*	.	H	α-helix	trans	-63.9	-34.4	176.9	-170.6	176.5	-178.9	179	0	112.8	F115 L116 L117	F115-K119 WeakPolarHBondContact O-CB 3.2Å; F115-K119 PolarHBondContact O-N 3.09Å; L116-K119 PolarHBondContact O-N 3.19Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 2.87Å
120	K	84.5	Confident	72.1	Confident	165 Å²	165	85.2 Å²	85.2	72%	0.717	49%	0.492	S	S	*	.	H	α-helix	trans	-71.2	-41.7	174.3	-76.1	178.1	-178.2	-178.1	0	112.3	L116 L117 M118	L116-K120 WeakPolarHBondContact O-CG 3.49Å; L116-K120 PolarHBondContact O-N 2.74Å; L117-K120 WeakPolarHBondContact O-CB 3.46Å; L117-K120 PolarHBondContact O-N 3.26Å; L117-K120 VanDerWaalsContact O-N 3.12Å; M118-K120 VanDerWaalsContact C-N 3.31Å; M118-K120 PolarHBondContact O-N 3.41Å
121	L	82.5	Confident	71.5	Confident	13 Å²	13	90.2 Å²	90.2	7%	0.068	51%	0.507	C	S	.	.	H	α-helix	trans	-80.8	-33.9	-173.8	-65.8	176.6	0	0	0	112.8	P90 L97 L117 M118	P90-L121 VanDerWaalsContact CD-O 3.3Å; P90-L121 WeakPolarHBondContact CD-O 3.41Å; L97-L121 HydrophobicContact CD1-CB 3.88Å; L117-L121 HydrophobicContact CD1-CD1 3.9Å; L117-L121 HydrophobicContact CD1-CG 4.05Å; L117-L121 HydrophobicContact CD2-CD1 4.45Å; L117-L121 HydrophobicContact CG-CD1 3.79Å; L117-L121 HydrophobicContact CG-CG 4.3Å; L117-L121 WeakPolarHBondContact O-CB 3.31Å; L117-L121 VanDerWaalsContact O-CG 3.32Å; L117-L121 WeakPolarHBondContact O-CG 2.99Å; L117-L121 PolarHBondContact O-N 2.89Å; M118-L121 PolarHBondContact O-N 3Å
122	N	78.1	Confident	70.5	Confident	38 Å²	38	90.3 Å²	90.3	20%	0.203	50%	0.502	C	S	.	.			trans	-131.9	74.7	-179.8	-165	-2.1	0	0	0	111.8	L97 M118 A124 A125	L97-N122 HydrophobicContact CD1-CB 4.49Å; M118-N122 PolarHBondContact O-N 3.04Å; N122-A124 PolarHBondContact O-N 3.39Å; N122-A124 VanDerWaalsContact O-N 3.1Å; N122-A125 HydrophobicContact CB-CB 4.26Å; N122-A125 PolarHBondContact O-N 3.19Å; N122-A125 PolarHBondContact OD1-N 3.38Å
123	P	68.3	Low	69.7	Low	110 Å²	110	86.8 Å²	86.8	71%	0.714	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-12.7	179.3	26.1	-34.1	0	0	0	113.6
124	A	62.6	Low	69	Low	80 Å²	80	88.7 Å²	88.7	66%	0.661	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-11.2	178	0	0	0	0	0	113.9	N122 K126	N122-A124 PolarHBondContact O-N 3.39Å; N122-A124 VanDerWaalsContact O-N 3.1Å; A124-K126 PolarHBondContact O-N 2.98Å
125	A	57.9	Low	68.9	Low	51 Å²	51	91.9 Å²	91.9	42%	0.421	51%	0.509	S	S	.	.			trans	-72.1	97.6	177.3	0	0	0	0	0	110.6	N122 T127	N122-A125 HydrophobicContact CB-CB 4.26Å; N122-A125 PolarHBondContact O-N 3.19Å; N122-A125 PolarHBondContact OD1-N 3.38Å; A125-T127 PolarHBondContact O-N 3.02Å
126	K	56.3	Low	69.1	Low	205 Å²	205	89 Å²	89	89%	0.891	51%	0.505	S	S	*	.			trans	-71.4	-9.3	178.6	-74.2	179.2	177.3	176.8	0	113.9	A124	A124-K126 PolarHBondContact O-N 2.98Å
127	T	55.8	Low	68.9	Low	119 Å²	119	89.2 Å²	89.2	73%	0.73	51%	0.506	S	S	*	.	S	Bend	trans	-152.2	129.2	-173.2	-5.7	0	0	0	0	110.5	A125	A125-T127 PolarHBondContact O-N 3.02Å
128	L	56	Low	69	Low	100 Å²	100	92.7 Å²	92.7	52%	0.524	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-69.1	141.9	165.2	-78.7	157.6	0	0	0	108.6	F115 T130	F115-L128 HydrophobicContact CD2-CD1 3.84Å; F115-L128 HydrophobicContact CE2-CD1 3.7Å; F115-L128 HydrophobicContact CE2-CG 4.49Å; L128-T130 PolarHBondContact O-N 3.44Å
129	P	55	Low	69.3	Low	95 Å²	95	96 Å²	96	62%	0.617	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-57.8	127.3	173.7	23.3	-31	0	0	0	109.3
130	T	56.9	Low	69.7	Low	84 Å²	84	95.1 Å²	95.1	52%	0.515	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-78.9	153.5	179.2	-45.1	0	0	0	0	108	L128 A132 D133 V134	L128-T130 PolarHBondContact O-N 3.44Å; T130-A132 PolarHBondContact O-N 2.9Å; T130-D133 PolarHBondContact N-OD2 3.24Å; T130-D133 WeakPolarHBondContact O-CB 3.28Å; T130-D133 PolarHBondContact O-N 3.15Å; T130-V134 PolarHBondContact O-N 2.84Å
131	I	61.7	Low	69.8	Low	145 Å²	145	90 Å²	90	74%	0.744	52%	0.524	S	S	*	.	H	α-helix	trans	-50.3	-33.3	177.3	-65.1	166.5	0	0	0	111.7	D133 V134 T135	I131-D133 PolarHBondContact O-N 2.73Å; I131-V134 PolarHBondContact O-N 2.95Å; I131-T135 WeakPolarHBondContact O-CG2 3.37Å; I131-T135 PolarHBondContact O-N 3.5Å; I131-T135 VanDerWaalsContact O-N 3.08Å
132	A	60.2	Low	70.2	Confident	59 Å²	59	93.3 Å²	93.3	49%	0.488	54%	0.541	S	S	.	.	H	α-helix	trans	-62.8	-37.4	175.6	0	0	0	0	0	113.9	T130 T135 A136	T130-A132 PolarHBondContact O-N 2.9Å; A132-T135 WeakPolarHBondContact CA-OG1 3.48Å; A132-T135 PolarHBondContact O-N 2.6Å; A132-T135 PolarHBondContact O-OG1 3.4Å; A132-A136 PolarHBondContact O-N 2.93Å; A132-A136 VanDerWaalsContact O-N 3.08Å
133	D	62.1	Low	70.7	Confident	83 Å²	83	96 Å²	96	44%	0.444	56%	0.556	S	S	.	*	H	α-helix	trans	-68.3	-39.7	178.3	-56.3	-42.6	0	0	0	110.3	T130 I131 T135 A136 D137	T130-D133 PolarHBondContact N-OD2 3.24Å; T130-D133 WeakPolarHBondContact O-CB 3.28Å; T130-D133 PolarHBondContact O-N 3.15Å; I131-D133 PolarHBondContact O-N 2.73Å; D133-T135 VanDerWaalsContact C-N 3.31Å; D133-T135 PolarHBondContact O-N 2.78Å; D133-A136 PolarHBondContact O-N 3.3Å; D133-D137 PolarHBondContact O-N 3.06Å
134	V	65.5	Low	71.8	Confident	87 Å²	87	94.9 Å²	94.9	53%	0.527	55%	0.547	S	S	.	.	H	α-helix	trans	-62.4	-39.2	175	-175.7	0	0	0	0	111	T130 I131 L138	T130-V134 PolarHBondContact O-N 2.84Å; I131-V134 PolarHBondContact O-N 2.95Å; V134-L138 WeakPolarHBondContact O-CB 3.29Å; V134-L138 PolarHBondContact O-N 2.71Å
135	T	77.7	Confident	73.1	Confident	77 Å²	77	95.8 Å²	95.8	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-67.7	-38.3	176.8	53.5	0	0	0	0	112.8	I131 A132 D133 Q139	I131-T135 WeakPolarHBondContact O-CG2 3.37Å; I131-T135 PolarHBondContact O-N 3.5Å; I131-T135 VanDerWaalsContact O-N 3.08Å; A132-T135 WeakPolarHBondContact CA-OG1 3.48Å; A132-T135 PolarHBondContact O-N 2.6Å; A132-T135 PolarHBondContact O-OG1 3.4Å; D133-T135 VanDerWaalsContact C-N 3.31Å; D133-T135 PolarHBondContact O-N 2.78Å; T135-Q139 WeakPolarHBondContact O-CB 3.28Å; T135-Q139 PolarHBondContact O-N 2.67Å
136	A	81.6	Confident	74.7	Confident	44 Å²	44	96.8 Å²	96.8	36%	0.364	53%	0.534	S	S	.	.	H	α-helix	trans	-68.4	-41.5	179	0	0	0	0	0	112	A132 D133 Q139 K140	A132-A136 PolarHBondContact O-N 2.93Å; A132-A136 VanDerWaalsContact O-N 3.08Å; D133-A136 PolarHBondContact O-N 3.3Å; A136-Q139 PolarHBondContact O-N 3.29Å; A136-K140 WeakPolarHBondContact O-CG 2.92Å; A136-K140 PolarHBondContact O-N 3.23Å; A136-K140 VanDerWaalsContact O-N 3.12Å
137	D	79.4	Confident	76.2	Confident	94 Å²	94	96.2 Å²	96.2	50%	0.503	53%	0.526	S	S	.	.	H	α-helix	trans	-72.8	-34	177.4	-71.7	-18.1	0	0	0	112.4	D133 Q139 K140 A141	D133-D137 PolarHBondContact O-N 3.06Å; D137-Q139 VanDerWaalsContact C-N 3.34Å; D137-K140 PolarHBondContact O-N 3.44Å; D137-K140 IonicContact OD1-NZ 2.84Å; D137-K140 PolarHBondContact OD1-NZ 3.43Å; D137-A141 WeakPolarHBondContact O-CB 3.22Å; D137-A141 PolarHBondContact O-N 3.31Å
138	L	84.4	Confident	77.7	Confident	102 Å²	102	95.7 Å²	95.7	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-43.2	171.2	179	63.2	0	0	0	111.4	V134 A141 L142	V134-L138 WeakPolarHBondContact O-CB 3.29Å; V134-L138 PolarHBondContact O-N 2.71Å; L138-A141 WeakPolarHBondContact O-CB 3.36Å; L138-A141 PolarHBondContact O-N 2.76Å; L138-L142 HydrophobicContact CG-CD1 4.44Å; L138-L142 WeakPolarHBondContact O-CG 3.36Å; L138-L142 PolarHBondContact O-N 2.72Å
139	Q	87.2	Confident	79.2	Confident	125 Å²	125	95 Å²	95	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-66.4	-42.5	179.7	-167.5	161.2	-3.5	0	0	111.8	T135 A136 D137 A141 L142 D143	T135-Q139 WeakPolarHBondContact O-CB 3.28Å; T135-Q139 PolarHBondContact O-N 2.67Å; A136-Q139 PolarHBondContact O-N 3.29Å; D137-Q139 VanDerWaalsContact C-N 3.34Å; Q139-A141 VanDerWaalsContact C-N 3.27Å; Q139-A141 PolarHBondContact O-N 3.04Å; Q139-L142 PolarHBondContact O-N 3.44Å; Q139-D143 VanDerWaalsContact O-CG 3.27Å; Q139-D143 PolarHBondContact O-N 3.1Å
140	K	89.9	Confident	80.7	Confident	121 Å²	121	96.2 Å²	96.2	53%	0.526	51%	0.512	S	S	.	.	H	α-helix	trans	-58.1	-39.3	171.4	-67.3	170.2	-161.8	155.1	0	112.2	A136 D137 D143 V144	A136-K140 WeakPolarHBondContact O-CG 2.92Å; A136-K140 PolarHBondContact O-N 3.23Å; A136-K140 VanDerWaalsContact O-N 3.12Å; D137-K140 PolarHBondContact O-N 3.44Å; D137-K140 IonicContact OD1-NZ 2.84Å; D137-K140 PolarHBondContact OD1-NZ 3.43Å; K140-D143 PolarHBondContact O-N 3.3Å; K140-V144 VanDerWaalsContact O-CG2 3.28Å; K140-V144 WeakPolarHBondContact O-CG2 3.44Å; K140-V144 PolarHBondContact O-N 2.83Å
141	A	87.7	Confident	81.9	Confident	58 Å²	58	98 Å²	98	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-38.8	178.4	0	0	0	0	0	112.1	D137 L138 Q139 K145	D137-A141 WeakPolarHBondContact O-CB 3.22Å; D137-A141 PolarHBondContact O-N 3.31Å; L138-A141 WeakPolarHBondContact O-CB 3.36Å; L138-A141 PolarHBondContact O-N 2.76Å; Q139-A141 VanDerWaalsContact C-N 3.27Å; Q139-A141 PolarHBondContact O-N 3.04Å; A141-K145 WeakPolarHBondContact O-CB 3.02Å; A141-K145 PolarHBondContact O-N 3.08Å
142	L	89.1	Confident	82.8	Confident	82 Å²	82	97.7 Å²	97.7	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-65.7	-44.9	174.3	-69.4	174.2	0	0	0	111.7	L138 Q139 V144 K145 D146	L138-L142 HydrophobicContact CG-CD1 4.44Å; L138-L142 WeakPolarHBondContact O-CG 3.36Å; L138-L142 PolarHBondContact O-N 2.72Å; Q139-L142 PolarHBondContact O-N 3.44Å; L142-V144 VanDerWaalsContact C-N 3.34Å; L142-V144 PolarHBondContact O-N 3.03Å; L142-K145 WeakPolarHBondContact O-CB 3.26Å; L142-K145 PolarHBondContact O-N 3.29Å; L142-K145 VanDerWaalsContact O-N 3.17Å; L142-D146 PolarHBondContact O-N 2.88Å
143	D	90.3	Very high	83.7	Confident	96 Å²	96	105 Å²	105	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-41.3	178	-66.8	-14.8	0	0	0	112	Q139 K140 R147	Q139-D143 VanDerWaalsContact O-CG 3.27Å; Q139-D143 PolarHBondContact O-N 3.1Å; K140-D143 PolarHBondContact O-N 3.3Å; D143-R147 VanDerWaalsContact O-CB 3.3Å; D143-R147 WeakPolarHBondContact O-CB 3.46Å; D143-R147 PolarHBondContact O-N 2.91Å
144	V	90.8	Very high	84.5	Confident	85 Å²	85	108.3 Å²	108.3	52%	0.515	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-42.5	175.6	171.1	0	0	0	0	111.1	K140 L142 R147 L148	K140-V144 VanDerWaalsContact O-CG2 3.28Å; K140-V144 WeakPolarHBondContact O-CG2 3.44Å; K140-V144 PolarHBondContact O-N 2.83Å; L142-V144 VanDerWaalsContact C-N 3.34Å; L142-V144 PolarHBondContact O-N 3.03Å; V144-R147 PolarHBondContact O-N 2.84Å; V144-L148 HydrophobicContact CG1-CD1 4.04Å; V144-L148 WeakPolarHBondContact O-CG 3.27Å; V144-L148 PolarHBondContact O-N 3.28Å
145	K	89.5	Confident	84.9	Confident	99 Å²	99	105.5 Å²	105.5	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-61.2	-47.4	177	179.5	-141	59.4	151.3	0	110.6	A141 L142 L148 L149	A141-K145 WeakPolarHBondContact O-CB 3.02Å; A141-K145 PolarHBondContact O-N 3.08Å; L142-K145 WeakPolarHBondContact O-CB 3.26Å; L142-K145 PolarHBondContact O-N 3.29Å; L142-K145 VanDerWaalsContact O-N 3.17Å; K145-L148 PolarHBondContact O-N 2.93Å; K145-L149 HydrophobicContact CD-CD1 4.46Å; K145-L149 HydrophobicContact CG-CD1 4.34Å; K145-L149 WeakPolarHBondContact O-CG 3.3Å; K145-L149 PolarHBondContact O-N 3.39Å
146	D	91.4	Very high	84.4	Confident	72 Å²	72	104.2 Å²	104.2	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-41.1	179.7	-69.8	-22.9	0	0	0	111.5	L142 L148 L149 E150	L142-D146 PolarHBondContact O-N 2.88Å; D146-L148 VanDerWaalsContact C-N 3.34Å; D146-L148 PolarHBondContact O-N 2.87Å; D146-L149 PolarHBondContact O-N 2.61Å; D146-E150 PolarHBondContact O-N 2.82Å
147	R	88.7	Confident	83.6	Confident	194 Å²	194	110 Å²	110	73%	0.732	54%	0.535	S	S	*	.	H	α-helix	trans	-59.4	-39.7	173	-176.5	179	179.6	177.5	0.9	113.3	D143 V144 Y151	D143-R147 VanDerWaalsContact O-CB 3.3Å; D143-R147 WeakPolarHBondContact O-CB 3.46Å; D143-R147 PolarHBondContact O-N 2.91Å; V144-R147 PolarHBondContact O-N 2.84Å; R147-Y151 PolarHBondContact O-N 3.1Å
148	L	87.7	Confident	83.1	Confident	107 Å²	107	116.2 Å²	116.2	56%	0.56	55%	0.551	S	S	*	*	H	α-helix	trans	-69.4	-37	177.6	-74.2	169.7	0	0	0	111.8	V144 K145 D146 Y151 Q152	V144-L148 HydrophobicContact CG1-CD1 4.04Å; V144-L148 WeakPolarHBondContact O-CG 3.27Å; V144-L148 PolarHBondContact O-N 3.28Å; K145-L148 PolarHBondContact O-N 2.93Å; D146-L148 VanDerWaalsContact C-N 3.34Å; D146-L148 PolarHBondContact O-N 2.87Å; L148-Y151 PolarHBondContact O-N 3.18Å; L148-Q152 WeakPolarHBondContact O-CG 3.32Å; L148-Q152 PolarHBondContact O-N 3.49Å
149	L	87.1	Confident	82.4	Confident	85 Å²	85	114.7 Å²	114.7	45%	0.445	55%	0.546	S	S	.	.	H	α-helix	trans	-67	-41	175.9	-69.8	171.3	0	0	0	111.6	K145 D146 Q152 R153	K145-L149 HydrophobicContact CD-CD1 4.46Å; K145-L149 HydrophobicContact CG-CD1 4.34Å; K145-L149 WeakPolarHBondContact O-CG 3.3Å; K145-L149 PolarHBondContact O-N 3.39Å; D146-L149 PolarHBondContact O-N 2.61Å; L149-Q152 PolarHBondContact O-N 3.28Å; L149-R153 WeakPolarHBondContact O-CG 3.32Å; L149-R153 PolarHBondContact O-N 3.08Å
150	E	85.2	Confident	81.4	Confident	121 Å²	121	112 Å²	112	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-61.7	-43.6	172.2	-74.7	176.8	175.4	0	0	111.8	D146 Q152 R153 E154	D146-E150 PolarHBondContact O-N 2.82Å; E150-Q152 VanDerWaalsContact C-N 3.35Å; E150-Q152 PolarHBondContact O-N 2.94Å; E150-R153 PolarHBondContact O-N 3.4Å; E150-R153 VanDerWaalsContact O-N 3.16Å; E150-E154 PolarHBondContact O-N 3.32Å
151	Y	83	Confident	80.4	Confident	121 Å²	121	112.5 Å²	112.5	48%	0.475	55%	0.551	S	S	.	*	I	π-helix	trans	-61.7	-41.1	176.1	-169.2	-89.7	0	0	0	112.2	R147 L148 R153 S155 A156 T159	R147-Y151 PolarHBondContact O-N 3.1Å; L148-Y151 PolarHBondContact O-N 3.18Å; Y151-R153 VanDerWaalsContact C-N 3.34Å; Y151-S155 VanDerWaalsContact CD2-OG 3.31Å; Y151-S155 WeakPolarHBondContact CD2-OG 3.44Å; Y151-S155 CarbonylContact O-C 3.59Å; Y151-S155 VanDerWaalsContact O-CA 3.29Å; Y151-S155 WeakPolarHBondContact O-CA 3.43Å; Y151-S155 WeakPolarHBondContact O-CB 3.36Å; Y151-S155 PolarHBondContact O-N 2.59Å; Y151-A156 PolarHBondContact O-N 2.85Å; Y151-T159 VanDerWaalsContact OH-CG2 3.28Å; Y151-T159 WeakPolarHBondContact OH-CG2 3.24Å
152	Q	80.8	Confident	79.1	Confident	139 Å²	139	115.8 Å²	115.8	65%	0.65	56%	0.555	S	S	*	*	I	π-helix	trans	-65	-36.7	174.5	-76	-173.4	-10.4	0	0	112.6	L148 L149 E150 A156	L148-Q152 WeakPolarHBondContact O-CG 3.32Å; L148-Q152 PolarHBondContact O-N 3.49Å; L149-Q152 PolarHBondContact O-N 3.28Å; E150-Q152 VanDerWaalsContact C-N 3.35Å; E150-Q152 PolarHBondContact O-N 2.94Å; Q152-A156 VanDerWaalsContact O-CB 3.24Å; Q152-A156 WeakPolarHBondContact O-CB 3.26Å
153	R	78.5	Confident	77.8	Confident	214 Å²	214	115.6 Å²	115.6	81%	0.808	55%	0.554	S	S	*	*	I	π-helix	trans	-72	-43.5	178.8	-73.4	179.3	73.5	-174.1	2.4	113.1	L149 E150 Y151	L149-R153 WeakPolarHBondContact O-CG 3.32Å; L149-R153 PolarHBondContact O-N 3.08Å; E150-R153 PolarHBondContact O-N 3.4Å; E150-R153 VanDerWaalsContact O-N 3.16Å; Y151-R153 VanDerWaalsContact C-N 3.34Å
154	E	79.6	Confident	76.2	Confident	151 Å²	151	116.6 Å²	116.6	71%	0.706	56%	0.56	S	S	*	*	I	π-helix	trans	-106.6	-37.6	-169.7	-62.9	-174.3	168.4	0	0	113.5	E150	E150-E154 PolarHBondContact O-N 3.32Å
155	S	73.2	Confident	74.7	Confident	28 Å²	28	121 Å²	121	20%	0.196	58%	0.575	C	S	.	*	I	π-helix	trans	-90.5	-20.4	-172.1	-58.8	0	0	0	0	113.4	Y151 Q157 R158 T159	Y151-S155 VanDerWaalsContact CD2-OG 3.31Å; Y151-S155 WeakPolarHBondContact CD2-OG 3.44Å; Y151-S155 CarbonylContact O-C 3.59Å; Y151-S155 VanDerWaalsContact O-CA 3.29Å; Y151-S155 WeakPolarHBondContact O-CA 3.43Å; Y151-S155 WeakPolarHBondContact O-CB 3.36Å; Y151-S155 PolarHBondContact O-N 2.59Å; S155-Q157 PolarHBondContact O-N 3.39Å; S155-R158 CarbonylContact O-C 3.58Å; S155-R158 WeakPolarHBondContact O-CA 3.43Å; S155-R158 PolarHBondContact O-N 3.3Å; S155-T159 PolarHBondContact O-N 2.93Å; S155-T159 PolarHBondContact O-OG1 3.32Å; S155-T159 VanDerWaalsContact O-OG1 3.1Å
156	A	66.4	Low	73	Confident	51 Å²	51	119.1 Å²	119.1	42%	0.421	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.2	-39.8	176.8	0	0	0	0	0	112.1	Y151 Q152 R158 T160	Y151-A156 PolarHBondContact O-N 2.85Å; Q152-A156 VanDerWaalsContact O-CB 3.24Å; Q152-A156 WeakPolarHBondContact O-CB 3.26Å; A156-R158 VanDerWaalsContact C-N 3.34Å; A156-T160 VanDerWaalsContact O-CG2 3.29Å; A156-T160 WeakPolarHBondContact O-CG2 3.28Å; A156-T160 PolarHBondContact O-N 3.47Å
157	Q	65.8	Low	71.2	Confident	165 Å²	165	120.8 Å²	120.8	77%	0.771	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-31	174.2	-70.1	-173	-3.5	0	0	113	S155 T160	S155-Q157 PolarHBondContact O-N 3.39Å; Q157-T160 PolarHBondContact O-OG1 3.41Å
158	R	67.9	Low	69.6	Low	225 Å²	225	115.8 Å²	115.8	85%	0.849	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-29.1	179.9	-173.7	178.5	173.5	124.4	1.6	112.5	S155 A156	S155-R158 CarbonylContact O-C 3.58Å; S155-R158 WeakPolarHBondContact O-CA 3.43Å; S155-R158 PolarHBondContact O-N 3.3Å; A156-R158 VanDerWaalsContact C-N 3.34Å
159	T	69.8	Low	67.9	Low	69 Å²	69	117.9 Å²	117.9	42%	0.423	57%	0.57	S	S	.	*	S	Bend	trans	-99.4	13	-179	61	0	0	0	0	113.8	Y151 S155 V161	Y151-T159 VanDerWaalsContact OH-CG2 3.28Å; Y151-T159 WeakPolarHBondContact OH-CG2 3.24Å; S155-T159 PolarHBondContact O-N 2.93Å; S155-T159 PolarHBondContact O-OG1 3.32Å; S155-T159 VanDerWaalsContact O-OG1 3.1Å; T159-V161 PolarHBondContact O-N 3.38Å
160	T	67.2	Low	66.4	Low	69 Å²	69	118 Å²	118	42%	0.423	57%	0.571	S	S	.	*			trans	-58.4	105.5	168.3	55.7	0	0	0	0	108.2	A156 Q157 F162	A156-T160 VanDerWaalsContact O-CG2 3.29Å; A156-T160 WeakPolarHBondContact O-CG2 3.28Å; A156-T160 PolarHBondContact O-N 3.47Å; Q157-T160 PolarHBondContact O-OG1 3.41Å; T160-F162 PolarHBondContact O-N 3.37Å; T160-F162 WeakPolarHBondContact OG1-CZ 3.29Å
161	V	67.9	Low	65.2	Low	132 Å²	132	115 Å²	115	80%	0.8	56%	0.557	S	S	*	*			trans	-78.5	108.7	175.2	178.9	0	0	0	0	106.5	T159 D163	T159-V161 PolarHBondContact O-N 3.38Å; V161-D163 PolarHBondContact O-N 3.09Å
162	F	61.3	Low	64.2	Low	126 Å²	126	114.6 Å²	114.6	55%	0.553	57%	0.568	S	S	*	*			trans	-75.6	108.8	170.5	-58.8	-72.2	0	0	0	108.1	T160 D164 P225	T160-F162 PolarHBondContact O-N 3.37Å; T160-F162 WeakPolarHBondContact OG1-CZ 3.29Å; F162-D164 PolarHBondContact O-N 2.79Å; F162-P225 HydrophobicContact CE1-CG 4.03Å
163	D	60.7	Low	63.5	Low	78 Å²	78	109.6 Å²	109.6	42%	0.417	55%	0.548	S	S	.	.			trans	-84.5	102.5	171.6	-173.7	-7.7	0	0	0	109.2	V161 Q165 A166 D167	V161-D163 PolarHBondContact O-N 3.09Å; D163-Q165 PolarHBondContact O-N 2.78Å; D163-Q165 VanDerWaalsContact O-N 3.07Å; D163-Q165 WeakPolarHBondContact OD1-CB 3.32Å; D163-Q165 PolarHBondContact OD1-N 3.31Å; D163-A166 HydrophobicContact CB-CB 3.86Å; D163-A166 PolarHBondContact O-N 3.02Å; D163-A166 PolarHBondContact OD1-N 3.24Å; D163-A166 WeakPolarHBondContact OD2-CB 3.11Å; D163-D167 PolarHBondContact O-N 2.88Å
164	D	58.7	Low	63.1	Low	117 Å²	117	104 Å²	104	63%	0.626	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.7	176.5	-69.6	-21	0	0	0	112.8	F162 Y169	F162-D164 PolarHBondContact O-N 2.79Å; D164-Y169 WeakPolarHBondContact O-CD2 3.41Å
165	Q	57.5	Low	62.5	Low	179 Å²	179	108.4 Å²	108.4	84%	0.836	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-26.2	179.6	-62.8	-168.8	-5.7	0	0	113.9	D163	D163-Q165 PolarHBondContact O-N 2.78Å; D163-Q165 VanDerWaalsContact O-N 3.07Å; D163-Q165 WeakPolarHBondContact OD1-CB 3.32Å; D163-Q165 PolarHBondContact OD1-N 3.31Å
166	A	54.8	Low	62.3	Low	58 Å²	58	109.2 Å²	109.2	48%	0.479	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-44.3	-173.9	0	0	0	0	0	113.1	D163	D163-A166 HydrophobicContact CB-CB 3.86Å; D163-A166 PolarHBondContact O-N 3.02Å; D163-A166 PolarHBondContact OD1-N 3.24Å; D163-A166 WeakPolarHBondContact OD2-CB 3.11Å
167	D	54.4	Low	63	Low	107 Å²	107	111.5 Å²	111.5	57%	0.572	57%	0.565	S	S	*	*	S	Bend	trans	-116.6	-16.3	-152.7	-69.7	-31.2	0	0	0	117.1	D163	D163-D167 PolarHBondContact O-N 2.88Å
168	Y	53.7	Low	63.8	Low	89 Å²	89	108.4 Å²	108.4	35%	0.349	56%	0.559	S	S	.	*	S	Bend	trans	-128.8	-21.8	-165.7	-68.5	-78.8	0	0	0	117.9	F223	Y168-F223 HydrophobicContact CD1-CD1 4.37Å
169	Y	51.7	Low	64.6	Low	152 Å²	152	103.9 Å²	103.9	60%	0.596	55%	0.547	S	S	*	.	S	Bend	trans	-109.6	-10.9	-171.3	-64.7	-76.7	0	0	0	115.2	D164 F223	D164-Y169 WeakPolarHBondContact O-CD2 3.41Å; Y169-F223 HydrophobicContact CD1-CE1 4.38Å; Y169-F223 AromaticContact CE1-CE1 3.67Å; Y169-F223 HydrophobicContact CE1-CE1 3.67Å; Y169-F223 AromaticContact CE1-CZ 3.9Å; Y169-F223 HydrophobicContact CE1-CZ 3.9Å; Y169-F223 AromaticContact CZ-CE1 3.97Å
170	N	56.5	Low	64.9	Low	88 Å²	88	106.3 Å²	106.3	47%	0.471	55%	0.552	S	S	.	*			trans	-119.8	68.1	-169.5	-141.6	-6.7	0	0	0	112.9	T172 S173	N170-T172 PolarHBondContact O-N 2.96Å; N170-T172 PolarHBondContact OD1-OG1 3.49Å; N170-S173 PolarHBondContact O-N 2.89Å; N170-S173 PolarHBondContact O-OG 3.18Å
171	M	58.8	Low	65.4	Low	58 Å²	58	107 Å²	107	29%	0.286	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-15.3	162.8	-71	-61.8	-68.7	0	0	113.4	K181 L184 Q185	M171-K181 WeakPolarHBondContact O-CE 3.46Å; M171-L184 HydrophobicContact CE-CB 3.96Å; M171-L184 HydrophobicContact SD-CB 3.73Å; M171-Q185 HydrophobicContact CE-CB 3.53Å; M171-Q185 HydrophobicContact CE-CG 4.19Å; M171-Q185 VanDerWaalsContact CE-N 3.35Å
172	T	63.5	Low	66.2	Low	112 Å²	112	103.3 Å²	103.3	69%	0.687	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	2.4	-177.9	22.4	0	0	0	0	114.6	N170 A174	N170-T172 PolarHBondContact O-N 2.96Å; N170-T172 PolarHBondContact OD1-OG1 3.49Å; T172-A174 PolarHBondContact O-N 2.88Å
173	S	65.4	Low	67.1	Low	34 Å²	34	101.9 Å²	101.9	24%	0.238	53%	0.528	C	S	.	.			trans	-66.2	135	179.9	72.3	0	0	0	0	111.2	N170 W175 I176	N170-S173 PolarHBondContact O-N 2.89Å; N170-S173 PolarHBondContact O-OG 3.18Å; S173-W175 PolarHBondContact O-N 3.47Å; S173-I176 WeakPolarHBondContact OG-CD1 3.39Å; S173-I176 VanDerWaalsContact OG-CG1 3.31Å; S173-I176 WeakPolarHBondContact OG-CG1 3.49Å
174	A	70.5	Confident	67.8	Low	97 Å²	97	101 Å²	101	80%	0.802	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-4.4	-176.4	0	0	0	0	0	113.9	T172	T172-A174 PolarHBondContact O-N 2.88Å
175	W	66.5	Low	68.8	Low	243 Å²	243	100 Å²	100	92%	0.92	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	1.7	-169.9	-56.7	103.5	0	0	0	113.8	S173	S173-W175 PolarHBondContact O-N 3.47Å
176	I	69	Low	70.1	Confident	45 Å²	45	97.7 Å²	97.7	23%	0.231	50%	0.504	C	S	.	.	S	Bend	trans	-90.8	131.4	177	-62.8	170.3	0	0	0	109.1	S173 K180 K181 L184	S173-I176 WeakPolarHBondContact OG-CD1 3.39Å; S173-I176 VanDerWaalsContact OG-CG1 3.31Å; S173-I176 WeakPolarHBondContact OG-CG1 3.49Å; I176-K180 HydrophobicContact CG2-CB 3.79Å; I176-K180 HydrophobicContact CG2-CD 4.49Å; I176-K180 HydrophobicContact CG2-CG 4.05Å; I176-K181 HydrophobicContact CG2-CB 3.91Å; I176-L184 HydrophobicContact CD1-CD1 4.07Å; I176-L184 HydrophobicContact CG2-CD1 4.47Å
177	N	81.3	Confident	71.1	Confident	99 Å²	99	98.4 Å²	98.4	53%	0.529	49%	0.494	S	S	.	.			trans	-55.4	132.2	171.7	-172.3	12.1	0	0	0	109.3	E179 K180 K181	N177-E179 PolarHBondContact O-N 2.87Å; N177-K180 HydrophobicContact CB-CB 4.45Å; N177-K180 PolarHBondContact O-N 3.01Å; N177-K181 PolarHBondContact O-N 3.49Å
178	P	83.5	Confident	72.1	Confident	100 Å²	100	98.9 Å²	98.9	65%	0.649	49%	0.488	S	S	*	.	H	α-helix	trans	-46.3	-36.2	-179.9	13.9	-33.4	0	0	0	114.8	K181 A182	P178-K181 WeakPolarHBondContact O-CB 3.43Å; P178-K181 PolarHBondContact O-N 3.07Å; P178-A182 PolarHBondContact O-N 3.04Å
179	E	83.6	Confident	73.4	Confident	129 Å²	129	98.5 Å²	98.5	60%	0.603	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-48.2	176.6	-171.7	172.9	-165.4	0	0	112.7	N177 K181 A182 Q183	N177-E179 PolarHBondContact O-N 2.87Å; E179-K181 PolarHBondContact O-N 3.41Å; E179-A182 PolarHBondContact O-N 3.05Å; E179-A182 VanDerWaalsContact O-N 3.14Å; E179-Q183 WeakPolarHBondContact O-CG 3.49Å; E179-Q183 PolarHBondContact O-N 3.32Å
180	K	76.7	Confident	74.7	Confident	120 Å²	120	97.3 Å²	97.3	52%	0.522	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-33.5	175.5	-171.3	170.2	-173.1	174.7	0	111.3	I176 N177 Q183 L184	I176-K180 HydrophobicContact CG2-CB 3.79Å; I176-K180 HydrophobicContact CG2-CD 4.49Å; I176-K180 HydrophobicContact CG2-CG 4.05Å; N177-K180 HydrophobicContact CB-CB 4.45Å; N177-K180 PolarHBondContact O-N 3.01Å; K180-Q183 PolarHBondContact O-N 2.96Å; K180-L184 HydrophobicContact CG-CD1 4.39Å; K180-L184 WeakPolarHBondContact O-CB 3Å; K180-L184 VanDerWaalsContact O-CG 3.27Å; K180-L184 WeakPolarHBondContact O-CG 3.35Å; K180-L184 PolarHBondContact O-N 3.21Å
181	K	77.8	Confident	75.6	Confident	83 Å²	83	95 Å²	95	36%	0.361	48%	0.481	S	S	.	.	H	α-helix	trans	-65.6	-41.8	174.3	-175.5	177.7	176.4	173.6	0	112.1	M171 I176 N177 P178 E179 L184 Q185	M171-K181 WeakPolarHBondContact O-CE 3.46Å; I176-K181 HydrophobicContact CG2-CB 3.91Å; N177-K181 PolarHBondContact O-N 3.49Å; P178-K181 WeakPolarHBondContact O-CB 3.43Å; P178-K181 PolarHBondContact O-N 3.07Å; E179-K181 PolarHBondContact O-N 3.41Å; K181-L184 PolarHBondContact O-N 3.34Å; K181-Q185 WeakPolarHBondContact O-CB 3.35Å; K181-Q185 PolarHBondContact O-N 3.39Å
182	A	84.2	Confident	76.4	Confident	56 Å²	56	93.7 Å²	93.7	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-64.2	-44.5	175.8	0	0	0	0	0	111.4	P178 E179 L184 Q185 E186	P178-A182 PolarHBondContact O-N 3.04Å; E179-A182 PolarHBondContact O-N 3.05Å; E179-A182 VanDerWaalsContact O-N 3.14Å; A182-L184 PolarHBondContact O-N 3.14Å; A182-Q185 WeakPolarHBondContact O-CB 3.47Å; A182-Q185 PolarHBondContact O-N 3.26Å; A182-Q185 VanDerWaalsContact O-N 3.13Å; A182-E186 WeakPolarHBondContact O-CB 3.46Å; A182-E186 PolarHBondContact O-N 2.85Å
183	Q	80.2	Confident	77.1	Confident	96 Å²	96	93.2 Å²	93.2	45%	0.449	47%	0.469	S	S	.	.	H	α-helix	trans	-61.1	-43.6	175.7	-69.5	173.4	-1.7	0	0	112.5	E179 K180 Q185 E186 R187	E179-Q183 WeakPolarHBondContact O-CG 3.49Å; E179-Q183 PolarHBondContact O-N 3.32Å; K180-Q183 PolarHBondContact O-N 2.96Å; Q183-Q185 VanDerWaalsContact C-N 3.28Å; Q183-Q185 PolarHBondContact O-N 3.34Å; Q183-E186 PolarHBondContact O-N 3.4Å; Q183-R187 VanDerWaalsContact O-CB 3.32Å; Q183-R187 WeakPolarHBondContact O-CB 3.41Å; Q183-R187 PolarHBondContact O-N 3.35Å
184	L	75.6	Confident	77.6	Confident	58 Å²	58	97 Å²	97	30%	0.304	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-37.4	174.6	-75.2	169.7	0	0	0	111.7	M171 I176 K180 K181 A182 Y188	M171-L184 HydrophobicContact CE-CB 3.96Å; M171-L184 HydrophobicContact SD-CB 3.73Å; I176-L184 HydrophobicContact CD1-CD1 4.07Å; I176-L184 HydrophobicContact CG2-CD1 4.47Å; K180-L184 HydrophobicContact CG-CD1 4.39Å; K180-L184 WeakPolarHBondContact O-CB 3Å; K180-L184 VanDerWaalsContact O-CG 3.27Å; K180-L184 WeakPolarHBondContact O-CG 3.35Å; K180-L184 PolarHBondContact O-N 3.21Å; K181-L184 PolarHBondContact O-N 3.34Å; A182-L184 PolarHBondContact O-N 3.14Å; L184-Y188 VanDerWaalsContact O-CB 3.28Å; L184-Y188 WeakPolarHBondContact O-CB 3.4Å; L184-Y188 PolarHBondContact O-N 3.19Å
185	Q	79.7	Confident	77.8	Confident	98 Å²	98	95.9 Å²	95.9	46%	0.458	46%	0.458	S	S	.	.	H	α-helix	trans	-70.2	-45.6	179.2	-172	174.4	-24.8	0	0	111.1	M171 K181 A182 Q183 R187 Y188 D189	M171-Q185 HydrophobicContact CE-CB 3.53Å; M171-Q185 HydrophobicContact CE-CG 4.19Å; M171-Q185 VanDerWaalsContact CE-N 3.35Å; K181-Q185 WeakPolarHBondContact O-CB 3.35Å; K181-Q185 PolarHBondContact O-N 3.39Å; A182-Q185 WeakPolarHBondContact O-CB 3.47Å; A182-Q185 PolarHBondContact O-N 3.26Å; A182-Q185 VanDerWaalsContact O-N 3.13Å; Q183-Q185 VanDerWaalsContact C-N 3.28Å; Q183-Q185 PolarHBondContact O-N 3.34Å; Q185-R187 VanDerWaalsContact C-N 3.31Å; Q185-R187 PolarHBondContact O-N 2.82Å; Q185-Y188 PolarHBondContact O-N 2.91Å; Q185-D189 WeakPolarHBondContact O-CB 3.5Å; Q185-D189 VanDerWaalsContact O-CG 3.26Å; Q185-D189 PolarHBondContact O-N 3.43Å
186	E	83.7	Confident	78.3	Confident	130 Å²	130	87.5 Å²	87.5	61%	0.607	43%	0.426	S	S	*	.	H	α-helix	trans	-58.7	-44.2	174.4	-177.8	176.8	-167.3	0	0	111.3	A182 Q183 Y188 D189 M190	A182-E186 WeakPolarHBondContact O-CB 3.46Å; A182-E186 PolarHBondContact O-N 2.85Å; Q183-E186 PolarHBondContact O-N 3.4Å; E186-Y188 PolarHBondContact O-N 2.81Å; E186-D189 PolarHBondContact O-N 2.92Å; E186-M190 VanDerWaalsContact O-CB 3.28Å; E186-M190 WeakPolarHBondContact O-CB 3.42Å; E186-M190 PolarHBondContact O-N 3.43Å
187	R	76	Confident	78.6	Confident	72 Å²	72	85.7 Å²	85.7	27%	0.272	42%	0.419	S	S	.	.	H	α-helix	trans	-63.7	-41.8	175.9	-171.4	176.4	179.2	137.8	-5.7	112	Q183 Q185 M190 L191	Q183-R187 VanDerWaalsContact O-CB 3.32Å; Q183-R187 WeakPolarHBondContact O-CB 3.41Å; Q183-R187 PolarHBondContact O-N 3.35Å; Q185-R187 VanDerWaalsContact C-N 3.31Å; Q185-R187 PolarHBondContact O-N 2.82Å; R187-M190 PolarHBondContact O-N 3.49Å; R187-L191 HydrophobicContact CG-CD1 4.45Å; R187-L191 VanDerWaalsContact O-CG 3.29Å; R187-L191 WeakPolarHBondContact O-CG 3.28Å; R187-L191 PolarHBondContact O-N 2.97Å
188	Y	76.5	Confident	78.3	Confident	118 Å²	118	81.2 Å²	81.2	46%	0.463	40%	0.396	S	S	.	.	H	α-helix	trans	-64.1	-43.3	176.3	179.6	-100.8	0	0	0	111.7	L184 Q185 E186 L191 L192	L184-Y188 VanDerWaalsContact O-CB 3.28Å; L184-Y188 WeakPolarHBondContact O-CB 3.4Å; L184-Y188 PolarHBondContact O-N 3.19Å; Q185-Y188 PolarHBondContact O-N 2.91Å; E186-Y188 PolarHBondContact O-N 2.81Å; Y188-L191 PolarHBondContact O-N 3.48Å; Y188-L192 HydrophobicContact CD1-CD1 3.57Å; Y188-L192 HydrophobicContact CD1-CG 4.44Å; Y188-L192 HydrophobicContact CE1-CD1 3.14Å; Y188-L192 HydrophobicContact CE1-CG 4.06Å; Y188-L192 HydrophobicContact CG-CD1 4.44Å; Y188-L192 WeakPolarHBondContact O-CB 3.5Å; Y188-L192 PolarHBondContact O-N 2.95Å
189	D	79.8	Confident	77.7	Confident	80 Å²	80	83.3 Å²	83.3	43%	0.428	39%	0.394	S	S	.	.	H	α-helix	trans	-66.1	-38.5	176.7	-69.5	-19.2	0	0	0	111.1	Q185 E186 L192 N193	Q185-D189 WeakPolarHBondContact O-CB 3.5Å; Q185-D189 VanDerWaalsContact O-CG 3.26Å; Q185-D189 PolarHBondContact O-N 3.43Å; E186-D189 PolarHBondContact O-N 2.92Å; D189-L192 WeakPolarHBondContact O-CB 3.27Å; D189-L192 PolarHBondContact O-N 3.47Å; D189-N193 WeakPolarHBondContact O-CB 3.49Å; D189-N193 PolarHBondContact O-N 2.83Å
190	M	78.9	Confident	77	Confident	127 Å²	127	82.6 Å²	82.6	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-62.5	-44.8	172.9	-176.2	-173.5	-72.8	0	0	111.8	E186 R187 N193 K194	E186-M190 VanDerWaalsContact O-CB 3.28Å; E186-M190 WeakPolarHBondContact O-CB 3.42Å; E186-M190 PolarHBondContact O-N 3.43Å; R187-M190 PolarHBondContact O-N 3.49Å; M190-N193 PolarHBondContact O-N 3.13Å; M190-K194 PolarHBondContact O-N 2.88Å
191	L	75.8	Confident	76.6	Confident	41 Å²	41	83.9 Å²	83.9	22%	0.215	40%	0.402	C	S	.	.	H	α-helix	trans	-66.3	-40.2	176.8	-72.4	170	0	0	0	112.1	R187 Y188 N193 K194 K195 I220 L222	R187-L191 HydrophobicContact CG-CD1 4.45Å; R187-L191 VanDerWaalsContact O-CG 3.29Å; R187-L191 WeakPolarHBondContact O-CG 3.28Å; R187-L191 PolarHBondContact O-N 2.97Å; Y188-L191 PolarHBondContact O-N 3.48Å; L191-N193 VanDerWaalsContact C-N 3.34Å; L191-K194 PolarHBondContact O-N 2.89Å; L191-K195 WeakPolarHBondContact O-CB 3.31Å; L191-K195 PolarHBondContact O-N 2.89Å; L191-I220 HydrophobicContact CD2-CG2 3.91Å; L191-L222 HydrophobicContact CB-CD2 3.82Å
192	L	75.7	Confident	76.1	Confident	30 Å²	30	84.4 Å²	84.4	16%	0.157	40%	0.404	C	S	.	.	H	α-helix	trans	-59	-45.9	171.8	-88.8	166.4	0	0	0	111.1	Y188 D189 K195 Y196	Y188-L192 HydrophobicContact CD1-CD1 3.57Å; Y188-L192 HydrophobicContact CD1-CG 4.44Å; Y188-L192 HydrophobicContact CE1-CD1 3.14Å; Y188-L192 HydrophobicContact CE1-CG 4.06Å; Y188-L192 HydrophobicContact CG-CD1 4.44Å; Y188-L192 WeakPolarHBondContact O-CB 3.5Å; Y188-L192 PolarHBondContact O-N 2.95Å; D189-L192 WeakPolarHBondContact O-CB 3.27Å; D189-L192 PolarHBondContact O-N 3.47Å; L192-K195 PolarHBondContact O-N 2.68Å; L192-Y196 HydrophobicContact CD2-CD2 3.63Å; L192-Y196 HydrophobicContact CD2-CE2 3.71Å; L192-Y196 PolarHBondContact O-N 3.04Å
193	N	78.2	Confident	75.1	Confident	102 Å²	102	86.1 Å²	86.1	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-66	-40.1	178.3	-163.6	20	0	0	0	111.6	D189 M190 L191 K195 G197	D189-N193 WeakPolarHBondContact O-CB 3.49Å; D189-N193 PolarHBondContact O-N 2.83Å; M190-N193 PolarHBondContact O-N 3.13Å; L191-N193 VanDerWaalsContact C-N 3.34Å; N193-K195 VanDerWaalsContact C-N 3.25Å; N193-K195 PolarHBondContact O-N 3.48Å; N193-G197 WeakPolarHBondContact O-CA 3.41Å; N193-G197 PolarHBondContact O-N 3Å; N193-G197 WeakPolarHBondContact OD1-CA 3.13Å
194	K	75.9	Confident	74.3	Confident	112 Å²	112	85.2 Å²	85.2	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-61.7	-36	174.5	-160	-172.4	170.1	-175.5	0	111.6	M190 L191 D218 I220	M190-K194 PolarHBondContact O-N 2.88Å; L191-K194 PolarHBondContact O-N 2.89Å; K194-D218 IonicContact NZ-OD2 3.76Å; K194-D218 PolarHBondContact NZ-OD2 2.87Å; K194-I220 HydrophobicContact CB-CD1 3.97Å; K194-I220 HydrophobicContact CD-CD1 3.55Å; K194-I220 HydrophobicContact CD-CG1 3.91Å; K194-I220 HydrophobicContact CD-CG2 4.49Å; K194-I220 HydrophobicContact CG-CD1 3.5Å; K194-I220 VanDerWaalsContact CG-CD1 3.5Å; K194-I220 HydrophobicContact CG-CG1 4.41Å
195	K	74.6	Confident	73.4	Confident	75 Å²	75	87.6 Å²	87.6	33%	0.326	42%	0.422	S	S	.	.	H	α-helix	trans	-81.2	-49.9	-178	-169.2	172.9	-179.7	-176.8	0	113.5	L191 L192 N193 K202 L222	L191-K195 WeakPolarHBondContact O-CB 3.31Å; L191-K195 PolarHBondContact O-N 2.89Å; L192-K195 PolarHBondContact O-N 2.68Å; N193-K195 VanDerWaalsContact C-N 3.25Å; N193-K195 PolarHBondContact O-N 3.48Å; K195-K202 PolarHBondContact O-NZ 3.02Å; K195-K202 VanDerWaalsContact O-NZ 3.09Å; K195-L222 HydrophobicContact CD-CD1 3.79Å
196	Y	77.5	Confident	72.5	Confident	66 Å²	66	88 Å²	88	26%	0.259	43%	0.427	S	S	.	.	H	α-helix	trans	-117.9	3.3	-169.6	-50.9	-63.7	0	0	0	114.3	L192 Y316	L192-Y196 HydrophobicContact CD2-CD2 3.63Å; L192-Y196 HydrophobicContact CD2-CE2 3.71Å; L192-Y196 PolarHBondContact O-N 3.04Å; Y196-Y316 AromaticContact CD1-CD1 3.4Å; Y196-Y316 HydrophobicContact CD1-CD1 3.4Å; Y196-Y316 HydrophobicContact CD1-CD2 4.16Å; Y196-Y316 AromaticContact CD1-CE1 3.47Å; Y196-Y316 HydrophobicContact CD1-CE1 3.47Å; Y196-Y316 VanDerWaalsContact CD1-CE1 3.47Å; Y196-Y316 HydrophobicContact CD1-CE2 4.21Å; Y196-Y316 AromaticContact CD1-CG 3.76Å; Y196-Y316 HydrophobicContact CD1-CG 3.76Å; Y196-Y316 AromaticContact CD1-CZ 3.9Å; Y196-Y316 HydrophobicContact CD2-CD1 4.11Å; Y196-Y316 HydrophobicContact CD2-CG 4.08Å; Y196-Y316 AromaticContact CE1-CD1 3.44Å; Y196-Y316 HydrophobicContact CE1-CD1 3.44Å; Y196-Y316 VanDerWaalsContact CE1-CD1 3.44Å; Y196-Y316 AromaticContact CE1-CE1 3.47Å; Y196-Y316 HydrophobicContact CE1-CE1 3.47Å; Y196-Y316 VanDerWaalsContact CE1-CE1 3.47Å; Y196-Y316 HydrophobicContact CE1-CG 4.24Å; Y196-Y316 HydrophobicContact CE2-CD1 4.12Å; Y196-Y316 HydrophobicContact CE2-CG 4.5Å; Y196-Y316 AromaticContact CG-CD1 3.75Å; Y196-Y316 HydrophobicContact CG-CD1 3.75Å; Y196-Y316 HydrophobicContact CG-CD2 4.12Å; Y196-Y316 HydrophobicContact CG-CE1 4.26Å; Y196-Y316 AromaticContact CG-CG 3.67Å; Y196-Y316 HydrophobicContact CG-CG 3.67Å; Y196-Y316 AromaticContact CZ-CD1 3.8Å
197	G	75.3	Confident	71.3	Confident	8 Å²	8	88.6 Å²	88.6	8%	0.082	43%	0.428	C	S	.	.	S	Bend	trans	-64.1	-179.1	170	0	0	0	0	0	112	N193 K199	N193-G197 WeakPolarHBondContact O-CA 3.41Å; N193-G197 PolarHBondContact O-N 3Å; N193-G197 WeakPolarHBondContact OD1-CA 3.13Å; G197-K199 PolarHBondContact O-N 2.93Å
198	S	75.5	Confident	70.8	Confident	5 Å²	5	94.8 Å²	94.8	4%	0.035	46%	0.457	C	S	.	.			trans	-55	135	-174.4	176.9	0	0	0	0	112.2	L200 H201 S376 E378 D379	S198-L200 PolarHBondContact O-N 2.79Å; S198-L200 VanDerWaalsContact OG-CB 3.32Å; S198-L200 WeakPolarHBondContact OG-CB 3.15Å; S198-L200 VanDerWaalsContact OG-CD1 3.24Å; S198-L200 WeakPolarHBondContact OG-CD1 3.15Å; S198-L200 VanDerWaalsContact OG-CG 3.26Å; S198-L200 WeakPolarHBondContact OG-CG 3.44Å; S198-L200 PolarHBondContact OG-N 3.47Å; S198-L200 VanDerWaalsContact OG-N 3.1Å; S198-H201 PolarHBondContact O-N 3.2Å; S198-S376 WeakPolarHBondContact CA-OG 3.39Å; S198-E378 WeakPolarHBondContact CB-OE2 3.24Å; S198-D379 WeakPolarHBondContact CA-OD2 3.33Å; S198-D379 WeakPolarHBondContact CB-OD1 3.26Å; S198-D379 PolarHBondContact OG-OD1 3.1Å
199	K	71.1	Confident	70.2	Confident	143 Å²	143	94.3 Å²	94.3	62%	0.622	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-62.3	-19.7	173.4	-65.5	-176.2	-178.6	179.6	0	112.2	G197 H201 K202 D379	G197-K199 PolarHBondContact O-N 2.93Å; K199-H201 VanDerWaalsContact C-N 3.29Å; K199-H201 PolarHBondContact O-N 3.41Å; K199-K202 PolarHBondContact O-N 3.48Å; K199-D379 PolarHBondContact N-OD1 3.04Å; K199-D379 PolarHBondContact N-OD2 3.47Å
200	L	67.8	Low	68.9	Low	115 Å²	115	92.8 Å²	92.8	60%	0.602	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-65.1	-31.9	179.9	-61.6	161.1	0	0	0	113.1	S198 K202 L382	S198-L200 PolarHBondContact O-N 2.79Å; S198-L200 VanDerWaalsContact OG-CB 3.32Å; S198-L200 WeakPolarHBondContact OG-CB 3.15Å; S198-L200 VanDerWaalsContact OG-CD1 3.24Å; S198-L200 WeakPolarHBondContact OG-CD1 3.15Å; S198-L200 VanDerWaalsContact OG-CG 3.26Å; S198-L200 WeakPolarHBondContact OG-CG 3.44Å; S198-L200 PolarHBondContact OG-N 3.47Å; S198-L200 VanDerWaalsContact OG-N 3.1Å; L200-K202 VanDerWaalsContact C-N 3.32Å; L200-L382 HydrophobicContact CD1-CD1 3.18Å; L200-L382 HydrophobicContact CD2-CD1 4.42Å; L200-L382 HydrophobicContact CG-CD1 4.26Å
201	H	68.9	Low	67.6	Low	147 Å²	147	96.9 Å²	96.9	68%	0.681	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-87.4	-1.6	-178.2	-71.8	-63.9	0	0	0	113.2	S198 K199 E378	S198-H201 PolarHBondContact O-N 3.2Å; K199-H201 VanDerWaalsContact C-N 3.29Å; K199-H201 PolarHBondContact O-N 3.41Å; H201-E378 IonicContact CD2-OE2 2.6Å; H201-E378 IonicContact NE2-OE2 2.9Å
202	K	67.7	Low	66.4	Low	94 Å²	94	101.4 Å²	101.4	41%	0.409	52%	0.518	S	S	.	.	S	Bend	trans	-80.4	120.3	178.5	-66	-174.3	178.1	-175.2	0	109.4	K195 K199 L200 V204	K195-K202 PolarHBondContact O-NZ 3.02Å; K195-K202 VanDerWaalsContact O-NZ 3.09Å; K199-K202 PolarHBondContact O-N 3.48Å; L200-K202 VanDerWaalsContact C-N 3.32Å; K202-V204 PolarHBondContact O-N 3.45Å
203	P	62.9	Low	65.5	Low	92 Å²	92	105.8 Å²	105.8	60%	0.597	54%	0.54	S	S	*	.			trans	-65.2	123.1	177.2	27.5	-32.6	0	0	0	109
204	V	63.5	Low	64.4	Low	76 Å²	76	103.4 Å²	103.4	46%	0.461	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.7	172.2	-179.5	0	0	0	0	107.5	K202 L206 I213	K202-V204 PolarHBondContact O-N 3.45Å; V204-L206 HydrophobicContact CG1-CD2 4.27Å; V204-L206 HydrophobicContact CG1-CG 4.3Å; V204-L206 PolarHBondContact O-N 3.09Å; V204-I213 HydrophobicContact CG1-CG2 3.68Å
205	M	57.2	Low	63.4	Low	108 Å²	108	104.4 Å²	104.4	53%	0.532	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	101.5	174.2	-82.1	-78.5	-82.5	0	0	109.5	K207	M205-K207 PolarHBondContact O-N 3.46Å
206	L	60.9	Low	62.4	Low	108 Å²	108	105.8 Å²	105.8	57%	0.565	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	106.9	173.9	-66	163.3	0	0	0	109.4	V204 F208 I213	V204-L206 HydrophobicContact CG1-CD2 4.27Å; V204-L206 HydrophobicContact CG1-CG 4.3Å; V204-L206 PolarHBondContact O-N 3.09Å; L206-F208 PolarHBondContact O-N 3.41Å; L206-I213 HydrophobicContact CD2-CG1 4.21Å
207	K	57.8	Low	61	Low	142 Å²	142	109.1 Å²	109.1	62%	0.617	57%	0.566	S	S	*	*			trans	-79.9	109	169.8	-71.9	-178.5	-178.5	171.1	0	109.1	M205 A209	M205-K207 PolarHBondContact O-N 3.46Å; K207-A209 PolarHBondContact O-N 3.33Å
208	F	65.3	Low	59.7	Low	202 Å²	202	113 Å²	113	89%	0.886	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	6	-177	-81.5	-89.9	0	0	0	116	L206	L206-F208 PolarHBondContact O-N 3.41Å
209	A	64.6	Low	58.3	Low	108 Å²	108	121.3 Å²	121.3	89%	0.893	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	12.1	-173	0	0	0	0	0	115.1	K207	K207-A209 PolarHBondContact O-N 3.33Å
210	G	51.5	Low	57.4	Low	48 Å²	48	116.3 Å²	116.3	50%	0.495	60%	0.6	S	S	.	*	S	Bend	trans	161.2	126.2	179.4	0	0	0	0	0	107.3	E212	G210-E212 PolarHBondContact O-N 3.02Å
211	E	52.6	Low	56.6	Low	213 Å²	213	114.9 Å²	114.9	100%	0.995	59%	0.593	S	S	*	*	S	Bend	trans	-60.4	79.3	-171.7	-64.4	173.8	149.2	0	0	112
212	E	50.3	Low	55.7	Low	136 Å²	136	109.8 Å²	109.8	64%	0.636	57%	0.571	S	S	*	*			trans	-129.3	104.7	171.9	-159.2	174.2	-164.6	0	0	107.8	G210 V214	G210-E212 PolarHBondContact O-N 3.02Å; E212-V214 VanDerWaalsContact C-N 3.35Å; E212-V214 HydrophobicContact CB-CG2 4.47Å; E212-V214 HydrophobicContact CG-CG2 4.01Å; E212-V214 PolarHBondContact O-N 3Å; E212-V214 VanDerWaalsContact O-N 3.1Å
213	I	56.8	Low	55	Low	121 Å²	121	109.6 Å²	109.6	62%	0.621	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.9	95.6	169.2	-59.4	171.7	0	0	0	105.6	V204 L206 E215	V204-I213 HydrophobicContact CG1-CG2 3.68Å; L206-I213 HydrophobicContact CD2-CG1 4.21Å; I213-E215 PolarHBondContact O-N 3.4Å
214	V	54.3	Low	54.5	Low	53 Å²	53	107.2 Å²	107.2	32%	0.321	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.8	98.7	171.1	-175.2	0	0	0	0	106.3	E212 E216	E212-V214 VanDerWaalsContact C-N 3.35Å; E212-V214 HydrophobicContact CB-CG2 4.47Å; E212-V214 HydrophobicContact CG-CG2 4.01Å; E212-V214 PolarHBondContact O-N 3Å; E212-V214 VanDerWaalsContact O-N 3.1Å; V214-E216 PolarHBondContact O-N 3.42Å; V214-E216 VanDerWaalsContact O-N 3.15Å
215	E	54.9	Low	53.8	Low	133 Å²	133	106.2 Å²	106.2	62%	0.621	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-56.8	118.7	156.3	-70.5	-172.2	165.7	0	0	105.6	I213 N217	I213-E215 PolarHBondContact O-N 3.4Å; E215-N217 PolarHBondContact O-N 3.32Å
216	E	53	Low	53.3	Low	103 Å²	103	105.8 Å²	105.8	48%	0.481	55%	0.553	S	S	.	*			trans	-60.5	94	164.4	-82.5	-178	166.3	0	0	105.5	V214 D218	V214-E216 PolarHBondContact O-N 3.42Å; V214-E216 VanDerWaalsContact O-N 3.15Å; E216-D218 PolarHBondContact O-N 3.27Å
217	N	50	Low	52.3	Low	137 Å²	137	103.7 Å²	103.7	73%	0.733	55%	0.551	S	S	*	*			trans	-65.5	68.9	157.3	-80.2	-38.7	0	0	0	105.7	E215 F219	E215-N217 PolarHBondContact O-N 3.32Å; N217-F219 PolarHBondContact O-N 3.03Å
218	D	47.9	Very low	51.5	Low	88 Å²	88	104.2 Å²	104.2	47%	0.471	56%	0.556	S	S	.	*			trans	-49	97.6	146.3	-92.2	6.3	0	0	0	103.1	K194 E216 I220	K194-D218 IonicContact NZ-OD2 3.76Å; K194-D218 PolarHBondContact NZ-OD2 2.87Å; E216-D218 PolarHBondContact O-N 3.27Å; D218-I220 HydrophobicContact CB-CG1 3.96Å; D218-I220 PolarHBondContact O-N 2.91Å
219	F	45.5	Very low	50.5	Low	181 Å²	181	99.2 Å²	99.2	79%	0.794	54%	0.538	S	S	*	.			trans	-65.2	83.4	166.5	-154.7	-89.3	0	0	0	103.6	N217 N221	N217-F219 PolarHBondContact O-N 3.03Å; F219-N221 HydrophobicContact CD1-CB 4.47Å; F219-N221 PolarHBondContact O-N 2.78Å
220	I	51.6	Low	49.5	Very low	38 Å²	38	99 Å²	99	20%	0.195	52%	0.522	C	S	.	.			trans	-68.3	88	176.2	-59.8	161	0	0	0	103.2	L191 K194 D218 L222	L191-I220 HydrophobicContact CD2-CG2 3.91Å; K194-I220 HydrophobicContact CB-CD1 3.97Å; K194-I220 HydrophobicContact CD-CD1 3.55Å; K194-I220 HydrophobicContact CD-CG1 3.91Å; K194-I220 HydrophobicContact CD-CG2 4.49Å; K194-I220 HydrophobicContact CG-CD1 3.5Å; K194-I220 VanDerWaalsContact CG-CD1 3.5Å; K194-I220 HydrophobicContact CG-CG1 4.41Å; D218-I220 HydrophobicContact CB-CG1 3.96Å; D218-I220 PolarHBondContact O-N 2.91Å; I220-L222 VanDerWaalsContact C-N 3.25Å; I220-L222 PolarHBondContact O-N 2.85Å
221	N	51.3	Low	48.9	Very low	84 Å²	84	102.5 Å²	102.5	45%	0.449	53%	0.525	S	S	.	.			trans	-68.8	98.3	174.8	-156.6	-4.3	0	0	0	104	F219 F223 A224	F219-N221 HydrophobicContact CD1-CB 4.47Å; F219-N221 PolarHBondContact O-N 2.78Å; N221-F223 PolarHBondContact O-N 3.26Å; N221-A224 HydrophobicContact CB-CB 3.78Å; N221-A224 PolarHBondContact O-N 3.15Å
222	L	50.7	Low	48.2	Very low	41 Å²	41	100 Å²	100	22%	0.215	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-15.6	178.6	-83.2	146.2	0	0	0	112.3	L191 K195 I220	L191-L222 HydrophobicContact CB-CD2 3.82Å; K195-L222 HydrophobicContact CD-CD1 3.79Å; I220-L222 VanDerWaalsContact C-N 3.25Å; I220-L222 PolarHBondContact O-N 2.85Å
223	F	51.9	Low	47.6	Very low	90 Å²	90	99.1 Å²	99.1	40%	0.395	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	6.1	-175.5	-52	-76	0	0	0	113.5	Y168 Y169 N221 P225	Y168-F223 HydrophobicContact CD1-CD1 4.37Å; Y169-F223 HydrophobicContact CD1-CE1 4.38Å; Y169-F223 AromaticContact CE1-CE1 3.67Å; Y169-F223 HydrophobicContact CE1-CE1 3.67Å; Y169-F223 AromaticContact CE1-CZ 3.9Å; Y169-F223 HydrophobicContact CE1-CZ 3.9Å; Y169-F223 AromaticContact CZ-CE1 3.97Å; N221-F223 PolarHBondContact O-N 3.26Å; F223-P225 WeakPolarHBondContact O-CD 3.42Å
224	A	52.5	Low	46.9	Very low	42 Å²	42	101.9 Å²	101.9	35%	0.347	53%	0.528	S	S	.	.			trans	-71.7	121.6	171.3	0	0	0	0	0	108.9	N221 N226	N221-A224 HydrophobicContact CB-CB 3.78Å; N221-A224 PolarHBondContact O-N 3.15Å; A224-N226 PolarHBondContact O-N 2.89Å
225	P	48.1	Very low	46.1	Very low	54 Å²	54	107.7 Å²	107.7	35%	0.351	55%	0.548	S	S	.	.			trans	-66.8	110.9	168.4	8.2	2.9	0	0	0	106.6	F162 F223 A227	F162-P225 HydrophobicContact CE1-CG 4.03Å; F223-P225 WeakPolarHBondContact O-CD 3.42Å; P225-A227 VanDerWaalsContact C-N 3.29Å; P225-A227 PolarHBondContact O-N 3.1Å
226	N	46.9	Very low	45	Very low	100 Å²	100	104.7 Å²	104.7	54%	0.535	55%	0.554	S	S	.	*			trans	-63	107.4	155.5	-67.9	-9.7	0	0	0	105	A224 E228 L229	A224-N226 PolarHBondContact O-N 2.89Å; N226-E228 PolarHBondContact O-N 3.46Å; N226-L229 PolarHBondContact O-N 3.2Å
227	A	41.3	Very low	44	Very low	63 Å²	63	105.3 Å²	105.3	52%	0.521	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.1	3.1	-178	0	0	0	0	0	114.4	P225 Q231	P225-A227 VanDerWaalsContact C-N 3.29Å; P225-A227 PolarHBondContact O-N 3.1Å; A227-Q231 PolarHBondContact O-NE2 3.41Å
228	E	40.8	Very low	43.3	Very low	154 Å²	154	107.7 Å²	107.7	72%	0.72	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-28.8	-177.9	-71.3	176.3	159.5	0	0	113	N226	N226-E228 PolarHBondContact O-N 3.46Å
229	L	43.8	Very low	42.8	Very low	97 Å²	97	112.7 Å²	112.7	51%	0.508	60%	0.599	S	S	.	*	S	Bend	trans	-82.6	-30.7	-173.4	-129	86.9	0	0	0	114.2	N226 Q231	N226-L229 PolarHBondContact O-N 3.2Å; L229-Q231 VanDerWaalsContact C-N 3.33Å
230	D	43.3	Very low	42.2	Very low	104 Å²	104	114 Å²	114	56%	0.556	60%	0.604	S	S	*	*	H	α-helix	trans	-80	-17.6	-178	-66	-35.1	0	0	0	112.7
231	Q	39.2	Very low	41.4	Very low	121 Å²	121	120.8 Å²	120.8	57%	0.565	64%	0.635	S	S	*	*	H	α-helix	trans	-76.7	-20.2	179.8	-71.2	-172.8	24.6	0	0	114.1	A227 L229	A227-Q231 PolarHBondContact O-NE2 3.41Å; L229-Q231 VanDerWaalsContact C-N 3.33Å
232	E	38	Very low	40.6	Very low	161 Å²	161	122.4 Å²	122.4	75%	0.752	65%	0.65	S	S	*	*	H	α-helix	trans	-83.1	-26.8	-178	-65.1	-163.9	150.4	0	0	112.6
233	T	38.2	Very low	39.7	Very low	116 Å²	116	125 Å²	125	71%	0.712	68%	0.677	S	S	*	*	H	α-helix	trans	-81.8	-15.8	-174.8	13.5	0	0	0	0	115.9
234	E	41.9	Very low	38.8	Very low	180 Å²	180	127 Å²	127	84%	0.841	70%	0.697	S	S	*	*	S	Bend	trans	-97.6	-8.2	179	-69.9	-163.5	155.9	0	0	114.6	G236	E234-G236 VanDerWaalsContact C-N 3.26Å; E234-G236 PolarHBondContact O-N 3.19Å
235	K	37.7	Very low	37.9	Very low	174 Å²	174	129.8 Å²	129.8	76%	0.757	71%	0.714	S	S	*	*	S	Bend	trans	-84.8	9.3	-178.7	-69.6	-175.7	-178.2	171.7	0	114.7
236	G	30.2	Very low	37.4	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	73%	0.734	S	S	*	*	S	Bend	trans	-110.4	47.8	-170.5	0	0	0	0	0	115.8	E234	E234-G236 VanDerWaalsContact C-N 3.26Å; E234-G236 PolarHBondContact O-N 3.19Å
237	S	32.8	Very low	36.9	Very low	115 Å²	115	134.4 Å²	134.4	80%	0.804	75%	0.745	S	S	*	*			trans	-176.6	76.3	154.1	-163.8	0	0	0	0	111.8
238	M	35.2	Very low	36.5	Very low	188 Å²	188	137.6 Å²	137.6	93%	0.926	76%	0.758	S	S	*	*			trans	-146.5	117.6	154.3	-106.2	179.3	75.5	0	0	108.4	K240	M238-K240 PolarHBondContact O-N 3.01Å
239	Q	36.8	Very low	36.7	Very low	192 Å²	192	137 Å²	137	90%	0.897	76%	0.76	S	S	*	*			trans	-59.5	128.8	-174.6	-68.3	169.7	-32.4	0	0	110.6	E241	Q239-E241 PolarHBondContact O-N 2.72Å
240	K	34.9	Very low	36.6	Very low	210 Å²	210	142.2 Å²	142.2	91%	0.913	77%	0.774	S	S	*	*			trans	-67.5	117.4	166.1	-86.5	175.4	170.3	174.6	0	109.1	M238	M238-K240 PolarHBondContact O-N 3.01Å
241	E	34	Very low	36.8	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	79%	0.788	S	S	*	*			trans	-112	144.4	154.8	-82.6	-91.7	143.9	0	0	108	Q239	Q239-E241 PolarHBondContact O-N 2.72Å
242	P	34.8	Very low	37.2	Very low	118 Å²	118	142.6 Å²	142.6	77%	0.766	79%	0.79	S	S	*	*			trans	-89.1	158.7	-158.2	30.2	-22	0	0	0	114
243	A	30.6	Very low	37.4	Very low	95 Å²	95	143.7 Å²	143.7	79%	0.785	80%	0.795	S	S	*	*			trans	-65.7	151.9	-172.4	0	0	0	0	0	115.8
244	T	33.1	Very low	37.4	Very low	131 Å²	131	145.7 Å²	145.7	80%	0.804	79%	0.794	S	S	*	*			trans	-135.7	115.3	142.9	26.2	0	0	0	0	110
245	S	35.1	Very low	37.9	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	79%	0.787	S	S	*	*			trans	24.8	130.8	137.9	-11.3	0	0	0	0	117
246	T	36.2	Very low	38.4	Very low	126 Å²	126	140.9 Å²	140.9	77%	0.773	79%	0.786	S	S	*	*			cis	177.6	135	39.7	-35.4	0	0	0	0	104.3
247	V	37.5	Very low	38.9	Very low	125 Å²	125	143.5 Å²	143.5	76%	0.758	79%	0.788	S	S	*	*			trans	177.2	107.5	136.9	172.1	0	0	0	0	104.9
248	T	33.4	Very low	39.2	Very low	130 Å²	130	142.6 Å²	142.6	80%	0.798	79%	0.787	S	S	*	*			trans	-76.8	121.1	168	45.3	0	0	0	0	108.2
249	D	43.4	Very low	39.2	Very low	142 Å²	142	138 Å²	138	76%	0.759	78%	0.779	S	S	*	*			trans	-149.2	107.5	158.7	-85.7	-40	0	0	0	111
250	Y	42.2	Very low	39.3	Very low	206 Å²	206	135.8 Å²	135.8	81%	0.808	78%	0.778	S	S	*	*			trans	20.6	116.5	144.8	-160.3	-103.9	0	0	0	119.6	P252	Y250-P252 HydrophobicContact CE1-CB 3.96Å; Y250-P252 HydrophobicContact CE1-CG 4.35Å
251	V	47.3	Very low	39.4	Very low	139 Å²	139	131.6 Å²	131.6	84%	0.842	78%	0.775	S	S	*	*			trans	-108.9	112.1	165.1	-178.6	0	0	0	0	109
252	P	48.8	Very low	39.7	Very low	94 Å²	94	134.1 Å²	134.1	61%	0.61	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.3	136.8	174	26.2	-29.8	0	0	0	112	Y250	Y250-P252 HydrophobicContact CE1-CB 3.96Å; Y250-P252 HydrophobicContact CE1-CG 4.35Å
253	Q	41.5	Very low	39.8	Very low	184 Å²	184	134.2 Å²	134.2	86%	0.86	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-86.2	123.6	175.3	-172.7	171.7	-1.7	0	0	110.2
254	F	37.6	Very low	40.2	Very low	158 Å²	158	138.3 Å²	138.3	69%	0.693	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-87	130.3	176.1	146.8	-99	0	0	0	111	L256	F254-L256 HydrophobicContact CE1-CD1 3.86Å; F254-L256 HydrophobicContact CE1-CD2 4.25Å; F254-L256 HydrophobicContact CE1-CG 3.61Å; F254-L256 HydrophobicContact CE2-CD2 3.77Å; F254-L256 HydrophobicContact CE2-CG 3.8Å; F254-L256 HydrophobicContact CZ-CB 4.38Å; F254-L256 HydrophobicContact CZ-CD1 3.77Å; F254-L256 HydrophobicContact CZ-CD2 3.33Å; F254-L256 HydrophobicContact CZ-CG 3.16Å
255	V	51.9	Low	40.4	Very low	113 Å²	113	137.7 Å²	137.7	69%	0.685	78%	0.779	S	S	*	*			trans	-112.2	121.3	174	-178.9	0	0	0	0	107.9	T257	V255-T257 PolarHBondContact O-N 2.87Å
256	L	49.3	Very low	40.4	Very low	141 Å²	141	143.1 Å²	143.1	74%	0.738	79%	0.789	S	S	*	*			trans	-75.8	106.5	173.8	-86.8	161.2	0	0	0	110.6	F254	F254-L256 HydrophobicContact CE1-CD1 3.86Å; F254-L256 HydrophobicContact CE1-CD2 4.25Å; F254-L256 HydrophobicContact CE1-CG 3.61Å; F254-L256 HydrophobicContact CE2-CD2 3.77Å; F254-L256 HydrophobicContact CE2-CG 3.8Å; F254-L256 HydrophobicContact CZ-CB 4.38Å; F254-L256 HydrophobicContact CZ-CD1 3.77Å; F254-L256 HydrophobicContact CZ-CD2 3.33Å; F254-L256 HydrophobicContact CZ-CG 3.16Å
257	T	39.9	Very low	40.5	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	79%	0.789	S	S	*	*			trans	-97	114.8	161.8	47.2	0	0	0	0	110.3	V255	V255-T257 PolarHBondContact O-N 2.87Å
258	A	38.9	Very low	40.6	Very low	95 Å²	95	143 Å²	143	79%	0.785	79%	0.794	S	S	*	*			trans	31.1	126.4	151.8	0	0	0	0	0	121.4
259	A	36.3	Very low	40.9	Very low	92 Å²	92	143.4 Å²	143.4	76%	0.76	80%	0.796	S	S	*	*			trans	69.2	96.3	138	0	0	0	0	0	118.9
260	V	37.7	Very low	40.5	Very low	145 Å²	145	143 Å²	143	88%	0.879	79%	0.794	S	S	*	*			trans	-138.7	112.7	133.3	-175.3	0	0	0	0	108.7
261	S	38.1	Very low	40.1	Very low	122 Å²	122	138.4 Å²	138.4	85%	0.853	79%	0.792	S	S	*	*			trans	-63.5	128	172.6	5.8	0	0	0	0	110.4
262	R	39.9	Very low	39.8	Very low	233 Å²	233	140 Å²	140	88%	0.879	79%	0.788	S	S	*	*			trans	-123	134.1	165.4	-162.9	172.4	-173.6	-159.2	1.2	108.8
263	P	37.8	Very low	39.3	Very low	120 Å²	120	140.7 Å²	140.7	78%	0.779	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-80.3	142.3	-169	9.9	5.6	0	0	0	111.7
264	E	37.9	Very low	39.2	Very low	182 Å²	182	140.9 Å²	140.9	85%	0.85	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-66.3	144.8	176.1	-65.1	-170.4	148.3	0	0	112.8
265	P	38.3	Very low	39.4	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.8	124.2	173.1	31	-30.3	0	0	0	110.7	T267	P265-T267 PolarHBondContact O-N 2.92Å
266	K	34.2	Very low	38.8	Very low	215 Å²	215	138.6 Å²	138.6	94%	0.935	80%	0.799	S	S	*	*			trans	-65.6	108.4	170.6	-65.1	173.7	179.2	177.1	0	110
267	T	38.4	Very low	38.6	Very low	126 Å²	126	142.8 Å²	142.8	77%	0.773	81%	0.805	S	S	*	*			trans	-97.5	125.2	162.4	33	0	0	0	0	109.6	P265 V269	P265-T267 PolarHBondContact O-N 2.92Å; T267-V269 PolarHBondContact O-N 2.76Å
268	S	39.2	Very low	38.8	Very low	122 Å²	122	142.8 Å²	142.8	85%	0.853	80%	0.799	S	S	*	*			trans	-64.9	120.4	-177.1	53	0	0	0	0	111.3	N270	S268-N270 PolarHBondContact O-N 2.85Å
269	V	39.8	Very low	39.2	Very low	140 Å²	140	146.3 Å²	146.3	85%	0.848	80%	0.799	S	S	*	*			trans	-72.3	113.3	170.2	-177.1	0	0	0	0	107.8	T267 S271	T267-V269 PolarHBondContact O-N 2.76Å; V269-S271 PolarHBondContact O-N 2.92Å
270	N	35.8	Very low	39.6	Very low	132 Å²	132	145 Å²	145	71%	0.706	78%	0.784	S	S	*	*			trans	-74	107.6	171.6	-158.2	8.8	0	0	0	108.1	S268 K272	S268-N270 PolarHBondContact O-N 2.85Å; N270-K272 PolarHBondContact O-N 3.49Å
271	S	34.3	Very low	40.4	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	77%	0.769	S	S	*	*			trans	-65.4	97.1	177.7	53.1	0	0	0	0	110.7	V269	V269-S271 PolarHBondContact O-N 2.92Å
272	K	40.6	Very low	41.5	Very low	172 Å²	172	141.9 Å²	141.9	75%	0.748	76%	0.759	S	S	*	*			trans	-120.9	94.5	162.7	-81.5	-176.9	177	177.6	0	108.9	N270	N270-K272 PolarHBondContact O-N 3.49Å
273	S	38	Very low	42.3	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	74%	0.74	S	S	*	*			trans	43.9	78.1	157.9	60.3	0	0	0	0	115.5	V275	S273-V275 PolarHBondContact O-N 3.2Å
274	E	39.2	Very low	43.1	Very low	188 Å²	188	135 Å²	135	88%	0.879	73%	0.728	S	S	*	*			trans	-62.7	102	155.1	-71	-173.6	140.1	0	0	108.1	S276	E274-S276 PolarHBondContact O-N 2.94Å; E274-S276 VanDerWaalsContact O-N 3.08Å
275	V	42.8	Very low	44.2	Very low	130 Å²	130	128.7 Å²	128.7	79%	0.788	70%	0.7	S	S	*	*			trans	-60.9	111.1	155.8	-178.1	0	0	0	0	104.9	S273 R277	S273-V275 PolarHBondContact O-N 3.2Å; V275-R277 PolarHBondContact O-N 3.39Å
276	S	38	Very low	45.1	Very low	93 Å²	93	130.8 Å²	130.8	65%	0.65	70%	0.702	S	S	*	*			trans	-42.9	109.5	-179.9	-150.9	0	0	0	0	109.7	E274 L278	E274-S276 PolarHBondContact O-N 2.94Å; E274-S276 VanDerWaalsContact O-N 3.08Å; S276-L278 PolarHBondContact O-N 2.82Å
277	R	45	Very low	46.9	Very low	228 Å²	228	129.2 Å²	129.2	86%	0.86	69%	0.69	S	S	*	*			trans	-71.5	71.7	174.1	-78.3	-175.4	171.9	124.8	-5.5	108.5	V275 Q279	V275-R277 PolarHBondContact O-N 3.39Å; R277-Q279 PolarHBondContact O-N 3.21Å; R277-Q279 VanDerWaalsContact O-N 3.08Å
278	L	44	Very low	49.1	Very low	126 Å²	126	125.5 Å²	125.5	66%	0.66	67%	0.665	S	S	*	*			trans	-74.2	93.9	166	-74.5	163.8	0	0	0	107.7	S276 C280	S276-L278 PolarHBondContact O-N 2.82Å; L278-C280 PolarHBondContact O-N 3.3Å
279	Q	48.7	Very low	51.3	Low	169 Å²	169	125.2 Å²	125.2	79%	0.79	65%	0.648	S	S	*	*			trans	-76.4	55.2	169.9	-86.5	-179.9	-71.5	0	0	110.9	R277 S281	R277-Q279 PolarHBondContact O-N 3.21Å; R277-Q279 VanDerWaalsContact O-N 3.08Å; Q279-S281 PolarHBondContact O-N 3.38Å
280	C	44.7	Very low	53.7	Low	64 Å²	64	118.6 Å²	118.6	43%	0.432	61%	0.609	S	S	.	*			trans	-78.1	107.7	159.9	-69.9	0	0	0	0	106.4	L278 D282 M283 E284	L278-C280 PolarHBondContact O-N 3.3Å; C280-D282 PolarHBondContact O-N 3.32Å; C280-M283 HydrophobicContact CB-CB 4.3Å; C280-M283 HydrophobicContact CB-CG 4Å; C280-M283 PolarHBondContact O-N 3.03Å; C280-E284 PolarHBondContact O-N 3.38Å
281	S	54.7	Low	56.5	Low	80 Å²	80	114.1 Å²	114.1	56%	0.559	59%	0.585	S	S	*	*	H	α-helix	trans	-48.5	-34	176.1	-57.2	0	0	0	0	111.7	Q279 M283 E284 N285	Q279-S281 PolarHBondContact O-N 3.38Å; S281-M283 PolarHBondContact O-N 2.99Å; S281-E284 PolarHBondContact O-N 3.3Å; S281-N285 WeakPolarHBondContact O-CB 3.27Å; S281-N285 PolarHBondContact O-N 2.79Å; S281-N285 PolarHBondContact O-ND2 3.48Å; S281-N285 PolarHBondContact O-OD1 2.81Å
282	D	60.5	Low	59.5	Low	123 Å²	123	108.9 Å²	108.9	66%	0.658	55%	0.548	S	S	*	.	H	α-helix	trans	-66.6	-33.4	178.1	-56.9	-29	0	0	0	113.3	C280 N285 M286	C280-D282 PolarHBondContact O-N 3.32Å; D282-N285 PolarHBondContact O-N 3.48Å; D282-M286 WeakPolarHBondContact O-CB 3.49Å; D282-M286 WeakPolarHBondContact O-CG 3.23Å; D282-M286 PolarHBondContact O-N 3.05Å; D282-M286 VanDerWaalsContact O-N 3.09Å
283	M	56.3	Low	62.1	Low	98 Å²	98	100.8 Å²	100.8	48%	0.483	51%	0.513	S	S	.	.	H	α-helix	trans	-74.4	-36.2	177.4	-71	-155.7	68.7	0	0	112.5	C280 S281 N285 M286 R287	C280-M283 HydrophobicContact CB-CB 4.3Å; C280-M283 HydrophobicContact CB-CG 4Å; C280-M283 PolarHBondContact O-N 3.03Å; S281-M283 PolarHBondContact O-N 2.99Å; M283-N285 VanDerWaalsContact C-N 3.33Å; M283-M286 PolarHBondContact O-N 3.31Å; M283-R287 PolarHBondContact O-N 2.86Å
284	E	55.4	Low	64.9	Low	110 Å²	110	96.1 Å²	96.1	51%	0.514	48%	0.48	S	S	.	.	H	α-helix	trans	-67.9	-35.6	172.8	-74.3	-165.7	131.1	0	0	111.7	C280 S281 M286	C280-E284 PolarHBondContact O-N 3.38Å; S281-E284 PolarHBondContact O-N 3.3Å; E284-M286 VanDerWaalsContact C-N 3.29Å; E284-M286 PolarHBondContact O-N 3.11Å
285	N	59.5	Low	67.5	Low	49 Å²	49	87.4 Å²	87.4	26%	0.262	44%	0.44	S	S	.	.	H	α-helix	trans	-67.3	-29.1	175	-68.9	-18.2	0	0	0	112.8	S281 D282 M283 R320	S281-N285 WeakPolarHBondContact O-CB 3.27Å; S281-N285 PolarHBondContact O-N 2.79Å; S281-N285 PolarHBondContact O-ND2 3.48Å; S281-N285 PolarHBondContact O-OD1 2.81Å; D282-N285 PolarHBondContact O-N 3.48Å; M283-N285 VanDerWaalsContact C-N 3.33Å; N285-R320 WeakPolarHBondContact OD1-CB 3.47Å
286	M	58.7	Low	70	Confident	162 Å²	162	86 Å²	86	80%	0.798	42%	0.424	S	S	*	.	H	α-helix	trans	-83.5	-23.4	-178.2	-77.5	-73	-161.8	0	0	114.5	D282 M283 E284 D288	D282-M286 WeakPolarHBondContact O-CB 3.49Å; D282-M286 WeakPolarHBondContact O-CG 3.23Å; D282-M286 PolarHBondContact O-N 3.05Å; D282-M286 VanDerWaalsContact O-N 3.09Å; M283-M286 PolarHBondContact O-N 3.31Å; E284-M286 VanDerWaalsContact C-N 3.29Å; E284-M286 PolarHBondContact O-N 3.11Å; M286-D288 PolarHBondContact O-N 2.91Å
287	R	72.5	Confident	72.7	Confident	181 Å²	181	82 Å²	82	68%	0.683	40%	0.396	S	S	*	.	S	Bend	trans	-86.3	101.8	178.4	-71.6	-175.1	-177.9	168.1	3	110.1	M283 K289	M283-R287 PolarHBondContact O-N 2.86Å; R287-K289 PolarHBondContact O-N 2.93Å
288	D	83.9	Confident	75	Confident	48 Å²	48	71.4 Å²	71.4	26%	0.257	36%	0.356	S	S	.	.			trans	-62	106.9	171.8	-174.9	-3	0	0	0	110.5	M286 G290 V322 W324 H423	M286-D288 PolarHBondContact O-N 2.91Å; D288-G290 PolarHBondContact O-N 2.78Å; D288-G290 WeakPolarHBondContact OD1-CA 3.37Å; D288-G290 PolarHBondContact OD1-N 2.92Å; D288-V322 HydrophobicContact CB-CB 4.36Å; D288-W324 PolarHBondContact OD1-NE1 2.87Å; D288-W324 PolarHBondContact OD2-NE1 3Å; D288-H423 IonicContact OD1-CE1 2.89Å; D288-H423 IonicContact OD1-NE2 3.54Å; D288-H423 PolarHBondContact OD1-NE2 2.8Å; D288-H423 IonicContact OD2-CD2 3.51Å; D288-H423 IonicContact OD2-CE1 2.83Å; D288-H423 IonicContact OD2-NE2 3.4Å; D288-H423 PolarHBondContact OD2-NE2 2.73Å
289	K	85.1	Confident	77.4	Confident	116 Å²	116	69.7 Å²	69.7	50%	0.504	34%	0.341	S	S	.	.			trans	-77.9	-2	179.5	-67.4	174.2	-176.5	169.9	0	112.7	R287 L291	R287-K289 PolarHBondContact O-N 2.93Å; K289-L291 VanDerWaalsContact C-N 3.3Å; K289-L291 HydrophobicContact CB-CD1 4.05Å; K289-L291 HydrophobicContact CB-CG 3.97Å; K289-L291 HydrophobicContact CD-CD1 4.31Å
290	G	91.1	Very high	79.6	Confident	2 Å²	2	61.7 Å²	61.7	2%	0.021	30%	0.304	C	S	.	.			trans	69.6	28.1	-175.7	0	0	0	0	0	112.9	D288 L418	D288-G290 PolarHBondContact O-N 2.78Å; D288-G290 WeakPolarHBondContact OD1-CA 3.37Å; D288-G290 PolarHBondContact OD1-N 2.92Å; G290-L418 WeakPolarHBondContact O-CB 3.45Å; G290-L418 PolarHBondContact O-N 2.85Å
291	L	94.5	Very high	82	Confident	38 Å²	38	59 Å²	59	20%	0.199	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	138.8	179.8	-69.4	174.4	0	0	0	110.8	K289 H319 L323 W324 I415	K289-L291 VanDerWaalsContact C-N 3.3Å; K289-L291 HydrophobicContact CB-CD1 4.05Å; K289-L291 HydrophobicContact CB-CG 3.97Å; K289-L291 HydrophobicContact CD-CD1 4.31Å; L291-H319 WeakPolarHBondContact CD1-CD2 3.48Å; L291-H319 WeakPolarHBondContact CD1-NE2 3.42Å; L291-L323 HydrophobicContact CB-CD1 4.26Å; L291-W324 WeakPolarHBondContact O-CB 3.29Å; L291-W324 PolarHBondContact O-N 3.28Å; L291-I415 HydrophobicContact CB-CG2 3.84Å; L291-I415 HydrophobicContact CD1-CG2 4.31Å; L291-I415 HydrophobicContact CD2-CG2 3.96Å; L291-I415 HydrophobicContact CG-CG2 4.24Å
292	C	95.8	Very high	83.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.2	-175.3	179.2	0	0	0	0	112.2	W324 I415 Y416 L418	C292-W324 CarbonylContact C-O 3.59Å; C292-W324 WeakPolarHBondContact CA-O 3.35Å; C292-W324 HydrophobicContact CB-CB 3.85Å; C292-W324 PolarHBondContact SG-O 2.92Å; C292-I415 WeakPolarHBondContact O-CA 3.45Å; C292-Y416 HydrophobicContact CB-CD2 4.42Å; C292-Y416 HydrophobicContact CB-CE2 3.95Å; C292-Y416 PolarHBondContact N-O 3.19Å; C292-Y416 WeakPolarHBondContact O-CD1 3.35Å; C292-Y416 PolarHBondContact O-N 2.65Å; C292-Y416 PolarHBondContact SG-OH 2.76Å; C292-L418 HydrophobicContact CB-CD1 4.02Å; C292-L418 HydrophobicContact CB-CD2 3.56Å; C292-L418 HydrophobicContact CB-CG 3.53Å
293	L	95.8	Very high	85.5	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.1	173.5	-177.6	65.1	0	0	0	110	E311 W315 L323 W324 I325 A326 I415	L293-E311 HydrophobicContact CD2-CG 4.37Å; L293-W315 HydrophobicContact CD1-CH2 4.32Å; L293-W315 HydrophobicContact CD1-CZ2 4.01Å; L293-L323 HydrophobicContact CB-CD1 4.25Å; L293-L323 HydrophobicContact CB-CD2 3.92Å; L293-L323 HydrophobicContact CB-CG 4.2Å; L293-L323 HydrophobicContact CD2-CD2 4.11Å; L293-W324 PolarHBondContact N-O 3.4Å; L293-I325 HydrophobicContact CB-CD1 4.28Å; L293-A326 PolarHBondContact O-N 2.99Å; L293-I415 HydrophobicContact CB-CG1 4.46Å; L293-I415 HydrophobicContact CD1-CG1 4.2Å
294	S	95.9	Very high	87.3	Confident	10 Å²	10	44.8 Å²	44.8	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.4	173.9	-69.6	0	0	0	0	111.8	R313 A326 G411 R412 Y416	S294-R313 PolarHBondContact O-NH2 3.06Å; S294-A326 CarbonylContact C-O 3.58Å; S294-A326 WeakPolarHBondContact CA-O 3.46Å; S294-G411 WeakPolarHBondContact OG-CA 3.22Å; S294-R412 PolarHBondContact OG-N 3.21Å; S294-Y416 WeakPolarHBondContact OG-CE1 3.28Å; S294-Y416 PolarHBondContact OG-OH 2.79Å
295	L	95.2	Very high	89	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	149.1	-179	-71.8	172	0	0	0	111.8	A300 L303 E311 I325 A326 T328	L295-A300 HydrophobicContact CB-CB 3.53Å; L295-L303 HydrophobicContact CD1-CB 4.31Å; L295-L303 HydrophobicContact CD1-CD2 3.42Å; L295-L303 VanDerWaalsContact CD1-CD2 3.42Å; L295-L303 HydrophobicContact CD1-CG 4.48Å; L295-E311 HydrophobicContact CD2-CG 4.04Å; L295-E311 WeakPolarHBondContact CD2-OE1 3.42Å; L295-I325 HydrophobicContact CD1-CD1 4.12Å; L295-I325 HydrophobicContact CD1-CG2 3.69Å; L295-I325 HydrophobicContact CG-CG2 4.43Å; L295-A326 PolarHBondContact N-O 2.91Å; L295-T328 VanDerWaalsContact O-CG2 3.28Å; L295-T328 WeakPolarHBondContact O-CG2 3.38Å; L295-T328 PolarHBondContact O-N 3.46Å; L295-T328 PolarHBondContact O-OG1 3.31Å; L295-T328 VanDerWaalsContact O-OG1 3.1Å
296	H	94.4	Very high	90.5	Very high	102 Å²	102	39.9 Å²	39.9	47%	0.472	18%	0.183	S	C	.	.			trans	-75	140.6	170.4	-68.3	-52.1	0	0	0	110.5	Y299 A300 T328	H296-Y299 WeakPolarHBondContact O-CB 3.46Å; H296-Y299 PolarHBondContact O-N 2.87Å; H296-Y299 VanDerWaalsContact O-N 3.08Å; H296-A300 PolarHBondContact O-N 2.79Å; H296-T328 WeakPolarHBondContact CA-OG1 3.28Å; H296-T328 PolarHBondContact ND1-OG1 2.83Å
297	Q	94.3	Very high	92.1	Very high	9 Å²	9	32.2 Å²	32.2	4%	0.042	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	144.6	169.2	-70.5	-67.3	16.8	0	0	109.5	S301 A327 P332 P361 V362	Q297-S301 PolarHBondContact NE2-OG 2.79Å; Q297-S301 VanDerWaalsContact OE1-N 3.13Å; Q297-S301 PolarHBondContact OE1-OG 2.83Å; Q297-S301 VanDerWaalsContact OE1-OG 3.13Å; Q297-A327 HydrophobicContact CG-CB 4.04Å; Q297-P332 HydrophobicContact CB-CB 4.04Å; Q297-P332 HydrophobicContact CB-CG 3.85Å; Q297-P361 PolarHBondContact NE2-O 2.73Å; Q297-V362 HydrophobicContact CG-CG1 4.27Å
298	P	94.7	Very high	93.1	Very high	4 Å²	4	24.2 Å²	24.2	3%	0.026	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	cis	-86.7	-7.1	7.4	33.6	-36	0	0	0	115.8	A300 S301 L302 V337 L340 Y360	P298-A300 PolarHBondContact O-N 3.43Å; P298-A300 VanDerWaalsContact O-N 3.16Å; P298-S301 PolarHBondContact O-N 3.14Å; P298-L302 HydrophobicContact CB-CD1 4.31Å; P298-L302 HydrophobicContact CG-CD1 4.44Å; P298-L302 WeakPolarHBondContact O-CG 3.18Å; P298-L302 PolarHBondContact O-N 2.93Å; P298-L302 VanDerWaalsContact O-N 3.11Å; P298-V337 HydrophobicContact CB-CG2 4.2Å; P298-V337 HydrophobicContact CG-CG2 4.3Å; P298-L340 HydrophobicContact CG-CB 4.3Å; P298-L340 HydrophobicContact CG-CD1 3.37Å; P298-L340 HydrophobicContact CG-CG 4.45Å; P298-Y360 HydrophobicContact CB-CD1 3.61Å; P298-Y360 HydrophobicContact CB-CE1 3.37Å; P298-Y360 HydrophobicContact CB-CG 4.42Å
299	Y	94.5	Very high	93.4	Very high	91 Å²	91	27 Å²	27	36%	0.357	12%	0.122	S	C	.	.	H	α-helix	trans	-56.2	-35.8	-174.7	-61.2	-68.4	0	0	0	113.7	H296 L302 L303 K308 L340	H296-Y299 WeakPolarHBondContact O-CB 3.46Å; H296-Y299 PolarHBondContact O-N 2.87Å; H296-Y299 VanDerWaalsContact O-N 3.08Å; Y299-L302 PolarHBondContact O-N 3.22Å; Y299-L303 VanDerWaalsContact O-CB 3.31Å; Y299-L303 WeakPolarHBondContact O-CB 2.97Å; Y299-L303 PolarHBondContact O-N 3.02Å; Y299-K308 HydrophobicContact CD1-CD 3.89Å; Y299-L340 HydrophobicContact CD1-CD1 4.44Å; Y299-L340 HydrophobicContact CE1-CD1 3.84Å; Y299-L340 HydrophobicContact CE1-CD2 3.75Å; Y299-L340 HydrophobicContact CE1-CG 4.44Å; Y299-L340 HydrophobicContact CE2-CD1 4.06Å; Y299-L340 WeakPolarHBondContact OH-CD2 3.35Å
300	A	95.2	Very high	93.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.4	-51.3	178.4	0	0	0	0	0	112.1	L295 H296 P298 L303 V304 I325 A327 L366	L295-A300 HydrophobicContact CB-CB 3.53Å; H296-A300 PolarHBondContact O-N 2.79Å; P298-A300 PolarHBondContact O-N 3.43Å; P298-A300 VanDerWaalsContact O-N 3.16Å; A300-L303 PolarHBondContact O-N 3.35Å; A300-V304 WeakPolarHBondContact O-CG2 3.4Å; A300-V304 PolarHBondContact O-N 2.95Å; A300-I325 HydrophobicContact CB-CG2 4.42Å; A300-A327 HydrophobicContact CB-CB 4.35Å; A300-L366 HydrophobicContact CB-CD1 3.67Å
301	S	94.5	Very high	94.1	Very high	8 Å²	8	22.9 Å²	22.9	6%	0.056	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-39.7	177.8	-66.6	0	0	0	0	112	Q297 P298 L303 V304 R305	Q297-S301 PolarHBondContact NE2-OG 2.79Å; Q297-S301 VanDerWaalsContact OE1-N 3.13Å; Q297-S301 PolarHBondContact OE1-OG 2.83Å; Q297-S301 VanDerWaalsContact OE1-OG 3.13Å; P298-S301 PolarHBondContact O-N 3.14Å; S301-L303 VanDerWaalsContact C-N 3.31Å; S301-L303 PolarHBondContact O-N 2.89Å; S301-V304 PolarHBondContact O-N 2.9Å; S301-R305 VanDerWaalsContact O-CB 3.3Å; S301-R305 WeakPolarHBondContact O-CB 3.4Å; S301-R305 VanDerWaalsContact O-CG 3.31Å; S301-R305 WeakPolarHBondContact O-CG 3.45Å; S301-R305 PolarHBondContact O-N 3.09Å
302	L	94	Very high	94	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.6	-36.9	178.9	-65.2	175	0	0	0	112.2	P298 Y299 G306 I307 K308 Y344 Y356	P298-L302 HydrophobicContact CB-CD1 4.31Å; P298-L302 HydrophobicContact CG-CD1 4.44Å; P298-L302 WeakPolarHBondContact O-CG 3.18Å; P298-L302 PolarHBondContact O-N 2.93Å; P298-L302 VanDerWaalsContact O-N 3.11Å; Y299-L302 PolarHBondContact O-N 3.22Å; L302-G306 PolarHBondContact O-N 2.83Å; L302-I307 HydrophobicContact CB-CB 4.45Å; L302-I307 HydrophobicContact CD2-CB 4.32Å; L302-I307 HydrophobicContact CD2-CD1 3.77Å; L302-I307 HydrophobicContact CD2-CG2 4.29Å; L302-I307 PolarHBondContact O-N 2.85Å; L302-K308 HydrophobicContact CB-CB 4.04Å; L302-K308 PolarHBondContact O-N 3.02Å; L302-K308 VanDerWaalsContact O-N 3.07Å; L302-Y344 HydrophobicContact CD1-CD2 3.85Å; L302-Y344 HydrophobicContact CD1-CE2 3.63Å; L302-Y356 HydrophobicContact CD2-CD1 3.89Å; L302-Y356 HydrophobicContact CD2-CE1 3.98Å
303	L	94.4	Very high	93.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-68.5	-47	177.5	-166.2	80	0	0	0	111.4	L295 Y299 A300 S301 R305 G306 K308 E311 I325 V369 C397 A400	L295-L303 HydrophobicContact CD1-CB 4.31Å; L295-L303 HydrophobicContact CD1-CD2 3.42Å; L295-L303 VanDerWaalsContact CD1-CD2 3.42Å; L295-L303 HydrophobicContact CD1-CG 4.48Å; Y299-L303 VanDerWaalsContact O-CB 3.31Å; Y299-L303 WeakPolarHBondContact O-CB 2.97Å; Y299-L303 PolarHBondContact O-N 3.02Å; A300-L303 PolarHBondContact O-N 3.35Å; S301-L303 VanDerWaalsContact C-N 3.31Å; S301-L303 PolarHBondContact O-N 2.89Å; L303-R305 VanDerWaalsContact C-N 3.28Å; L303-R305 PolarHBondContact O-N 2.87Å; L303-G306 WeakPolarHBondContact O-CA 3.08Å; L303-G306 PolarHBondContact O-N 2.8Å; L303-K308 HydrophobicContact CB-CB 4.24Å; L303-K308 HydrophobicContact CD1-CB 4.01Å; L303-K308 HydrophobicContact CD1-CD 4.21Å; L303-K308 HydrophobicContact CD1-CG 3.93Å; L303-K308 WeakPolarHBondContact CD1-O 3.15Å; L303-E311 HydrophobicContact CD1-CB 4.38Å; L303-I325 HydrophobicContact CD2-CD1 3.75Å; L303-I325 HydrophobicContact CD2-CG1 4.01Å; L303-V369 HydrophobicContact CD2-CG1 4.37Å; L303-V369 HydrophobicContact CD2-CG2 4.39Å; L303-V369 HydrophobicContact CG-CG1 4.22Å; L303-C397 HydrophobicContact CD1-CB 4.18Å; L303-A400 VanDerWaalsContact O-CB 3.24Å; L303-A400 WeakPolarHBondContact O-CB 3.47Å
304	V	93.8	Very high	93.7	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-30.9	178.2	173.6	0	0	0	0	112	A300 S301 G306 I325 L366 A400 E402	A300-V304 WeakPolarHBondContact O-CG2 3.4Å; A300-V304 PolarHBondContact O-N 2.95Å; S301-V304 PolarHBondContact O-N 2.9Å; V304-G306 PolarHBondContact O-N 3.45Å; V304-I325 HydrophobicContact CG2-CB 3.6Å; V304-I325 HydrophobicContact CG2-CG1 4.14Å; V304-I325 HydrophobicContact CG2-CG2 3.68Å; V304-L366 HydrophobicContact CB-CB 4.42Å; V304-L366 HydrophobicContact CG1-CB 4.4Å; V304-L366 HydrophobicContact CG2-CB 3.9Å; V304-A400 VanDerWaalsContact O-CB 3.31Å; V304-A400 WeakPolarHBondContact O-CB 3.31Å; V304-E402 VanDerWaalsContact CG1-CA 3.41Å; V304-E402 HydrophobicContact CG1-CB 3.67Å; V304-E402 HydrophobicContact CG1-CG 3.88Å
305	R	92	Very high	93.4	Very high	44 Å²	44	30.6 Å²	30.6	17%	0.166	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-11.2	169.9	-75.8	-76	173.7	115.5	-4.8	113.3	S301 L303 I307 R354 P355 E402	S301-R305 VanDerWaalsContact O-CB 3.3Å; S301-R305 WeakPolarHBondContact O-CB 3.4Å; S301-R305 VanDerWaalsContact O-CG 3.31Å; S301-R305 WeakPolarHBondContact O-CG 3.45Å; S301-R305 PolarHBondContact O-N 3.09Å; L303-R305 VanDerWaalsContact C-N 3.28Å; L303-R305 PolarHBondContact O-N 2.87Å; R305-I307 HydrophobicContact CB-CD1 4.12Å; R305-I307 HydrophobicContact CB-CG1 4.24Å; R305-I307 PolarHBondContact O-N 3.42Å; R305-R354 VanDerWaalsContact O-CZ 3.28Å; R305-R354 PolarHBondContact O-NE 2.9Å; R305-R354 PolarHBondContact O-NH2 2.86Å; R305-P355 PolarHBondContact NH1-O 3.45Å; R305-E402 IonicContact CZ-OE2 2.69Å; R305-E402 VanDerWaalsContact CZ-OE2 3.23Å; R305-E402 IonicContact NE-OE2 3.97Å; R305-E402 PolarHBondContact NE-OE2 3.39Å; R305-E402 IonicContact NH2-OE1 2.93Å; R305-E402 IonicContact NH2-OE2 3.73Å; R305-E402 PolarHBondContact NH2-OE2 2.93Å
306	G	90.9	Very high	93.1	Very high	12 Å²	12	33.1 Å²	33.1	12%	0.124	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	72	17.4	-178.1	0	0	0	0	0	114.1	L302 L303 V304	L302-G306 PolarHBondContact O-N 2.83Å; L303-G306 WeakPolarHBondContact O-CA 3.08Å; L303-G306 PolarHBondContact O-N 2.8Å; V304-G306 PolarHBondContact O-N 3.45Å
307	I	91.7	Very high	92.9	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.138	C	C	.	.	S	Bend	trans	-76.2	-50.9	170.2	-64	165.8	0	0	0	108.1	L302 R305 Y344 Y348 L352 Y356	L302-I307 HydrophobicContact CB-CB 4.45Å; L302-I307 HydrophobicContact CD2-CB 4.32Å; L302-I307 HydrophobicContact CD2-CD1 3.77Å; L302-I307 HydrophobicContact CD2-CG2 4.29Å; L302-I307 PolarHBondContact O-N 2.85Å; R305-I307 HydrophobicContact CB-CD1 4.12Å; R305-I307 HydrophobicContact CB-CG1 4.24Å; R305-I307 PolarHBondContact O-N 3.42Å; I307-Y344 HydrophobicContact CG2-CD1 4.28Å; I307-Y344 HydrophobicContact CG2-CD2 4.24Å; I307-Y344 HydrophobicContact CG2-CG 3.85Å; I307-Y348 VanDerWaalsContact O-CE2 3.28Å; I307-Y348 WeakPolarHBondContact O-CE2 3.45Å; I307-L352 HydrophobicContact CG2-CD2 4.04Å; I307-Y356 HydrophobicContact CD1-CD1 3.7Å; I307-Y356 HydrophobicContact CD1-CE1 3.82Å; I307-Y356 HydrophobicContact CD1-CG 4.31Å; I307-Y356 HydrophobicContact CG2-CE1 4.32Å
308	K	92.6	Very high	92.7	Very high	12 Å²	12	33.2 Å²	33.2	5%	0.052	17%	0.169	C	C	.	.			trans	-80.3	128.7	170.6	-167.5	175.8	-176	40.3	0	108.7	Y299 L302 L303 F310 E311 Y344 E388	Y299-K308 HydrophobicContact CD1-CD 3.89Å; L302-K308 HydrophobicContact CB-CB 4.04Å; L302-K308 PolarHBondContact O-N 3.02Å; L302-K308 VanDerWaalsContact O-N 3.07Å; L303-K308 HydrophobicContact CB-CB 4.24Å; L303-K308 HydrophobicContact CD1-CB 4.01Å; L303-K308 HydrophobicContact CD1-CD 4.21Å; L303-K308 HydrophobicContact CD1-CG 3.93Å; L303-K308 WeakPolarHBondContact CD1-O 3.15Å; K308-F310 WeakPolarHBondContact CE-O 3.47Å; K308-F310 PolarHBondContact NZ-O 2.87Å; K308-E311 WeakPolarHBondContact CE-OE2 3.44Å; K308-Y344 WeakPolarHBondContact CG-OH 3.46Å; K308-Y344 PolarHBondContact NZ-OH 2.92Å; K308-E388 WeakPolarHBondContact CG-OE1 3.29Å; K308-E388 IonicContact NZ-OE1 3.23Å; K308-E388 PolarHBondContact NZ-OE1 2.82Å
309	R	91.7	Very high	92.4	Very high	106 Å²	106	34 Å²	34	40%	0.4	17%	0.172	S	C	.	.			trans	-113.2	-21.2	-180	-58.8	-176.9	-163.5	176.3	7	112.8	E388 C397	R309-E388 PolarHBondContact N-OE1 3.35Å; R309-C397 WeakPolarHBondContact O-CB 3.43Å; R309-C397 PolarHBondContact O-N 3.26Å
310	F	94.6	Very high	92.2	Very high	18 Å²	18	31.9 Å²	31.9	8%	0.079	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	119.3	-173	-52.1	-69.3	0	0	0	109.8	K308 Y380 Y384 E388 V394 L395 I396	K308-F310 WeakPolarHBondContact CE-O 3.47Å; K308-F310 PolarHBondContact NZ-O 2.87Å; F310-Y380 HydrophobicContact CB-CE2 4.2Å; F310-Y380 WeakPolarHBondContact CB-OH 3.5Å; F310-Y380 AromaticContact CD1-CE2 3.52Å; F310-Y380 HydrophobicContact CD1-CE2 3.52Å; F310-Y380 HydrophobicContact CD2-CE2 4.24Å; F310-Y380 WeakPolarHBondContact CD2-OH 3.4Å; F310-Y380 AromaticContact CE1-CE2 3.82Å; F310-Y380 HydrophobicContact CE1-CE2 3.82Å; F310-Y380 HydrophobicContact CE2-CE2 4.49Å; F310-Y380 AromaticContact CG-CE2 3.73Å; F310-Y380 HydrophobicContact CG-CE2 3.73Å; F310-Y380 AromaticContact CG-CZ 3.86Å; F310-Y380 WeakPolarHBondContact CG-OH 3.28Å; F310-Y380 HydrophobicContact CZ-CE2 4.29Å; F310-Y384 HydrophobicContact CE1-CD1 4.01Å; F310-Y384 AromaticContact CE1-CD2 3.89Å; F310-Y384 HydrophobicContact CE1-CD2 3.89Å; F310-Y384 HydrophobicContact CE1-CE1 4.01Å; F310-Y384 AromaticContact CE1-CE2 3.9Å; F310-Y384 HydrophobicContact CE1-CE2 3.9Å; F310-Y384 AromaticContact CE1-CG 3.94Å; F310-Y384 HydrophobicContact CE1-CG 3.94Å; F310-Y384 AromaticContact CE1-CZ 3.95Å; F310-Y384 HydrophobicContact CE2-CD1 4.47Å; F310-Y384 AromaticContact CZ-CD1 3.5Å; F310-Y384 HydrophobicContact CZ-CD1 3.5Å; F310-Y384 VanDerWaalsContact CZ-CD1 3.5Å; F310-Y384 HydrophobicContact CZ-CD2 4.17Å; F310-Y384 AromaticContact CZ-CE1 3.74Å; F310-Y384 HydrophobicContact CZ-CE1 3.74Å; F310-Y384 HydrophobicContact CZ-CE2 4.38Å; F310-Y384 AromaticContact CZ-CG 3.72Å; F310-Y384 HydrophobicContact CZ-CG 3.72Å; F310-E388 HydrophobicContact CB-CG 3.96Å; F310-E388 HydrophobicContact CD2-CG 3.89Å; F310-E388 HydrophobicContact CG-CG 4.43Å; F310-E388 PolarHBondContact N-OE1 3.32Å; F310-V394 HydrophobicContact CB-CG1 3.72Å; F310-L395 WeakPolarHBondContact CA-O 3.26Å; F310-I396 HydrophobicContact CD1-CG1 4.25Å; F310-I396 HydrophobicContact CE1-CG1 4.37Å; F310-I396 HydrophobicContact CE1-CG2 4.32Å
311	E	94.9	Very high	92.1	Very high	15 Å²	15	32 Å²	32	7%	0.07	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.6	179.4	174.3	55.8	-164.3	0	0	110.8	L293 L295 L303 K308 R313 L395	L293-E311 HydrophobicContact CD2-CG 4.37Å; L295-E311 HydrophobicContact CD2-CG 4.04Å; L295-E311 WeakPolarHBondContact CD2-OE1 3.42Å; L303-E311 HydrophobicContact CD1-CB 4.38Å; K308-E311 WeakPolarHBondContact CE-OE2 3.44Å; E311-R313 IonicContact OE1-CZ 2.83Å; E311-R313 IonicContact OE1-NE 3.85Å; E311-R313 PolarHBondContact OE1-NE 2.98Å; E311-R313 IonicContact OE1-NH2 2.9Å; E311-L395 HydrophobicContact CB-CB 4.31Å; E311-L395 PolarHBondContact N-O 3.4Å; E311-L395 WeakPolarHBondContact O-CD1 3.4Å; E311-L395 PolarHBondContact O-N 3.37Å
312	G	94	Very high	92	Very high	12 Å²	12	33.5 Å²	33.5	12%	0.124	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131.1	-176	0	0	0	0	0	113.2	S389 S391 Y393	G312-S389 VanDerWaalsContact CA-OG 3.26Å; G312-S389 WeakPolarHBondContact CA-OG 3.27Å; G312-S391 VanDerWaalsContact C-OG 3.29Å; G312-S391 WeakPolarHBondContact CA-OG 3.38Å; G312-S391 PolarHBondContact O-OG 2.69Å; G312-Y393 CarbonylContact C-O 3.6Å
313	R	93.4	Very high	92	Very high	51 Å²	51	33.6 Å²	33.6	19%	0.192	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	158.6	178.1	-64.5	-62.2	179.9	145.7	15	112.3	S294 E311 W315 P392 Y393 L395	S294-R313 PolarHBondContact O-NH2 3.06Å; E311-R313 IonicContact OE1-CZ 2.83Å; E311-R313 IonicContact OE1-NE 3.85Å; E311-R313 PolarHBondContact OE1-NE 2.98Å; E311-R313 IonicContact OE1-NH2 2.9Å; R313-W315 VanDerWaalsContact C-N 3.25Å; R313-W315 HydrophobicContact CB-CZ2 4.45Å; R313-W315 HydrophobicContact CG-CZ2 4.12Å; R313-W315 PolarHBondContact O-N 3.37Å; R313-P392 WeakPolarHBondContact O-CD 3.33Å; R313-P392 WeakPolarHBondContact O-CG 3.29Å; R313-Y393 PolarHBondContact N-O 3.27Å; R313-Y393 PolarHBondContact O-N 3.38Å; R313-Y393 VanDerWaalsContact O-N 3.1Å; R313-L395 HydrophobicContact CB-CD1 4.3Å; R313-L395 HydrophobicContact CG-CD1 3.97Å
314	S	90.5	Very high	92.1	Very high	98 Å²	98	33.7 Å²	33.7	69%	0.685	17%	0.174	S	C	*	.	S	Bend	trans	-80.6	-3	175.5	57.7	0	0	0	0	114
315	W	89.6	Confident	92.2	Very high	51 Å²	51	33.6 Å²	33.6	19%	0.193	17%	0.174	C	C	.	.	S	Bend	trans	-135.1	142.4	-174.7	52.3	-86.4	0	0	0	110.1	L293 R313 Y393 K414 I415	L293-W315 HydrophobicContact CD1-CH2 4.32Å; L293-W315 HydrophobicContact CD1-CZ2 4.01Å; R313-W315 VanDerWaalsContact C-N 3.25Å; R313-W315 HydrophobicContact CB-CZ2 4.45Å; R313-W315 HydrophobicContact CG-CZ2 4.12Å; R313-W315 PolarHBondContact O-N 3.37Å; W315-Y393 VanDerWaalsContact C-CD2 3.44Å; W315-K414 HydrophobicContact CZ2-CB 4.42Å; W315-I415 HydrophobicContact CH2-CD1 3.62Å; W315-I415 HydrophobicContact CH2-CG1 3.65Å; W315-I415 HydrophobicContact CZ3-CD1 3.85Å; W315-I415 HydrophobicContact CZ3-CG1 4.25Å
316	Y	89.9	Confident	92.5	Very high	59 Å²	59	31.5 Å²	31.5	23%	0.231	17%	0.166	C	C	.	.			trans	-75.3	145.7	177.4	179.6	-95.5	0	0	0	111.7	Y196 R320 C374 Y393	Y196-Y316 AromaticContact CD1-CD1 3.4Å; Y196-Y316 HydrophobicContact CD1-CD1 3.4Å; Y196-Y316 HydrophobicContact CD1-CD2 4.16Å; Y196-Y316 AromaticContact CD1-CE1 3.47Å; Y196-Y316 HydrophobicContact CD1-CE1 3.47Å; Y196-Y316 VanDerWaalsContact CD1-CE1 3.47Å; Y196-Y316 HydrophobicContact CD1-CE2 4.21Å; Y196-Y316 AromaticContact CD1-CG 3.76Å; Y196-Y316 HydrophobicContact CD1-CG 3.76Å; Y196-Y316 AromaticContact CD1-CZ 3.9Å; Y196-Y316 HydrophobicContact CD2-CD1 4.11Å; Y196-Y316 HydrophobicContact CD2-CG 4.08Å; Y196-Y316 AromaticContact CE1-CD1 3.44Å; Y196-Y316 HydrophobicContact CE1-CD1 3.44Å; Y196-Y316 VanDerWaalsContact CE1-CD1 3.44Å; Y196-Y316 AromaticContact CE1-CE1 3.47Å; Y196-Y316 HydrophobicContact CE1-CE1 3.47Å; Y196-Y316 VanDerWaalsContact CE1-CE1 3.47Å; Y196-Y316 HydrophobicContact CE1-CG 4.24Å; Y196-Y316 HydrophobicContact CE2-CD1 4.12Å; Y196-Y316 HydrophobicContact CE2-CG 4.5Å; Y196-Y316 AromaticContact CG-CD1 3.75Å; Y196-Y316 HydrophobicContact CG-CD1 3.75Å; Y196-Y316 HydrophobicContact CG-CD2 4.12Å; Y196-Y316 HydrophobicContact CG-CE1 4.26Å; Y196-Y316 AromaticContact CG-CG 3.67Å; Y196-Y316 HydrophobicContact CG-CG 3.67Å; Y196-Y316 AromaticContact CZ-CD1 3.8Å; Y316-R320 PolarHBondContact OH-NH2 3.37Å; Y316-R320 VanDerWaalsContact OH-NH2 3.1Å; Y316-C374 HydrophobicContact CD2-CB 4.36Å; Y316-C374 HydrophobicContact CE2-CB 4.01Å; Y316-C374 WeakPolarHBondContact CE2-O 3.43Å; Y316-Y393 AromaticContact CD2-CD1 3.76Å; Y316-Y393 HydrophobicContact CD2-CD1 3.76Å; Y316-Y393 AromaticContact CD2-CE1 3.98Å; Y316-Y393 HydrophobicContact CD2-CE1 3.98Å; Y316-Y393 HydrophobicContact CG-CD1 4.31Å; Y316-Y393 HydrophobicContact CG-CE1 4.33Å
317	T	90.1	Very high	92.7	Very high	14 Å²	14	31 Å²	31	9%	0.086	16%	0.16	C	C	.	.			trans	-125	136.1	168.2	-165.9	0	0	0	0	112	H319 R320 C374 L395 I415	T317-H319 VanDerWaalsContact C-N 3.29Å; T317-H319 HydrophobicContact CG2-CB 4.42Å; T317-H319 WeakPolarHBondContact OG1-CB 3.41Å; T317-H319 PolarHBondContact OG1-N 3.34Å; T317-R320 PolarHBondContact O-NH1 2.85Å; T317-C374 HydrophobicContact CG2-CB 4Å; T317-C374 VanDerWaalsContact O-CB 3.28Å; T317-C374 WeakPolarHBondContact O-CB 3.28Å; T317-L395 HydrophobicContact CG2-CD2 3.76Å; T317-L395 HydrophobicContact CG2-CG 4.01Å; T317-I415 HydrophobicContact CG2-CD1 4.29Å; T317-I415 WeakPolarHBondContact OG1-CD1 3.34Å
318	S	89	Confident	92.9	Very high	98 Å²	98	32 Å²	32	69%	0.685	17%	0.166	S	C	*	.			trans	-85.9	-0.5	168.4	55.7	0	0	0	0	112.9	R320	S318-R320 PolarHBondContact O-N 3.15Å; S318-R320 PolarHBondContact O-NH1 3.22Å
319	H	89.5	Confident	92.9	Very high	20 Å²	20	38 Å²	38	9%	0.093	19%	0.192	C	C	.	.			trans	-66.7	129.8	-179.1	-176.4	-90	0	0	0	111.4	L291 T317 V322 V371 I415	L291-H319 WeakPolarHBondContact CD1-CD2 3.48Å; L291-H319 WeakPolarHBondContact CD1-NE2 3.42Å; T317-H319 VanDerWaalsContact C-N 3.29Å; T317-H319 HydrophobicContact CG2-CB 4.42Å; T317-H319 WeakPolarHBondContact OG1-CB 3.41Å; T317-H319 PolarHBondContact OG1-N 3.34Å; H319-V322 PolarHBondContact CE1-O 3.42Å; H319-V371 WeakPolarHBondContact O-CG1 3.39Å; H319-I415 HydrophobicContact CB-CD1 4.26Å
320	R	91.1	Very high	93	Very high	48 Å²	48	38.9 Å²	38.9	18%	0.181	20%	0.199	C	C	.	.			trans	-132.6	144.9	175.3	-56.3	-63.1	179.6	-87.5	0.7	108.8	N285 Y316 T317 S318 V371 V372 D373 C374	N285-R320 WeakPolarHBondContact OD1-CB 3.47Å; Y316-R320 PolarHBondContact OH-NH2 3.37Å; Y316-R320 VanDerWaalsContact OH-NH2 3.1Å; T317-R320 PolarHBondContact O-NH1 2.85Å; S318-R320 PolarHBondContact O-N 3.15Å; S318-R320 PolarHBondContact O-NH1 3.22Å; R320-V371 WeakPolarHBondContact CA-O 3.11Å; R320-V372 VanDerWaalsContact CD-O 3.26Å; R320-V372 WeakPolarHBondContact CD-O 3.38Å; R320-D373 IonicContact CZ-OD1 3.94Å; R320-D373 IonicContact NE-OD1 3.79Å; R320-D373 PolarHBondContact NE-OD1 3.39Å; R320-D373 IonicContact NH2-OD1 2.73Å; R320-D373 PolarHBondContact NH2-OD1 3.48Å; R320-C374 VanDerWaalsContact NH2-N 3.15Å
321	G	91.6	Very high	92.9	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.9	-155.2	-172.7	0	0	0	0	0	113.6	L323 V371	G321-L323 PolarHBondContact O-N 3.08Å; G321-V371 PolarHBondContact N-O 3.07Å; G321-V371 PolarHBondContact O-N 3.47Å
322	V	92.7	Very high	92.8	Very high	41 Å²	41	44.8 Å²	44.8	25%	0.248	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	124.7	-170.5	-177.1	0	0	0	0	112.3	D288 H319 C368	D288-V322 HydrophobicContact CB-CB 4.36Å; H319-V322 PolarHBondContact CE1-O 3.42Å; V322-C368 HydrophobicContact CG1-CB 3.89Å
323	L	94.9	Very high	92.8	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.5	174.9	-175.4	64.9	0	0	0	110	L291 L293 G321 I325 C368 V369 V371 L395 I415	L291-L323 HydrophobicContact CB-CD1 4.26Å; L293-L323 HydrophobicContact CB-CD1 4.25Å; L293-L323 HydrophobicContact CB-CD2 3.92Å; L293-L323 HydrophobicContact CB-CG 4.2Å; L293-L323 HydrophobicContact CD2-CD2 4.11Å; G321-L323 PolarHBondContact O-N 3.08Å; L323-I325 HydrophobicContact CD2-CD1 4.42Å; L323-I325 HydrophobicContact CG-CD1 4.4Å; L323-C368 WeakPolarHBondContact O-CA 3.49Å; L323-V369 HydrophobicContact CB-CG2 4.26Å; L323-V369 PolarHBondContact N-O 3Å; L323-V369 PolarHBondContact O-N 3.29Å; L323-V371 HydrophobicContact CB-CG2 3.65Å; L323-V371 HydrophobicContact CD2-CG2 3.62Å; L323-V371 HydrophobicContact CG-CG2 4.28Å; L323-L395 HydrophobicContact CD2-CD2 4.35Å; L323-I415 HydrophobicContact CD1-CD1 4.45Å; L323-I415 HydrophobicContact CD1-CG1 4.23Å; L323-I415 HydrophobicContact CD1-CG2 4.33Å
324	W	96	Very high	92.7	Very high	3 Å²	3	50.4 Å²	50.4	1%	0.011	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	141.3	177.2	-69.6	88.8	0	0	0	111.2	D288 L291 C292 L293 L365 C368 L403 L418 H423 A426 A427 I430	D288-W324 PolarHBondContact OD1-NE1 2.87Å; D288-W324 PolarHBondContact OD2-NE1 3Å; L291-W324 WeakPolarHBondContact O-CB 3.29Å; L291-W324 PolarHBondContact O-N 3.28Å; C292-W324 CarbonylContact C-O 3.59Å; C292-W324 WeakPolarHBondContact CA-O 3.35Å; C292-W324 HydrophobicContact CB-CB 3.85Å; C292-W324 PolarHBondContact SG-O 2.92Å; L293-W324 PolarHBondContact N-O 3.4Å; W324-L365 HydrophobicContact CB-CD1 4.07Å; W324-L365 HydrophobicContact CE3-CD1 4.2Å; W324-L365 HydrophobicContact CE3-CD2 3.91Å; W324-L365 HydrophobicContact CE3-CG 4.29Å; W324-L365 HydrophobicContact CZ3-CD2 4.3Å; W324-C368 HydrophobicContact CD2-CB 3.99Å; W324-C368 HydrophobicContact CE3-CB 3.88Å; W324-C368 HydrophobicContact CG-CB 4.49Å; W324-C368 HydrophobicContact CH2-CB 4.46Å; W324-C368 HydrophobicContact CZ3-CB 4.11Å; W324-L403 HydrophobicContact CE3-CD1 4.5Å; W324-L403 HydrophobicContact CZ3-CD1 3.96Å; W324-L403 HydrophobicContact CZ3-CD2 4.16Å; W324-L403 HydrophobicContact CZ3-CG 4.21Å; W324-L418 HydrophobicContact CB-CD1 3.7Å; W324-L418 HydrophobicContact CD2-CD1 4.08Å; W324-L418 HydrophobicContact CG-CD1 3.6Å; W324-H423 AromaticContact CE2-CD2 3.77Å; W324-H423 AromaticContact CZ2-CD2 3.87Å; W324-H423 AromaticContact NE1-CD2 3.46Å; W324-H423 PolarHBondContact NE1-CD2 3.05Å; W324-H423 AromaticContact NE1-NE2 3.71Å; W324-A426 HydrophobicContact CE3-CB 4.26Å; W324-A426 HydrophobicContact CH2-CB 3.45Å; W324-A426 VanDerWaalsContact CH2-CB 3.45Å; W324-A426 HydrophobicContact CZ2-CB 4.25Å; W324-A426 HydrophobicContact CZ3-CB 3.47Å; W324-A426 VanDerWaalsContact CZ3-CB 3.47Å; W324-A427 HydrophobicContact CZ2-CB 4.35Å; W324-I430 HydrophobicContact CH2-CD1 3.53Å; W324-I430 HydrophobicContact CH2-CG1 4.35Å; W324-I430 HydrophobicContact CZ3-CD1 3.65Å
325	I	96.8	Very high	92.9	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.3	-175.5	-58.7	-59.1	0	0	0	110.6	L293 L295 A300 L303 V304 L323 L366 G367 V369	L293-I325 HydrophobicContact CB-CD1 4.28Å; L295-I325 HydrophobicContact CD1-CD1 4.12Å; L295-I325 HydrophobicContact CD1-CG2 3.69Å; L295-I325 HydrophobicContact CG-CG2 4.43Å; A300-I325 HydrophobicContact CB-CG2 4.42Å; L303-I325 HydrophobicContact CD2-CD1 3.75Å; L303-I325 HydrophobicContact CD2-CG1 4.01Å; V304-I325 HydrophobicContact CG2-CB 3.6Å; V304-I325 HydrophobicContact CG2-CG1 4.14Å; V304-I325 HydrophobicContact CG2-CG2 3.68Å; L323-I325 HydrophobicContact CD2-CD1 4.42Å; L323-I325 HydrophobicContact CG-CD1 4.4Å; I325-L366 PolarHBondContact O-N 3.43Å; I325-G367 PolarHBondContact N-O 3.31Å; I325-G367 PolarHBondContact O-N 3.5Å; I325-V369 HydrophobicContact CD1-CG2 3.85Å; I325-V369 HydrophobicContact CG1-CG1 4.01Å; I325-V369 HydrophobicContact CG1-CG2 3.79Å
326	A	96.7	Very high	93	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	142	177.9	0	0	0	0	0	111.8	L293 S294 L295 C364 L365 I409	L293-A326 PolarHBondContact O-N 2.99Å; S294-A326 CarbonylContact C-O 3.58Å; S294-A326 WeakPolarHBondContact CA-O 3.46Å; L295-A326 PolarHBondContact N-O 2.91Å; A326-C364 CarbonylContact C-O 3.53Å; A326-C364 WeakPolarHBondContact CA-O 3.46Å; A326-L365 HydrophobicContact CB-CD1 4.44Å; A326-I409 HydrophobicContact CB-CD1 3.31Å; A326-I409 HydrophobicContact CB-CG1 4Å
327	A	96.1	Very high	93.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	127.3	168.3	0	0	0	0	0	110.3	Q297 A300 P361 G363 C364 L366	Q297-A327 HydrophobicContact CG-CB 4.04Å; A300-A327 HydrophobicContact CB-CB 4.35Å; A327-P361 WeakPolarHBondContact CB-O 3.42Å; A327-G363 VanDerWaalsContact O-CA 3.25Å; A327-G363 WeakPolarHBondContact O-CA 3.36Å; A327-G363 PolarHBondContact O-N 3.42Å; A327-C364 PolarHBondContact N-O 3.44Å; A327-L366 HydrophobicContact CB-CD1 4.08Å; A327-L366 HydrophobicContact CB-CD2 4.38Å; A327-L366 HydrophobicContact CB-CG 4.22Å
328	T	95.3	Very high	93.3	Very high	22 Å²	22	53.9 Å²	53.9	14%	0.135	29%	0.288	C	S	.	.			trans	-64.4	172.1	169.1	59.9	0	0	0	0	111.5	L295 H296 K330 V362 G363	L295-T328 VanDerWaalsContact O-CG2 3.28Å; L295-T328 WeakPolarHBondContact O-CG2 3.38Å; L295-T328 PolarHBondContact O-N 3.46Å; L295-T328 PolarHBondContact O-OG1 3.31Å; L295-T328 VanDerWaalsContact O-OG1 3.1Å; H296-T328 WeakPolarHBondContact CA-OG1 3.28Å; H296-T328 PolarHBondContact ND1-OG1 2.83Å; T328-K330 PolarHBondContact O-N 3.06Å; T328-V362 WeakPolarHBondContact O-CA 3.42Å; T328-V362 VanDerWaalsContact O-CB 3.31Å; T328-V362 WeakPolarHBondContact O-CB 3.27Å; T328-G363 PolarHBondContact O-N 3.02Å; T328-G363 VanDerWaalsContact O-N 3.12Å
329	K	93.4	Very high	93.5	Very high	138 Å²	138	52.8 Å²	52.8	60%	0.6	28%	0.28	S	S	*	.	S	Bend	trans	-74.3	-6.4	177.7	-63.5	-173.4	177.6	-172.6	0	114.3	I331	K329-I331 PolarHBondContact O-N 3.37Å
330	K	93.3	Very high	93.6	Very high	125 Å²	125	53.2 Å²	53.2	54%	0.543	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-73.1	117.6	-177.7	-175.2	-179.6	177.5	-175.4	0	109.7	T328 V362	T328-K330 PolarHBondContact O-N 3.06Å; K330-V362 WeakPolarHBondContact O-CG1 3.27Å
331	I	92.2	Very high	93.6	Very high	137 Å²	137	52.3 Å²	52.3	70%	0.703	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-73.2	127.9	175.5	-58.7	167.5	0	0	0	108.2	K329 V362	K329-I331 PolarHBondContact O-N 3.37Å; I331-V362 HydrophobicContact CG1-CG1 4.41Å; I331-V362 HydrophobicContact CG1-CG2 4.45Å
332	P	92.4	Very high	93.6	Very high	20 Å²	20	55.2 Å²	55.2	13%	0.13	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-73.5	143.4	178.2	32.2	-34.7	0	0	0	110.4	Q297 V337	Q297-P332 HydrophobicContact CB-CB 4.04Å; Q297-P332 HydrophobicContact CB-CG 3.85Å; P332-V337 HydrophobicContact CB-CG2 3.77Å; P332-V337 HydrophobicContact CG-CG2 4.15Å
333	S	93.6	Very high	93.5	Very high	50 Å²	50	57.8 Å²	57.8	35%	0.35	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-78.4	143	169.8	83.4	0	0	0	0	109.6	N335 D336 V337	S333-N335 PolarHBondContact O-N 2.99Å; S333-D336 WeakPolarHBondContact CB-OD2 3.07Å; S333-D336 PolarHBondContact O-N 2.97Å; S333-D336 VanDerWaalsContact O-N 3.07Å; S333-D336 WeakPolarHBondContact OG-CB 3.36Å; S333-D336 PolarHBondContact OG-N 2.98Å; S333-D336 PolarHBondContact OG-OD1 3.25Å; S333-D336 PolarHBondContact OG-OD2 2.93Å; S333-V337 WeakPolarHBondContact O-CG2 2.94Å; S333-V337 PolarHBondContact O-N 3.46Å
334	N	92.4	Very high	93.3	Very high	132 Å²	132	57.9 Å²	57.9	71%	0.706	31%	0.305	S	S	*	.	H	α-helix	trans	-59.4	-31.5	-179.4	-77.1	-13.7	0	0	0	112.8	T338	N334-T338 WeakPolarHBondContact O-CB 3.43Å; N334-T338 PolarHBondContact O-N 3.39Å; N334-T338 PolarHBondContact O-OG1 3.33Å
335	N	93.6	Very high	93	Very high	127 Å²	127	61.6 Å²	61.6	68%	0.679	32%	0.319	S	S	*	.	H	α-helix	trans	-67.2	-42.6	176.2	-68.6	-6.3	0	0	0	111.4	S333 V337 T338 S339	S333-N335 PolarHBondContact O-N 2.99Å; N335-V337 VanDerWaalsContact C-N 3.34Å; N335-T338 PolarHBondContact O-N 3.38Å; N335-S339 VanDerWaalsContact O-CB 3.31Å; N335-S339 WeakPolarHBondContact O-CB 3.38Å; N335-S339 PolarHBondContact O-N 2.61Å; N335-S339 PolarHBondContact O-OG 3.1Å
336	D	91.9	Very high	92.5	Very high	83 Å²	83	68.4 Å²	68.4	44%	0.444	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.4	-62.3	-30.1	0	0	0	111	S333 L340	S333-D336 WeakPolarHBondContact CB-OD2 3.07Å; S333-D336 PolarHBondContact O-N 2.97Å; S333-D336 VanDerWaalsContact O-N 3.07Å; S333-D336 WeakPolarHBondContact OG-CB 3.36Å; S333-D336 PolarHBondContact OG-N 2.98Å; S333-D336 PolarHBondContact OG-OD1 3.25Å; S333-D336 PolarHBondContact OG-OD2 2.93Å; D336-L340 WeakPolarHBondContact O-CB 3.31Å; D336-L340 VanDerWaalsContact O-CG 3.29Å; D336-L340 WeakPolarHBondContact O-CG 3.39Å; D336-L340 PolarHBondContact O-N 3.02Å
337	V	93.5	Very high	92.1	Very high	13 Å²	13	71.3 Å²	71.3	8%	0.079	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-55.1	176.1	177.7	0	0	0	0	110.3	P298 P332 S333 N335 S339 L340 E341 Y360	P298-V337 HydrophobicContact CB-CG2 4.2Å; P298-V337 HydrophobicContact CG-CG2 4.3Å; P332-V337 HydrophobicContact CB-CG2 3.77Å; P332-V337 HydrophobicContact CG-CG2 4.15Å; S333-V337 WeakPolarHBondContact O-CG2 2.94Å; S333-V337 PolarHBondContact O-N 3.46Å; N335-V337 VanDerWaalsContact C-N 3.34Å; V337-S339 VanDerWaalsContact C-N 3.29Å; V337-S339 PolarHBondContact O-N 3.03Å; V337-L340 PolarHBondContact O-N 2.89Å; V337-E341 HydrophobicContact CG1-CG 4.27Å; V337-E341 WeakPolarHBondContact O-CG 2.92Å; V337-E341 PolarHBondContact O-N 3.07Å; V337-Y360 HydrophobicContact CG1-CD2 4.12Å; V337-Y360 HydrophobicContact CG1-CE2 3.36Å; V337-Y360 HydrophobicContact CG2-CD2 4.33Å; V337-Y360 HydrophobicContact CG2-CE2 4.33Å
338	T	93	Very high	91.5	Very high	72 Å²	72	72.8 Å²	72.8	44%	0.442	37%	0.371	S	S	.	.	H	α-helix	trans	-59.1	-42.6	-178.1	-50.8	0	0	0	0	111.5	N334 N335 E341 N342	N334-T338 WeakPolarHBondContact O-CB 3.43Å; N334-T338 PolarHBondContact O-N 3.39Å; N334-T338 PolarHBondContact O-OG1 3.33Å; N335-T338 PolarHBondContact O-N 3.38Å; T338-E341 PolarHBondContact O-N 3.08Å; T338-N342 WeakPolarHBondContact O-CB 3.22Å; T338-N342 VanDerWaalsContact O-CG 3.23Å; T338-N342 PolarHBondContact O-N 2.83Å; T338-N342 PolarHBondContact O-ND2 3.47Å
339	S	93.5	Very high	90.7	Very high	75 Å²	75	78.4 Å²	78.4	52%	0.524	40%	0.4	S	S	.	.	H	α-helix	trans	-63.9	-43.8	179.2	-57	0	0	0	0	111.7	N335 V337 N342 F343	N335-S339 VanDerWaalsContact O-CB 3.31Å; N335-S339 WeakPolarHBondContact O-CB 3.38Å; N335-S339 PolarHBondContact O-N 2.61Å; N335-S339 PolarHBondContact O-OG 3.1Å; V337-S339 VanDerWaalsContact C-N 3.29Å; V337-S339 PolarHBondContact O-N 3.03Å; S339-N342 PolarHBondContact O-N 3.22Å; S339-F343 WeakPolarHBondContact O-CB 3.44Å; S339-F343 PolarHBondContact O-N 2.92Å
340	L	91.8	Very high	89.7	Confident	28 Å²	28	77.5 Å²	77.5	15%	0.147	40%	0.402	C	S	.	.	H	α-helix	trans	-71.1	-38.9	178.9	-73.7	171.3	0	0	0	112.5	P298 Y299 D336 V337 F343 Y344	P298-L340 HydrophobicContact CG-CB 4.3Å; P298-L340 HydrophobicContact CG-CD1 3.37Å; P298-L340 HydrophobicContact CG-CG 4.45Å; Y299-L340 HydrophobicContact CD1-CD1 4.44Å; Y299-L340 HydrophobicContact CE1-CD1 3.84Å; Y299-L340 HydrophobicContact CE1-CD2 3.75Å; Y299-L340 HydrophobicContact CE1-CG 4.44Å; Y299-L340 HydrophobicContact CE2-CD1 4.06Å; Y299-L340 WeakPolarHBondContact OH-CD2 3.35Å; D336-L340 WeakPolarHBondContact O-CB 3.31Å; D336-L340 VanDerWaalsContact O-CG 3.29Å; D336-L340 WeakPolarHBondContact O-CG 3.39Å; D336-L340 PolarHBondContact O-N 3.02Å; V337-L340 PolarHBondContact O-N 2.89Å; L340-F343 WeakPolarHBondContact O-CB 2.94Å; L340-F343 PolarHBondContact O-N 2.94Å; L340-Y344 WeakPolarHBondContact O-CD2 3.41Å; L340-Y344 PolarHBondContact O-N 3.4Å
341	E	91.5	Very high	88.9	Confident	29 Å²	29	75.6 Å²	75.6	14%	0.136	41%	0.405	C	S	.	.	H	α-helix	trans	-59.3	-49	172.8	-70.8	-172.5	-179.4	0	0	110.7	V337 T338 F343 Y344 R345 Y356 Y360	V337-E341 HydrophobicContact CG1-CG 4.27Å; V337-E341 WeakPolarHBondContact O-CG 2.92Å; V337-E341 PolarHBondContact O-N 3.07Å; T338-E341 PolarHBondContact O-N 3.08Å; E341-F343 VanDerWaalsContact C-N 3.33Å; E341-F343 PolarHBondContact O-N 2.92Å; E341-Y344 PolarHBondContact O-N 3.39Å; E341-R345 WeakPolarHBondContact O-CG 3.39Å; E341-R345 PolarHBondContact O-N 3.42Å; E341-R345 IonicContact OE2-CZ 3.63Å; E341-R345 IonicContact OE2-NH2 3.21Å; E341-R345 PolarHBondContact OE2-NH2 3.47Å; E341-Y356 HydrophobicContact CB-CD1 4.2Å; E341-Y356 HydrophobicContact CB-CE1 3.85Å; E341-Y356 HydrophobicContact CG-CD1 3.56Å; E341-Y356 HydrophobicContact CG-CE1 3.65Å; E341-Y356 HydrophobicContact CG-CG 4.24Å; E341-Y356 PolarHBondContact O-OH 3.18Å; E341-Y360 PolarHBondContact OE1-OH 3.12Å
342	N	91.3	Very high	88.1	Confident	62 Å²	62	71 Å²	71	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-59.6	-43.9	176.6	-72.1	-19.7	0	0	0	111.4	T338 S339 Y344 R345 H346	T338-N342 WeakPolarHBondContact O-CB 3.22Å; T338-N342 VanDerWaalsContact O-CG 3.23Å; T338-N342 PolarHBondContact O-N 2.83Å; T338-N342 PolarHBondContact O-ND2 3.47Å; S339-N342 PolarHBondContact O-N 3.22Å; N342-Y344 VanDerWaalsContact C-N 3.35Å; N342-Y344 PolarHBondContact O-N 3Å; N342-R345 PolarHBondContact O-N 2.73Å; N342-R345 PolarHBondContact OD1-NH1 3.42Å; N342-R345 VanDerWaalsContact OD1-NH1 3.15Å; N342-H346 PolarHBondContact O-N 2.9Å; N342-H346 PolarHBondContact O-ND1 2.83Å
343	F	91.3	Very high	87	Confident	96 Å²	96	73.9 Å²	73.9	42%	0.421	40%	0.4	S	S	.	.	H	α-helix	trans	-54.4	-49.1	175.7	174.3	-95.8	0	0	0	112	S339 L340 E341 H346 L347 E388	S339-F343 WeakPolarHBondContact O-CB 3.44Å; S339-F343 PolarHBondContact O-N 2.92Å; L340-F343 WeakPolarHBondContact O-CB 2.94Å; L340-F343 PolarHBondContact O-N 2.94Å; E341-F343 VanDerWaalsContact C-N 3.33Å; E341-F343 PolarHBondContact O-N 2.92Å; F343-H346 PolarHBondContact O-N 3.18Å; F343-L347 HydrophobicContact CE1-CD2 4.28Å; F343-L347 WeakPolarHBondContact O-CB 3.35Å; F343-L347 PolarHBondContact O-N 2.83Å; F343-E388 HydrophobicContact CE1-CB 4.21Å
344	Y	89.7	Confident	86.1	Confident	3 Å²	3	76.5 Å²	76.5	1%	0.012	40%	0.402	C	S	.	.	H	α-helix	trans	-70.2	-31.1	178.6	-72.4	-64.3	0	0	0	113.6	L302 I307 K308 L340 E341 N342 H346 L347 Y348 E388	L302-Y344 HydrophobicContact CD1-CD2 3.85Å; L302-Y344 HydrophobicContact CD1-CE2 3.63Å; I307-Y344 HydrophobicContact CG2-CD1 4.28Å; I307-Y344 HydrophobicContact CG2-CD2 4.24Å; I307-Y344 HydrophobicContact CG2-CG 3.85Å; K308-Y344 WeakPolarHBondContact CG-OH 3.46Å; K308-Y344 PolarHBondContact NZ-OH 2.92Å; L340-Y344 WeakPolarHBondContact O-CD2 3.41Å; L340-Y344 PolarHBondContact O-N 3.4Å; E341-Y344 PolarHBondContact O-N 3.39Å; N342-Y344 VanDerWaalsContact C-N 3.35Å; N342-Y344 PolarHBondContact O-N 3Å; Y344-H346 VanDerWaalsContact C-N 3.34Å; Y344-L347 HydrophobicContact CD1-CD2 4.33Å; Y344-L347 PolarHBondContact O-N 3.3Å; Y344-Y348 HydrophobicContact CD1-CD2 4.35Å; Y344-Y348 AromaticContact CD1-CE2 3.82Å; Y344-Y348 HydrophobicContact CD1-CE2 3.82Å; Y344-Y348 WeakPolarHBondContact O-CD2 3.44Å; Y344-Y348 PolarHBondContact O-N 2.84Å; Y344-Y348 VanDerWaalsContact O-N 3.1Å; Y344-E388 HydrophobicContact CE1-CB 4.33Å; Y344-E388 HydrophobicContact CE1-CG 4.45Å; Y344-E388 VanDerWaalsContact CE1-OE2 3.27Å; Y344-E388 WeakPolarHBondContact CE1-OE2 3.43Å
345	R	88.9	Confident	85.8	Confident	81 Å²	81	74.9 Å²	74.9	31%	0.306	40%	0.399	S	S	.	.	H	α-helix	trans	-61.2	-44.7	172.1	-71.9	-179.6	-164.6	142.8	7.7	111.3	E341 N342 N349 D350 L352 Y356	E341-R345 WeakPolarHBondContact O-CG 3.39Å; E341-R345 PolarHBondContact O-N 3.42Å; E341-R345 IonicContact OE2-CZ 3.63Å; E341-R345 IonicContact OE2-NH2 3.21Å; E341-R345 PolarHBondContact OE2-NH2 3.47Å; N342-R345 PolarHBondContact O-N 2.73Å; N342-R345 PolarHBondContact OD1-NH1 3.42Å; N342-R345 VanDerWaalsContact OD1-NH1 3.15Å; R345-N349 WeakPolarHBondContact O-CA 3.35Å; R345-N349 PolarHBondContact O-N 2.85Å; R345-D350 PolarHBondContact O-N 3.34Å; R345-D350 VanDerWaalsContact O-N 3.11Å; R345-L352 HydrophobicContact CG-CD1 4.4Å; R345-Y356 HydrophobicContact CG-CE2 3.84Å; R345-Y356 VanDerWaalsContact CG-OH 3.27Å; R345-Y356 WeakPolarHBondContact CG-OH 3.34Å; R345-Y356 PolarHBondContact N-OH 3.21Å
346	H	88	Confident	85.5	Confident	144 Å²	144	70.8 Å²	70.8	67%	0.667	37%	0.374	S	S	*	.	H	α-helix	trans	-68	-43.2	177.5	-70.7	78.2	0	0	0	111.5	N342 F343 Y344 Y348 N349	N342-H346 PolarHBondContact O-N 2.9Å; N342-H346 PolarHBondContact O-ND1 2.83Å; F343-H346 PolarHBondContact O-N 3.18Å; Y344-H346 VanDerWaalsContact C-N 3.34Å; H346-Y348 VanDerWaalsContact C-N 3.33Å; H346-Y348 PolarHBondContact O-N 3.36Å; H346-N349 PolarHBondContact O-N 3.1Å; H346-N349 PolarHBondContact O-OD1 3.46Å
347	L	86.7	Confident	85.4	Confident	61 Å²	61	67.2 Å²	67.2	32%	0.319	36%	0.355	S	S	.	.	H	α-helix	trans	-62.1	-40	-178.5	-172.3	68.2	0	0	0	112.5	F343 Y344 E388	F343-L347 HydrophobicContact CE1-CD2 4.28Å; F343-L347 WeakPolarHBondContact O-CB 3.35Å; F343-L347 PolarHBondContact O-N 2.83Å; Y344-L347 HydrophobicContact CD1-CD2 4.33Å; Y344-L347 PolarHBondContact O-N 3.3Å; L347-E388 HydrophobicContact CD2-CB 3.78Å
348	Y	83.6	Confident	85.1	Confident	30 Å²	30	71.8 Å²	71.8	12%	0.118	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	8	-177.7	-64.7	-67.2	0	0	0	113.6	I307 Y344 H346 D350 S351 L352 E388	I307-Y348 VanDerWaalsContact O-CE2 3.28Å; I307-Y348 WeakPolarHBondContact O-CE2 3.45Å; Y344-Y348 HydrophobicContact CD1-CD2 4.35Å; Y344-Y348 AromaticContact CD1-CE2 3.82Å; Y344-Y348 HydrophobicContact CD1-CE2 3.82Å; Y344-Y348 WeakPolarHBondContact O-CD2 3.44Å; Y344-Y348 PolarHBondContact O-N 2.84Å; Y344-Y348 VanDerWaalsContact O-N 3.1Å; H346-Y348 VanDerWaalsContact C-N 3.33Å; H346-Y348 PolarHBondContact O-N 3.36Å; Y348-D350 VanDerWaalsContact C-N 3.26Å; Y348-D350 PolarHBondContact O-N 2.92Å; Y348-S351 WeakPolarHBondContact O-CB 3.21Å; Y348-S351 PolarHBondContact O-N 3.49Å; Y348-S351 PolarHBondContact O-OG 3.1Å; Y348-L352 HydrophobicContact CD2-CD2 3.68Å; Y348-L352 HydrophobicContact CG-CD2 4.08Å; Y348-E388 PolarHBondContact OH-OE2 3.12Å; Y348-E388 VanDerWaalsContact OH-OE2 3.14Å
349	N	78.9	Confident	85	Confident	140 Å²	140	74 Å²	74	75%	0.749	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.9	49.4	-176.3	-72	-26.5	0	0	0	113.1	R345 H346 S351	R345-N349 WeakPolarHBondContact O-CA 3.35Å; R345-N349 PolarHBondContact O-N 2.85Å; H346-N349 PolarHBondContact O-N 3.1Å; H346-N349 PolarHBondContact O-OD1 3.46Å; N349-S351 PolarHBondContact O-N 2.76Å
350	D	72.4	Confident	85	Confident	120 Å²	120	72.1 Å²	72.1	64%	0.642	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	4.8	-175.7	-72.1	-27.8	0	0	0	117	R345 Y348 L352	R345-D350 PolarHBondContact O-N 3.34Å; R345-D350 VanDerWaalsContact O-N 3.11Å; Y348-D350 VanDerWaalsContact C-N 3.26Å; Y348-D350 PolarHBondContact O-N 2.92Å; D350-L352 PolarHBondContact O-N 2.99Å
351	S	76.8	Confident	85	Confident	85 Å²	85	72.4 Å²	72.4	59%	0.594	38%	0.38	S	S	*	.			trans	-79.3	51.4	173.4	70.7	0	0	0	0	112.7	Y348 N349	Y348-S351 WeakPolarHBondContact O-CB 3.21Å; Y348-S351 PolarHBondContact O-N 3.49Å; Y348-S351 PolarHBondContact O-OG 3.1Å; N349-S351 PolarHBondContact O-N 2.76Å
352	L	74.8	Confident	85.2	Confident	41 Å²	41	73.8 Å²	73.8	22%	0.215	39%	0.39	C	S	.	.			trans	-81	138.6	-177.6	-66.5	170.3	0	0	0	111.1	I307 R345 Y348 D350 R354 Y356	I307-L352 HydrophobicContact CG2-CD2 4.04Å; R345-L352 HydrophobicContact CG-CD1 4.4Å; Y348-L352 HydrophobicContact CD2-CD2 3.68Å; Y348-L352 HydrophobicContact CG-CD2 4.08Å; D350-L352 PolarHBondContact O-N 2.99Å; L352-R354 VanDerWaalsContact C-N 3.28Å; L352-R354 PolarHBondContact O-N 3.06Å; L352-Y356 HydrophobicContact CD1-CD2 4.36Å; L352-Y356 HydrophobicContact CD1-CE2 3.34Å; L352-Y356 VanDerWaalsContact CD1-OH 3.24Å; L352-Y356 WeakPolarHBondContact CD1-OH 3.46Å
353	P	70.1	Confident	85.3	Confident	79 Å²	79	71.7 Å²	71.7	51%	0.513	38%	0.383	S	S	.	.	S	Bend	trans	-69.1	-26.9	-179.5	25.4	-32.2	0	0	0	112.8
354	R	75.3	Confident	85.5	Confident	105 Å²	105	67.7 Å²	67.7	40%	0.396	37%	0.367	S	S	.	.	S	Bend	trans	-146.6	151.7	-175.4	-76.9	-172.8	-79.8	-115.6	8.6	111.8	R305 L352 A400	R305-R354 VanDerWaalsContact O-CZ 3.28Å; R305-R354 PolarHBondContact O-NE 2.9Å; R305-R354 PolarHBondContact O-NH2 2.86Å; L352-R354 VanDerWaalsContact C-N 3.28Å; L352-R354 PolarHBondContact O-N 3.06Å; R354-A400 PolarHBondContact NH2-O 3.47Å
355	P	85.4	Confident	85.8	Confident	99 Å²	99	67.6 Å²	67.6	64%	0.643	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-66.5	152.3	175	28.7	-35.1	0	0	0	111.4	R305	R305-P355 PolarHBondContact NH1-O 3.45Å
356	Y	88.1	Confident	86.1	Confident	41 Å²	41	63.8 Å²	63.8	16%	0.161	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-57.9	145.3	174.3	-70.8	-81.4	0	0	0	111.4	L302 I307 E341 R345 L352	L302-Y356 HydrophobicContact CD2-CD1 3.89Å; L302-Y356 HydrophobicContact CD2-CE1 3.98Å; I307-Y356 HydrophobicContact CD1-CD1 3.7Å; I307-Y356 HydrophobicContact CD1-CE1 3.82Å; I307-Y356 HydrophobicContact CD1-CG 4.31Å; I307-Y356 HydrophobicContact CG2-CE1 4.32Å; E341-Y356 HydrophobicContact CB-CD1 4.2Å; E341-Y356 HydrophobicContact CB-CE1 3.85Å; E341-Y356 HydrophobicContact CG-CD1 3.56Å; E341-Y356 HydrophobicContact CG-CE1 3.65Å; E341-Y356 HydrophobicContact CG-CG 4.24Å; E341-Y356 PolarHBondContact O-OH 3.18Å; R345-Y356 HydrophobicContact CG-CE2 3.84Å; R345-Y356 VanDerWaalsContact CG-OH 3.27Å; R345-Y356 WeakPolarHBondContact CG-OH 3.34Å; R345-Y356 PolarHBondContact N-OH 3.21Å; L352-Y356 HydrophobicContact CD1-CD2 4.36Å; L352-Y356 HydrophobicContact CD1-CE2 3.34Å; L352-Y356 VanDerWaalsContact CD1-OH 3.24Å; L352-Y356 WeakPolarHBondContact CD1-OH 3.46Å
357	P	88.1	Confident	86.4	Confident	7 Å²	7	57 Å²	57	5%	0.045	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-69.4	138.2	177.5	29.9	-33.5	0	0	0	110.2	D359 Y360	P357-D359 VanDerWaalsContact C-N 3.3Å; P357-D359 PolarHBondContact O-N 3.4Å; P357-Y360 HydrophobicContact CG-CD1 4.26Å; P357-Y360 HydrophobicContact CG-CE1 3.56Å; P357-Y360 HydrophobicContact CG-CE2 4.3Å
358	P	87	Confident	86.8	Confident	109 Å²	109	54.6 Å²	54.6	71%	0.708	31%	0.309	S	S	*	.	S	Bend	trans	-67.9	-33.4	178.3	26.8	-33.8	0	0	0	112
359	D	91	Very high	87.3	Confident	119 Å²	119	53.2 Å²	53.2	64%	0.636	30%	0.304	S	S	*	.			trans	-131.2	147.9	-176.8	-59.8	-49.7	0	0	0	111.6	P357 P361	P357-D359 VanDerWaalsContact C-N 3.3Å; P357-D359 PolarHBondContact O-N 3.4Å; D359-P361 VanDerWaalsContact O-CD 3.26Å; D359-P361 WeakPolarHBondContact O-CD 3.39Å
360	Y	93.7	Very high	88	Confident	36 Å²	36	49.7 Å²	49.7	14%	0.141	28%	0.283	C	S	.	.			trans	-113.8	84.5	178.2	-65.9	-89	0	0	0	110.8	P298 V337 E341 P357	P298-Y360 HydrophobicContact CB-CD1 3.61Å; P298-Y360 HydrophobicContact CB-CE1 3.37Å; P298-Y360 HydrophobicContact CB-CG 4.42Å; V337-Y360 HydrophobicContact CG1-CD2 4.12Å; V337-Y360 HydrophobicContact CG1-CE2 3.36Å; V337-Y360 HydrophobicContact CG2-CD2 4.33Å; V337-Y360 HydrophobicContact CG2-CE2 4.33Å; E341-Y360 PolarHBondContact OE1-OH 3.12Å; P357-Y360 HydrophobicContact CG-CD1 4.26Å; P357-Y360 HydrophobicContact CG-CE1 3.56Å; P357-Y360 HydrophobicContact CG-CE2 4.3Å
361	P	93.5	Very high	89	Confident	34 Å²	34	44 Å²	44	22%	0.221	25%	0.252	C	S	.	.			trans	-71.3	150.7	-177.7	33.4	-39	0	0	0	111.2	Q297 A327 D359 L366 K406	Q297-P361 PolarHBondContact NE2-O 2.73Å; A327-P361 WeakPolarHBondContact CB-O 3.42Å; D359-P361 VanDerWaalsContact O-CD 3.26Å; D359-P361 WeakPolarHBondContact O-CD 3.39Å; P361-L366 HydrophobicContact CG-CD2 3.73Å; P361-K406 HydrophobicContact CB-CD 4.39Å; P361-K406 HydrophobicContact CG-CD 3.78Å
362	V	94.6	Very high	89.8	Confident	58 Å²	58	42.8 Å²	42.8	35%	0.352	24%	0.241	S	C	.	.			trans	-115.4	153.1	-179.1	-67.3	0	0	0	0	110.7	Q297 T328 K330 I331 C364	Q297-V362 HydrophobicContact CG-CG1 4.27Å; T328-V362 WeakPolarHBondContact O-CA 3.42Å; T328-V362 VanDerWaalsContact O-CB 3.31Å; T328-V362 WeakPolarHBondContact O-CB 3.27Å; K330-V362 WeakPolarHBondContact O-CG1 3.27Å; I331-V362 HydrophobicContact CG1-CG1 4.41Å; I331-V362 HydrophobicContact CG1-CG2 4.45Å; V362-C364 VanDerWaalsContact C-N 3.33Å; V362-C364 PolarHBondContact O-N 3.35Å
363	G	94.2	Very high	90.6	Very high	18 Å²	18	43 Å²	43	19%	0.186	24%	0.242	C	C	.	.	S	Bend	trans	65.2	31	175.6	0	0	0	0	0	115	A327 T328 I409	A327-G363 VanDerWaalsContact O-CA 3.25Å; A327-G363 WeakPolarHBondContact O-CA 3.36Å; A327-G363 PolarHBondContact O-N 3.42Å; T328-G363 PolarHBondContact O-N 3.02Å; T328-G363 VanDerWaalsContact O-N 3.12Å; G363-I409 CarbonylContact C-O 3.45Å; G363-I409 PolarHBondContact O-N 3.47Å; G363-I409 VanDerWaalsContact O-N 3.08Å; G363-I409 VanDerWaalsContact O-O 3.05Å
364	C	94.9	Very high	91.6	Very high	12 Å²	12	39.4 Å²	39.4	8%	0.081	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154.6	-179.4	58.7	0	0	0	0	112.5	A326 A327 V362 K406 F407	A326-C364 CarbonylContact C-O 3.53Å; A326-C364 WeakPolarHBondContact CA-O 3.46Å; A327-C364 PolarHBondContact N-O 3.44Å; V362-C364 VanDerWaalsContact C-N 3.33Å; V362-C364 PolarHBondContact O-N 3.35Å; C364-K406 HydrophobicContact CB-CB 4.18Å; C364-F407 CarbonylContact C-O 3.58Å; C364-F407 WeakPolarHBondContact CA-O 3.46Å; C364-F407 WeakPolarHBondContact CB-O 3.19Å
365	L	95.9	Very high	92.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.1	170.6	-173.2	67.8	0	0	0	108	W324 A326 L403 F407 I409 L418 I422 A426	W324-L365 HydrophobicContact CB-CD1 4.07Å; W324-L365 HydrophobicContact CE3-CD1 4.2Å; W324-L365 HydrophobicContact CE3-CD2 3.91Å; W324-L365 HydrophobicContact CE3-CG 4.29Å; W324-L365 HydrophobicContact CZ3-CD2 4.3Å; A326-L365 HydrophobicContact CB-CD1 4.44Å; L365-L403 HydrophobicContact CB-CD1 4.42Å; L365-L403 HydrophobicContact CD2-CD1 3.81Å; L365-L403 HydrophobicContact CG-CD1 3.76Å; L365-F407 HydrophobicContact CB-CB 4.17Å; L365-F407 HydrophobicContact CD2-CD2 4.25Å; L365-F407 PolarHBondContact N-O 3.36Å; L365-I409 HydrophobicContact CB-CD1 3.84Å; L365-I409 HydrophobicContact CB-CG1 4.07Å; L365-I409 HydrophobicContact CB-CG2 4.4Å; L365-I409 HydrophobicContact CD1-CD1 3.85Å; L365-I409 HydrophobicContact CG-CD1 4.41Å; L365-L418 HydrophobicContact CD1-CD1 4.32Å; L365-L418 HydrophobicContact CD2-CD1 4.26Å; L365-I422 HydrophobicContact CD2-CG2 4.12Å; L365-A426 HydrophobicContact CD2-CB 3.86Å
366	L	94.7	Very high	92.7	Very high	2 Å²	2	30.4 Å²	30.4	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-39	-173	-62.8	-178.3	0	0	0	112.6	A300 V304 I325 A327 P361 L403 K406	A300-L366 HydrophobicContact CB-CD1 3.67Å; V304-L366 HydrophobicContact CB-CB 4.42Å; V304-L366 HydrophobicContact CG1-CB 4.4Å; V304-L366 HydrophobicContact CG2-CB 3.9Å; I325-L366 PolarHBondContact O-N 3.43Å; A327-L366 HydrophobicContact CB-CD1 4.08Å; A327-L366 HydrophobicContact CB-CD2 4.38Å; A327-L366 HydrophobicContact CB-CG 4.22Å; P361-L366 HydrophobicContact CG-CD2 3.73Å; L366-L403 WeakPolarHBondContact O-CB 3.16Å; L366-L403 PolarHBondContact O-N 3.11Å; L366-K406 HydrophobicContact CD2-CD 4.4Å
367	G	94.6	Very high	92.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-166.4	-169.7	0	0	0	0	0	112.9	I325 R401	I325-G367 PolarHBondContact N-O 3.31Å; I325-G367 PolarHBondContact O-N 3.5Å; G367-R401 CarbonylContact C-O 3.35Å; G367-R401 WeakPolarHBondContact CA-O 3.48Å
368	C	94.4	Very high	92.9	Very high	11 Å²	11	34.7 Å²	34.7	7%	0.074	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.5	173.7	69.4	0	0	0	0	111.5	V322 L323 W324 R401 I430	V322-C368 HydrophobicContact CG1-CB 3.89Å; L323-C368 WeakPolarHBondContact O-CA 3.49Å; W324-C368 HydrophobicContact CD2-CB 3.99Å; W324-C368 HydrophobicContact CE3-CB 3.88Å; W324-C368 HydrophobicContact CG-CB 4.49Å; W324-C368 HydrophobicContact CH2-CB 4.46Å; W324-C368 HydrophobicContact CZ3-CB 4.11Å; C368-R401 PolarHBondContact N-O 3.31Å; C368-R401 PolarHBondContact O-N 3.1Å; C368-I430 HydrophobicContact CB-CD1 4.28Å; C368-I430 WeakPolarHBondContact SG-CD1 3.36Å
369	V	94.6	Very high	93	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.3	175.5	-59.6	0	0	0	0	108.7	L303 L323 I325 C397 A400	L303-V369 HydrophobicContact CD2-CG1 4.37Å; L303-V369 HydrophobicContact CD2-CG2 4.39Å; L303-V369 HydrophobicContact CG-CG1 4.22Å; L323-V369 HydrophobicContact CB-CG2 4.26Å; L323-V369 PolarHBondContact N-O 3Å; L323-V369 PolarHBondContact O-N 3.29Å; I325-V369 HydrophobicContact CD1-CG2 3.85Å; I325-V369 HydrophobicContact CG1-CG1 4.01Å; I325-V369 HydrophobicContact CG1-CG2 3.79Å; V369-C397 HydrophobicContact CB-CB 4.24Å; V369-C397 HydrophobicContact CG2-CB 4.24Å; V369-A400 HydrophobicContact CG1-CB 3.85Å
370	E	94.1	Very high	93.1	Very high	65 Å²	65	24.7 Å²	24.7	30%	0.304	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.7	175.3	-172.2	-175.2	159.3	0	0	109.7	V372 C397 K398 N399	E370-V372 PolarHBondContact O-N 2.72Å; E370-C397 CarbonylContact O-C 3.58Å; E370-C397 WeakPolarHBondContact O-CA 3.38Å; E370-K398 WeakPolarHBondContact CB-O 3.36Å; E370-K398 PolarHBondContact N-O 3.08Å; E370-K398 PolarHBondContact O-N 3.24Å; E370-N399 HydrophobicContact CB-CB 4.2Å; E370-N399 PolarHBondContact OE2-ND2 2.95Å
371	V	94.2	Very high	93	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	110.2	175.6	-179	0	0	0	0	108.8	H319 R320 G321 L323 L395	H319-V371 WeakPolarHBondContact O-CG1 3.39Å; R320-V371 WeakPolarHBondContact CA-O 3.11Å; G321-V371 PolarHBondContact N-O 3.07Å; G321-V371 PolarHBondContact O-N 3.47Å; L323-V371 HydrophobicContact CB-CG2 3.65Å; L323-V371 HydrophobicContact CD2-CG2 3.62Å; L323-V371 HydrophobicContact CG-CG2 4.28Å; V371-L395 HydrophobicContact CG1-CD2 4.32Å; V371-L395 HydrophobicContact CG2-CD2 4.37Å
372	V	92.4	Very high	92.9	Very high	60 Å²	60	32.6 Å²	32.6	36%	0.364	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-44.3	-177.9	179	0	0	0	0	111.3	R320 E370 I396 K398	R320-V372 VanDerWaalsContact CD-O 3.26Å; R320-V372 WeakPolarHBondContact CD-O 3.38Å; E370-V372 PolarHBondContact O-N 2.72Å; V372-I396 HydrophobicContact CB-CG2 4.43Å; V372-I396 PolarHBondContact N-O 3.01Å; V372-K398 HydrophobicContact CG2-CB 3.99Å; V372-K398 HydrophobicContact CG2-CD 3.73Å; V372-K398 HydrophobicContact CG2-CG 3.71Å
373	D	91.5	Very high	92.7	Very high	44 Å²	44	35 Å²	35	24%	0.235	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	163.9	175.7	-148	-3.5	0	0	0	112	R320 L375 I396	R320-D373 IonicContact CZ-OD1 3.94Å; R320-D373 IonicContact NE-OD1 3.79Å; R320-D373 PolarHBondContact NE-OD1 3.39Å; R320-D373 IonicContact NH2-OD1 2.73Å; R320-D373 PolarHBondContact NH2-OD1 3.48Å; D373-L375 HydrophobicContact CB-CD2 4.42Å; D373-L375 WeakPolarHBondContact OD2-CD2 3.47Å; D373-I396 HydrophobicContact CB-CD1 4.24Å; D373-I396 PolarHBondContact O-N 3.19Å
374	C	92.4	Very high	92.6	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.027	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	110	168.9	-176.4	0	0	0	0	107.2	Y316 T317 R320 V394	Y316-C374 HydrophobicContact CD2-CB 4.36Å; Y316-C374 HydrophobicContact CE2-CB 4.01Å; Y316-C374 WeakPolarHBondContact CE2-O 3.43Å; T317-C374 HydrophobicContact CG2-CB 4Å; T317-C374 VanDerWaalsContact O-CB 3.28Å; T317-C374 WeakPolarHBondContact O-CB 3.28Å; R320-C374 VanDerWaalsContact NH2-N 3.15Å; C374-V394 WeakPolarHBondContact CA-O 3.24Å
375	L	91.5	Very high	92.2	Very high	7 Å²	7	41 Å²	41	4%	0.037	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.3	-175.6	-62.5	-176.5	0	0	0	111	D373 D379 Q383 Y393 V394 I396	D373-L375 HydrophobicContact CB-CD2 4.42Å; D373-L375 WeakPolarHBondContact OD2-CD2 3.47Å; L375-D379 HydrophobicContact CB-CB 4.19Å; L375-D379 HydrophobicContact CD2-CB 4.42Å; L375-Q383 HydrophobicContact CD1-CG 4.37Å; L375-Y393 CarbonylContact O-C 3.56Å; L375-Y393 WeakPolarHBondContact O-CA 3.38Å; L375-V394 PolarHBondContact N-O 3.27Å; L375-V394 PolarHBondContact O-N 3.42Å; L375-I396 HydrophobicContact CD1-CD1 3.63Å; L375-I396 HydrophobicContact CG-CD1 3.98Å
376	S	91.8	Very high	91.8	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.063	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	158.1	163	69.7	0	0	0	0	109.9	S198 E378 D379 Y380 P392	S198-S376 WeakPolarHBondContact CA-OG 3.39Å; S376-E378 PolarHBondContact O-N 2.95Å; S376-D379 PolarHBondContact O-N 3.04Å; S376-D379 WeakPolarHBondContact OG-CB 3.31Å; S376-D379 PolarHBondContact OG-N 3.42Å; S376-D379 PolarHBondContact OG-OD2 3.32Å; S376-Y380 VanDerWaalsContact O-CB 3.29Å; S376-Y380 WeakPolarHBondContact O-CB 3.3Å; S376-Y380 PolarHBondContact O-N 2.98Å; S376-P392 CarbonylContact C-O 3.49Å
377	Q	90.5	Very high	91.3	Very high	39 Å²	39	48.3 Å²	48.3	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-34.4	-178	-175.5	60.2	2.1	0	0	113.3	R381 S389 S391 P392	Q377-R381 WeakPolarHBondContact O-CB 3.19Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.39Å; Q377-R381 PolarHBondContact O-N 2.85Å; Q377-S389 PolarHBondContact NE2-O 2.9Å; Q377-S391 PolarHBondContact OE1-O 3.11Å; Q377-P392 PolarHBondContact N-O 2.91Å
378	E	89	Confident	91	Very high	98 Å²	98	49.4 Å²	49.4	46%	0.458	25%	0.251	S	S	.	.	H	α-helix	trans	-67.1	-49.6	176.2	-68.6	170.7	-178.2	0	0	111.4	S198 H201 S376 Y380 R381 L382	S198-E378 WeakPolarHBondContact CB-OE2 3.24Å; H201-E378 IonicContact CD2-OE2 2.6Å; H201-E378 IonicContact NE2-OE2 2.9Å; S376-E378 PolarHBondContact O-N 2.95Å; E378-Y380 VanDerWaalsContact C-N 3.28Å; E378-Y380 PolarHBondContact O-N 3.39Å; E378-R381 PolarHBondContact O-N 2.92Å; E378-L382 WeakPolarHBondContact O-CG 3.41Å; E378-L382 PolarHBondContact O-N 3.23Å
379	D	90	Very high	90.8	Very high	18 Å²	18	49.2 Å²	49.2	10%	0.096	25%	0.25	C	S	.	.	H	α-helix	trans	-63.6	-37.1	177.3	-63.8	-28.4	0	0	0	111.3	S198 K199 L375 S376 L382 Q383	S198-D379 WeakPolarHBondContact CA-OD2 3.33Å; S198-D379 WeakPolarHBondContact CB-OD1 3.26Å; S198-D379 PolarHBondContact OG-OD1 3.1Å; K199-D379 PolarHBondContact N-OD1 3.04Å; K199-D379 PolarHBondContact N-OD2 3.47Å; L375-D379 HydrophobicContact CB-CB 4.19Å; L375-D379 HydrophobicContact CD2-CB 4.42Å; S376-D379 PolarHBondContact O-N 3.04Å; S376-D379 WeakPolarHBondContact OG-CB 3.31Å; S376-D379 PolarHBondContact OG-N 3.42Å; S376-D379 PolarHBondContact OG-OD2 3.32Å; D379-L382 PolarHBondContact O-N 3.19Å; D379-Q383 WeakPolarHBondContact O-CG 3.37Å; D379-Q383 PolarHBondContact O-N 3.11Å; D379-Q383 VanDerWaalsContact O-N 3.15Å
380	Y	92.5	Very high	90.6	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-48.6	176.9	173.3	-115	0	0	0	111.8	F310 S376 E378 L382 Q383 Y384 G387 E388 S389 V394	F310-Y380 HydrophobicContact CB-CE2 4.2Å; F310-Y380 WeakPolarHBondContact CB-OH 3.5Å; F310-Y380 AromaticContact CD1-CE2 3.52Å; F310-Y380 HydrophobicContact CD1-CE2 3.52Å; F310-Y380 HydrophobicContact CD2-CE2 4.24Å; F310-Y380 WeakPolarHBondContact CD2-OH 3.4Å; F310-Y380 AromaticContact CE1-CE2 3.82Å; F310-Y380 HydrophobicContact CE1-CE2 3.82Å; F310-Y380 HydrophobicContact CE2-CE2 4.49Å; F310-Y380 AromaticContact CG-CE2 3.73Å; F310-Y380 HydrophobicContact CG-CE2 3.73Å; F310-Y380 AromaticContact CG-CZ 3.86Å; F310-Y380 WeakPolarHBondContact CG-OH 3.28Å; F310-Y380 HydrophobicContact CZ-CE2 4.29Å; S376-Y380 VanDerWaalsContact O-CB 3.29Å; S376-Y380 WeakPolarHBondContact O-CB 3.3Å; S376-Y380 PolarHBondContact O-N 2.98Å; E378-Y380 VanDerWaalsContact C-N 3.28Å; E378-Y380 PolarHBondContact O-N 3.39Å; Y380-L382 PolarHBondContact O-N 2.97Å; Y380-Q383 PolarHBondContact O-N 3.2Å; Y380-Y384 AromaticContact CD2-CD2 3.75Å; Y380-Y384 HydrophobicContact CD2-CD2 3.75Å; Y380-Y384 HydrophobicContact CD2-CG 4.37Å; Y380-Y384 AromaticContact CE2-CD2 3.74Å; Y380-Y384 HydrophobicContact CE2-CD2 3.74Å; Y380-Y384 HydrophobicContact CE2-CG 4Å; Y380-Y384 WeakPolarHBondContact O-CA 3.31Å; Y380-Y384 PolarHBondContact O-N 3.16Å; Y380-G387 WeakPolarHBondContact OH-CA 3.47Å; Y380-E388 PolarHBondContact OH-N 3.49Å; Y380-E388 VanDerWaalsContact OH-N 3.11Å; Y380-S389 WeakPolarHBondContact CE1-O 3.48Å; Y380-V394 HydrophobicContact CD1-CB 4.27Å; Y380-V394 HydrophobicContact CD1-CG1 4.36Å; Y380-V394 HydrophobicContact CD1-CG2 3.8Å; Y380-V394 HydrophobicContact CD2-CB 4.07Å; Y380-V394 HydrophobicContact CD2-CG1 3.83Å; Y380-V394 HydrophobicContact CD2-CG2 4.49Å; Y380-V394 HydrophobicContact CE1-CG1 4.28Å; Y380-V394 HydrophobicContact CE1-CG2 4.2Å; Y380-V394 HydrophobicContact CE2-CB 4.48Å; Y380-V394 HydrophobicContact CE2-CG1 3.77Å; Y380-V394 HydrophobicContact CG-CB 3.95Å; Y380-V394 HydrophobicContact CG-CG1 4.13Å; Y380-V394 HydrophobicContact CG-CG2 3.94Å
381	R	91.3	Very high	90.5	Very high	120 Å²	120	55.7 Å²	55.7	45%	0.453	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-30.7	178.9	-76.7	-80.2	-175.6	143.5	0.2	112.9	Q377 E378 Y384 P385	Q377-R381 WeakPolarHBondContact O-CB 3.19Å; Q377-R381 VanDerWaalsContact O-CG 3.27Å; Q377-R381 WeakPolarHBondContact O-CG 3.39Å; Q377-R381 PolarHBondContact O-N 2.85Å; E378-R381 PolarHBondContact O-N 2.92Å; R381-Y384 CarbonylContact O-C 3.46Å; R381-P385 VanDerWaalsContact O-CA 3.23Å; R381-P385 WeakPolarHBondContact O-CA 3.35Å
382	L	91.2	Very high	90.4	Very high	116 Å²	116	58.9 Å²	58.9	61%	0.607	31%	0.305	S	S	*	.	H	α-helix	trans	-73.3	-41.2	176.2	-73.3	164	0	0	0	112.6	L200 E378 D379 Y380	L200-L382 HydrophobicContact CD1-CD1 3.18Å; L200-L382 HydrophobicContact CD2-CD1 4.42Å; L200-L382 HydrophobicContact CG-CD1 4.26Å; E378-L382 WeakPolarHBondContact O-CG 3.41Å; E378-L382 PolarHBondContact O-N 3.23Å; D379-L382 PolarHBondContact O-N 3.19Å; Y380-L382 PolarHBondContact O-N 2.97Å
383	Q	91.3	Very high	90.4	Very high	108 Å²	108	57 Å²	57	51%	0.505	29%	0.292	S	S	.	.	H	α-helix	trans	-77.8	-32.4	178.2	-66.6	-174.3	34	0	0	112.4	L375 D379 Y380	L375-Q383 HydrophobicContact CD1-CG 4.37Å; D379-Q383 WeakPolarHBondContact O-CG 3.37Å; D379-Q383 PolarHBondContact O-N 3.11Å; D379-Q383 VanDerWaalsContact O-N 3.15Å; Y380-Q383 PolarHBondContact O-N 3.2Å
384	Y	90.8	Very high	90.5	Very high	72 Å²	72	54.9 Å²	54.9	28%	0.282	28%	0.28	S	S	.	.			trans	-135.2	79.8	-175.8	-58.1	-76.6	0	0	0	109.5	F310 Y380 R381 D386 G387 I396	F310-Y384 HydrophobicContact CE1-CD1 4.01Å; F310-Y384 AromaticContact CE1-CD2 3.89Å; F310-Y384 HydrophobicContact CE1-CD2 3.89Å; F310-Y384 HydrophobicContact CE1-CE1 4.01Å; F310-Y384 AromaticContact CE1-CE2 3.9Å; F310-Y384 HydrophobicContact CE1-CE2 3.9Å; F310-Y384 AromaticContact CE1-CG 3.94Å; F310-Y384 HydrophobicContact CE1-CG 3.94Å; F310-Y384 AromaticContact CE1-CZ 3.95Å; F310-Y384 HydrophobicContact CE2-CD1 4.47Å; F310-Y384 AromaticContact CZ-CD1 3.5Å; F310-Y384 HydrophobicContact CZ-CD1 3.5Å; F310-Y384 VanDerWaalsContact CZ-CD1 3.5Å; F310-Y384 HydrophobicContact CZ-CD2 4.17Å; F310-Y384 AromaticContact CZ-CE1 3.74Å; F310-Y384 HydrophobicContact CZ-CE1 3.74Å; F310-Y384 HydrophobicContact CZ-CE2 4.38Å; F310-Y384 AromaticContact CZ-CG 3.72Å; F310-Y384 HydrophobicContact CZ-CG 3.72Å; Y380-Y384 AromaticContact CD2-CD2 3.75Å; Y380-Y384 HydrophobicContact CD2-CD2 3.75Å; Y380-Y384 HydrophobicContact CD2-CG 4.37Å; Y380-Y384 AromaticContact CE2-CD2 3.74Å; Y380-Y384 HydrophobicContact CE2-CD2 3.74Å; Y380-Y384 HydrophobicContact CE2-CG 4Å; Y380-Y384 WeakPolarHBondContact O-CA 3.31Å; Y380-Y384 PolarHBondContact O-N 3.16Å; R381-Y384 CarbonylContact O-C 3.46Å; Y384-D386 PolarHBondContact O-N 3.03Å; Y384-G387 PolarHBondContact O-N 3.13Å; Y384-I396 HydrophobicContact CE2-CD1 3.68Å; Y384-I396 HydrophobicContact CE2-CG1 4.35Å
385	P	88.4	Confident	90.6	Very high	85 Å²	85	54.8 Å²	54.8	55%	0.552	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-36.3	-179.2	21.7	-32.4	0	0	0	112.6	R381 G387	R381-P385 VanDerWaalsContact O-CA 3.23Å; R381-P385 WeakPolarHBondContact O-CA 3.35Å; P385-G387 PolarHBondContact O-N 3.37Å
386	D	86.1	Confident	90.8	Very high	139 Å²	139	54.8 Å²	54.8	74%	0.743	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	27.5	177.3	-55.5	-42.2	0	0	0	112.7	Y384	Y384-D386 PolarHBondContact O-N 3.03Å
387	G	85.3	Confident	90.9	Very high	16 Å²	16	54.9 Å²	54.9	17%	0.165	28%	0.28	C	S	.	.			trans	-63.1	140.2	-178	0	0	0	0	0	114	Y380 Y384 P385 S389	Y380-G387 WeakPolarHBondContact OH-CA 3.47Å; Y384-G387 PolarHBondContact O-N 3.13Å; P385-G387 PolarHBondContact O-N 3.37Å; G387-S389 VanDerWaalsContact C-N 3.32Å; G387-S389 PolarHBondContact O-N 2.89Å
388	E	88.1	Confident	91	Very high	23 Å²	23	58 Å²	58	11%	0.107	29%	0.293	C	S	.	.	S	Bend	trans	-78.8	-8.5	-178.6	72.1	-161.6	-159.1	0	0	114.4	K308 R309 F310 F343 Y344 L347 Y348 Y380	K308-E388 WeakPolarHBondContact CG-OE1 3.29Å; K308-E388 IonicContact NZ-OE1 3.23Å; K308-E388 PolarHBondContact NZ-OE1 2.82Å; R309-E388 PolarHBondContact N-OE1 3.35Å; F310-E388 HydrophobicContact CB-CG 3.96Å; F310-E388 HydrophobicContact CD2-CG 3.89Å; F310-E388 HydrophobicContact CG-CG 4.43Å; F310-E388 PolarHBondContact N-OE1 3.32Å; F343-E388 HydrophobicContact CE1-CB 4.21Å; Y344-E388 HydrophobicContact CE1-CB 4.33Å; Y344-E388 HydrophobicContact CE1-CG 4.45Å; Y344-E388 VanDerWaalsContact CE1-OE2 3.27Å; Y344-E388 WeakPolarHBondContact CE1-OE2 3.43Å; L347-E388 HydrophobicContact CD2-CB 3.78Å; Y348-E388 PolarHBondContact OH-OE2 3.12Å; Y348-E388 VanDerWaalsContact OH-OE2 3.14Å; Y380-E388 PolarHBondContact OH-N 3.49Å; Y380-E388 VanDerWaalsContact OH-N 3.11Å
389	S	90	Very high	91.1	Very high	8 Å²	8	58.2 Å²	58.2	6%	0.056	30%	0.298	C	S	.	.			trans	-112.2	137.9	-171.4	-157.9	0	0	0	0	113.8	G312 Q377 Y380 G387	G312-S389 VanDerWaalsContact CA-OG 3.26Å; G312-S389 WeakPolarHBondContact CA-OG 3.27Å; Q377-S389 PolarHBondContact NE2-O 2.9Å; Y380-S389 WeakPolarHBondContact CE1-O 3.48Å; G387-S389 VanDerWaalsContact C-N 3.32Å; G387-S389 PolarHBondContact O-N 2.89Å
390	E	90.1	Very high	91.2	Very high	165 Å²	165	58 Å²	58	77%	0.771	30%	0.298	S	S	*	.			trans	-110.7	1.7	177.6	-61.9	-174.9	161	0	0	113.3
391	S	92.2	Very high	91.2	Very high	37 Å²	37	64 Å²	64	26%	0.259	32%	0.321	S	S	.	.	S	Bend	trans	-73.1	152.6	-177.4	-65.7	0	0	0	0	111.9	G312 Q377 Y393	G312-S391 VanDerWaalsContact C-OG 3.29Å; G312-S391 WeakPolarHBondContact CA-OG 3.38Å; G312-S391 PolarHBondContact O-OG 2.69Å; Q377-S391 PolarHBondContact OE1-O 3.11Å; S391-Y393 VanDerWaalsContact C-N 3.26Å; S391-Y393 PolarHBondContact O-N 2.98Å
392	P	91.1	Very high	91.2	Very high	69 Å²	69	61 Å²	61	45%	0.448	31%	0.312	S	S	.	.	S	Bend	trans	-63	-29.9	-175.7	25.6	-36	0	0	0	113.9	R313 S376 Q377	R313-P392 WeakPolarHBondContact O-CD 3.33Å; R313-P392 WeakPolarHBondContact O-CG 3.29Å; S376-P392 CarbonylContact C-O 3.49Å; Q377-P392 PolarHBondContact N-O 2.91Å
393	Y	92.5	Very high	91.3	Very high	20 Å²	20	55.7 Å²	55.7	8%	0.078	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	128.7	173.5	-60	-75.5	0	0	0	110.5	G312 R313 W315 Y316 L375 S391	G312-Y393 CarbonylContact C-O 3.6Å; R313-Y393 PolarHBondContact N-O 3.27Å; R313-Y393 PolarHBondContact O-N 3.38Å; R313-Y393 VanDerWaalsContact O-N 3.1Å; W315-Y393 VanDerWaalsContact C-CD2 3.44Å; Y316-Y393 AromaticContact CD2-CD1 3.76Å; Y316-Y393 HydrophobicContact CD2-CD1 3.76Å; Y316-Y393 AromaticContact CD2-CE1 3.98Å; Y316-Y393 HydrophobicContact CD2-CE1 3.98Å; Y316-Y393 HydrophobicContact CG-CD1 4.31Å; Y316-Y393 HydrophobicContact CG-CE1 4.33Å; L375-Y393 CarbonylContact O-C 3.56Å; L375-Y393 WeakPolarHBondContact O-CA 3.38Å; S391-Y393 VanDerWaalsContact C-N 3.26Å; S391-Y393 PolarHBondContact O-N 2.98Å
394	V	94.7	Very high	91.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.1	-176.3	-175.6	0	0	0	0	109.7	F310 C374 L375 Y380	F310-V394 HydrophobicContact CB-CG1 3.72Å; C374-V394 WeakPolarHBondContact CA-O 3.24Å; L375-V394 PolarHBondContact N-O 3.27Å; L375-V394 PolarHBondContact O-N 3.42Å; Y380-V394 HydrophobicContact CD1-CB 4.27Å; Y380-V394 HydrophobicContact CD1-CG1 4.36Å; Y380-V394 HydrophobicContact CD1-CG2 3.8Å; Y380-V394 HydrophobicContact CD2-CB 4.07Å; Y380-V394 HydrophobicContact CD2-CG1 3.83Å; Y380-V394 HydrophobicContact CD2-CG2 4.49Å; Y380-V394 HydrophobicContact CE1-CG1 4.28Å; Y380-V394 HydrophobicContact CE1-CG2 4.2Å; Y380-V394 HydrophobicContact CE2-CB 4.48Å; Y380-V394 HydrophobicContact CE2-CG1 3.77Å; Y380-V394 HydrophobicContact CG-CB 3.95Å; Y380-V394 HydrophobicContact CG-CG1 4.13Å; Y380-V394 HydrophobicContact CG-CG2 3.94Å
395	L	95.1	Very high	91.1	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.9	173.6	-68.3	80	0	0	0	108.9	F310 E311 R313 T317 L323 V371	F310-L395 WeakPolarHBondContact CA-O 3.26Å; E311-L395 HydrophobicContact CB-CB 4.31Å; E311-L395 PolarHBondContact N-O 3.4Å; E311-L395 WeakPolarHBondContact O-CD1 3.4Å; E311-L395 PolarHBondContact O-N 3.37Å; R313-L395 HydrophobicContact CB-CD1 4.3Å; R313-L395 HydrophobicContact CG-CD1 3.97Å; T317-L395 HydrophobicContact CG2-CD2 3.76Å; T317-L395 HydrophobicContact CG2-CG 4.01Å; L323-L395 HydrophobicContact CD2-CD2 4.35Å; V371-L395 HydrophobicContact CG1-CD2 4.32Å; V371-L395 HydrophobicContact CG2-CD2 4.37Å
396	I	94.5	Very high	91.3	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	109.5	175	-58.5	172.7	0	0	0	108.1	F310 V372 D373 L375 Y384	F310-I396 HydrophobicContact CD1-CG1 4.25Å; F310-I396 HydrophobicContact CE1-CG1 4.37Å; F310-I396 HydrophobicContact CE1-CG2 4.32Å; V372-I396 HydrophobicContact CB-CG2 4.43Å; V372-I396 PolarHBondContact N-O 3.01Å; D373-I396 HydrophobicContact CB-CD1 4.24Å; D373-I396 PolarHBondContact O-N 3.19Å; L375-I396 HydrophobicContact CD1-CD1 3.63Å; L375-I396 HydrophobicContact CG-CD1 3.98Å; Y384-I396 HydrophobicContact CE2-CD1 3.68Å; Y384-I396 HydrophobicContact CE2-CG1 4.35Å
397	C	94.5	Very high	91.6	Very high	12 Å²	12	51 Å²	51	8%	0.081	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.7	-178.8	-62.6	0	0	0	0	110.3	L303 R309 V369 E370	L303-C397 HydrophobicContact CD1-CB 4.18Å; R309-C397 WeakPolarHBondContact O-CB 3.43Å; R309-C397 PolarHBondContact O-N 3.26Å; V369-C397 HydrophobicContact CB-CB 4.24Å; V369-C397 HydrophobicContact CG2-CB 4.24Å; E370-C397 CarbonylContact O-C 3.58Å; E370-C397 WeakPolarHBondContact O-CA 3.38Å
398	K	92.6	Very high	92	Very high	105 Å²	105	55 Å²	55	46%	0.457	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	173.3	172.2	-62.6	-167	-168.7	171.3	0	110.4	E370 V372 A400	E370-K398 WeakPolarHBondContact CB-O 3.36Å; E370-K398 PolarHBondContact N-O 3.08Å; E370-K398 PolarHBondContact O-N 3.24Å; V372-K398 HydrophobicContact CG2-CB 3.99Å; V372-K398 HydrophobicContact CG2-CD 3.73Å; V372-K398 HydrophobicContact CG2-CG 3.71Å; K398-A400 VanDerWaalsContact C-N 3.34Å; K398-A400 PolarHBondContact O-N 3Å
399	N	90.2	Very high	92.3	Very high	102 Å²	102	54.8 Å²	54.8	55%	0.545	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.5	46.5	171	-64.9	-23.9	0	0	0	114.8	E370 R401	E370-N399 HydrophobicContact CB-CB 4.2Å; E370-N399 PolarHBondContact OE2-ND2 2.95Å; N399-R401 PolarHBondContact O-N 2.97Å
400	A	92.9	Very high	92.3	Very high	13 Å²	13	60.1 Å²	60.1	11%	0.107	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.9	179.9	0	0	0	0	0	112.1	L303 V304 R354 V369 K398	L303-A400 VanDerWaalsContact O-CB 3.24Å; L303-A400 WeakPolarHBondContact O-CB 3.47Å; V304-A400 VanDerWaalsContact O-CB 3.31Å; V304-A400 WeakPolarHBondContact O-CB 3.31Å; R354-A400 PolarHBondContact NH2-O 3.47Å; V369-A400 HydrophobicContact CG1-CB 3.85Å; K398-A400 VanDerWaalsContact C-N 3.34Å; K398-A400 PolarHBondContact O-N 3Å
401	R	91.7	Very high	92.2	Very high	127 Å²	127	53.9 Å²	53.9	48%	0.479	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	121.4	-178.6	-61.8	178	-172.7	-172.4	1.4	110.2	G367 C368 N399 I430	G367-R401 CarbonylContact C-O 3.35Å; G367-R401 WeakPolarHBondContact CA-O 3.48Å; C368-R401 PolarHBondContact N-O 3.31Å; C368-R401 PolarHBondContact O-N 3.1Å; N399-R401 PolarHBondContact O-N 2.97Å; R401-I430 HydrophobicContact CB-CD1 4.49Å; R401-I430 HydrophobicContact CB-CG2 4.37Å
402	E	92.6	Very high	92.2	Very high	57 Å²	57	59.9 Å²	59.9	27%	0.266	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.6	174.4	-166.8	177.9	-174.4	0	0	110.9	V304 R305	V304-E402 VanDerWaalsContact CG1-CA 3.41Å; V304-E402 HydrophobicContact CG1-CB 3.67Å; V304-E402 HydrophobicContact CG1-CG 3.88Å; R305-E402 IonicContact CZ-OE2 2.69Å; R305-E402 VanDerWaalsContact CZ-OE2 3.23Å; R305-E402 IonicContact NE-OE2 3.97Å; R305-E402 PolarHBondContact NE-OE2 3.39Å; R305-E402 IonicContact NH2-OE1 2.93Å; R305-E402 IonicContact NH2-OE2 3.73Å; R305-E402 PolarHBondContact NH2-OE2 2.93Å
403	L	92.8	Very high	92	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	135.4	172.4	-79.3	163.2	0	0	0	110.5	W324 L365 L366 L405 F407 A426 A429 I430	W324-L403 HydrophobicContact CE3-CD1 4.5Å; W324-L403 HydrophobicContact CZ3-CD1 3.96Å; W324-L403 HydrophobicContact CZ3-CD2 4.16Å; W324-L403 HydrophobicContact CZ3-CG 4.21Å; L365-L403 HydrophobicContact CB-CD1 4.42Å; L365-L403 HydrophobicContact CD2-CD1 3.81Å; L365-L403 HydrophobicContact CG-CD1 3.76Å; L366-L403 WeakPolarHBondContact O-CB 3.16Å; L366-L403 PolarHBondContact O-N 3.11Å; L403-L405 WeakPolarHBondContact CB-O 3.25Å; L403-L405 PolarHBondContact O-N 3.2Å; L403-F407 HydrophobicContact CD1-CD2 4.14Å; L403-F407 HydrophobicContact CD1-CE2 4.34Å; L403-F407 HydrophobicContact CD2-CE2 4.4Å; L403-A426 HydrophobicContact CD1-CB 4.15Å; L403-A426 HydrophobicContact CD2-CB 3.97Å; L403-A426 WeakPolarHBondContact CD2-O 3.34Å; L403-A429 HydrophobicContact CD2-CB 4Å; L403-I430 HydrophobicContact CD2-CD1 3.97Å; L403-I430 HydrophobicContact CD2-CG1 3.5Å; L403-I430 VanDerWaalsContact CD2-CG1 3.5Å; L403-I430 HydrophobicContact CG-CD1 4.32Å; L403-I430 HydrophobicContact CG-CG1 4.23Å
404	P	89.2	Confident	91.9	Very high	74 Å²	74	70.8 Å²	70.8	48%	0.481	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	-29.5	172.7	27.5	-34.2	0	0	0	112.2	A429 N433	P404-A429 HydrophobicContact CG-CB 4.24Å; P404-N433 HydrophobicContact CG-CB 4.38Å
405	L	89.6	Confident	91.8	Very high	91 Å²	91	72.6 Å²	72.6	48%	0.476	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.9	177.3	-64	175.9	0	0	0	110	L7 L403	L7-L405 HydrophobicContact CD1-CD1 4.49Å; L403-L405 WeakPolarHBondContact CB-O 3.25Å; L403-L405 PolarHBondContact O-N 3.2Å
406	K	91.4	Very high	91.8	Very high	92 Å²	92	73.7 Å²	73.7	40%	0.4	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.3	-179.4	-61.7	174.5	-178.2	166.5	0	109.4	P361 C364 L366	P361-K406 HydrophobicContact CB-CD 4.39Å; P361-K406 HydrophobicContact CG-CD 3.78Å; C364-K406 HydrophobicContact CB-CB 4.18Å; L366-K406 HydrophobicContact CD2-CD 4.4Å
407	F	93.1	Very high	91.8	Very high	48 Å²	48	76.8 Å²	76.8	21%	0.211	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.2	179.5	-61.7	-83.3	0	0	0	110.5	C364 L365 L403 I409 I422 A425 A426	C364-F407 CarbonylContact C-O 3.58Å; C364-F407 WeakPolarHBondContact CA-O 3.46Å; C364-F407 WeakPolarHBondContact CB-O 3.19Å; L365-F407 HydrophobicContact CB-CB 4.17Å; L365-F407 HydrophobicContact CD2-CD2 4.25Å; L365-F407 PolarHBondContact N-O 3.36Å; L403-F407 HydrophobicContact CD1-CD2 4.14Å; L403-F407 HydrophobicContact CD1-CE2 4.34Å; L403-F407 HydrophobicContact CD2-CE2 4.4Å; F407-I409 PolarHBondContact O-N 3.3Å; F407-I422 HydrophobicContact CB-CG2 4.19Å; F407-I422 HydrophobicContact CG-CG2 4.36Å; F407-A425 HydrophobicContact CE1-CB 4.12Å; F407-A425 HydrophobicContact CZ-CB 4Å; F407-A426 HydrophobicContact CD2-CB 4.19Å; F407-A426 HydrophobicContact CE2-CB 3.86Å
408	P	93.9	Very high	91.8	Very high	100 Å²	100	76.8 Å²	76.8	65%	0.649	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	119.8	176.5	27.9	-32.9	0	0	0	109.8
409	I	93.2	Very high	91.8	Very high	18 Å²	18	75.8 Å²	75.8	9%	0.092	38%	0.382	C	S	.	.			trans	-138.5	146.6	177.7	64.7	164.1	0	0	0	111.1	A326 G363 L365 F407 L418 I422	A326-I409 HydrophobicContact CB-CD1 3.31Å; A326-I409 HydrophobicContact CB-CG1 4Å; G363-I409 CarbonylContact C-O 3.45Å; G363-I409 PolarHBondContact O-N 3.47Å; G363-I409 VanDerWaalsContact O-N 3.08Å; G363-I409 VanDerWaalsContact O-O 3.05Å; L365-I409 HydrophobicContact CB-CD1 3.84Å; L365-I409 HydrophobicContact CB-CG1 4.07Å; L365-I409 HydrophobicContact CB-CG2 4.4Å; L365-I409 HydrophobicContact CD1-CD1 3.85Å; L365-I409 HydrophobicContact CG-CD1 4.41Å; F407-I409 PolarHBondContact O-N 3.3Å; I409-L418 HydrophobicContact CD1-CD2 4Å; I409-I422 HydrophobicContact CG2-CD1 3.95Å; I409-I422 HydrophobicContact CG2-CG2 4.25Å
410	M	91.3	Very high	91.9	Very high	120 Å²	120	74.9 Å²	74.9	59%	0.591	38%	0.382	S	S	*	.			trans	-86.5	115.4	172.1	-70.1	-177.1	58.9	0	0	109.9
411	G	87.3	Confident	91.9	Very high	34 Å²	34	80 Å²	80	35%	0.351	40%	0.402	S	S	.	.			trans	-63.1	145.4	175.4	0	0	0	0	0	113.1	S294	S294-G411 WeakPolarHBondContact OG-CA 3.22Å
412	R	91.5	Very high	92	Very high	164 Å²	164	76.1 Å²	76.1	62%	0.619	39%	0.391	S	S	*	.			trans	-122.8	165.6	175.5	-52.2	179.4	-179.7	165.8	0.7	110.5	S294 Y416	S294-R412 PolarHBondContact OG-N 3.21Å; R412-Y416 HydrophobicContact CB-CD1 3.55Å; R412-Y416 HydrophobicContact CB-CD2 4.36Å; R412-Y416 HydrophobicContact CB-CE1 3.82Å; R412-Y416 HydrophobicContact CB-CG 3.84Å; R412-Y416 HydrophobicContact CG-CD1 4.29Å; R412-Y416 HydrophobicContact CG-CD2 4.23Å; R412-Y416 HydrophobicContact CG-CE1 4.42Å; R412-Y416 HydrophobicContact CG-CE2 4.39Å; R412-Y416 HydrophobicContact CG-CG 4.18Å
413	Q	86.9	Confident	92	Very high	185 Å²	185	75 Å²	75	86%	0.864	39%	0.385	S	S	*	.	S	Bend	trans	-75.3	149	175.7	-66.1	-178	-2.7	0	0	111
414	K	90.9	Very high	92	Very high	133 Å²	133	80.9 Å²	80.9	58%	0.578	41%	0.412	S	S	*	.	S	Bend	trans	57.1	-167.4	-175.9	-57.9	-176.9	177.2	-179.1	0	111.9	W315	W315-K414 HydrophobicContact CZ2-CB 4.42Å
415	I	93.4	Very high	92.2	Very high	38 Å²	38	79.2 Å²	79.2	20%	0.195	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	132.9	173.5	-70.3	160.7	0	0	0	108.8	L291 C292 L293 W315 T317 H319 L323	L291-I415 HydrophobicContact CB-CG2 3.84Å; L291-I415 HydrophobicContact CD1-CG2 4.31Å; L291-I415 HydrophobicContact CD2-CG2 3.96Å; L291-I415 HydrophobicContact CG-CG2 4.24Å; C292-I415 WeakPolarHBondContact O-CA 3.45Å; L293-I415 HydrophobicContact CB-CG1 4.46Å; L293-I415 HydrophobicContact CD1-CG1 4.2Å; W315-I415 HydrophobicContact CH2-CD1 3.62Å; W315-I415 HydrophobicContact CH2-CG1 3.65Å; W315-I415 HydrophobicContact CZ3-CD1 3.85Å; W315-I415 HydrophobicContact CZ3-CG1 4.25Å; T317-I415 HydrophobicContact CG2-CD1 4.29Å; T317-I415 WeakPolarHBondContact OG1-CD1 3.34Å; H319-I415 HydrophobicContact CB-CD1 4.26Å; L323-I415 HydrophobicContact CD1-CD1 4.45Å; L323-I415 HydrophobicContact CD1-CG1 4.23Å; L323-I415 HydrophobicContact CD1-CG2 4.33Å
416	Y	94.8	Very high	92.4	Very high	23 Å²	23	74.9 Å²	74.9	9%	0.09	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	155.7	179	60	-86.4	0	0	0	110.9	C292 S294 R412 L418	C292-Y416 HydrophobicContact CB-CD2 4.42Å; C292-Y416 HydrophobicContact CB-CE2 3.95Å; C292-Y416 PolarHBondContact N-O 3.19Å; C292-Y416 WeakPolarHBondContact O-CD1 3.35Å; C292-Y416 PolarHBondContact O-N 2.65Å; C292-Y416 PolarHBondContact SG-OH 2.76Å; S294-Y416 WeakPolarHBondContact OG-CE1 3.28Å; S294-Y416 PolarHBondContact OG-OH 2.79Å; R412-Y416 HydrophobicContact CB-CD1 3.55Å; R412-Y416 HydrophobicContact CB-CD2 4.36Å; R412-Y416 HydrophobicContact CB-CE1 3.82Å; R412-Y416 HydrophobicContact CB-CG 3.84Å; R412-Y416 HydrophobicContact CG-CD1 4.29Å; R412-Y416 HydrophobicContact CG-CD2 4.23Å; R412-Y416 HydrophobicContact CG-CE1 4.42Å; R412-Y416 HydrophobicContact CG-CE2 4.39Å; R412-Y416 HydrophobicContact CG-CG 4.18Å; Y416-L418 HydrophobicContact CE2-CD2 4.24Å
417	S	94.4	Very high	92.4	Very high	72 Å²	72	71.6 Å²	71.6	50%	0.503	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	134.6	174.4	-170.5	0	0	0	0	111.1
418	L	93.3	Very high	92.2	Very high	12 Å²	12	73.5 Å²	73.5	6%	0.063	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-69.1	161.7	166.8	-70.1	175.5	0	0	0	111.2	G290 C292 W324 L365 I409 Y416 H423	G290-L418 WeakPolarHBondContact O-CB 3.45Å; G290-L418 PolarHBondContact O-N 2.85Å; C292-L418 HydrophobicContact CB-CD1 4.02Å; C292-L418 HydrophobicContact CB-CD2 3.56Å; C292-L418 HydrophobicContact CB-CG 3.53Å; W324-L418 HydrophobicContact CB-CD1 3.7Å; W324-L418 HydrophobicContact CD2-CD1 4.08Å; W324-L418 HydrophobicContact CG-CD1 3.6Å; L365-L418 HydrophobicContact CD1-CD1 4.32Å; L365-L418 HydrophobicContact CD2-CD1 4.26Å; I409-L418 HydrophobicContact CD1-CD2 4Å; Y416-L418 HydrophobicContact CE2-CD2 4.24Å; L418-H423 HydrophobicContact CB-CB 4.27Å
419	D	93.9	Very high	92.1	Very high	84 Å²	84	69.2 Å²	69.2	45%	0.449	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-63	126.6	164.8	-175.6	-27.2	0	0	0	108.4	K421 I422 H423	D419-K421 PolarHBondContact O-N 3.19Å; D419-K421 PolarHBondContact OD1-N 3.23Å; D419-I422 HydrophobicContact CB-CB 4.31Å; D419-I422 HydrophobicContact CB-CD1 4.06Å; D419-I422 HydrophobicContact CB-CG1 4.14Å; D419-I422 PolarHBondContact O-N 3.36Å; D419-H423 PolarHBondContact O-N 2.98Å
420	P	92.9	Very high	91.8	Very high	84 Å²	84	69 Å²	69	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-49.3	-33.9	178.2	-29.1	34.8	0	0	0	114.1	Q424	P420-Q424 WeakPolarHBondContact O-CB 3.4Å; P420-Q424 VanDerWaalsContact O-CG 3.27Å; P420-Q424 WeakPolarHBondContact O-CG 3.31Å; P420-Q424 PolarHBondContact O-N 3.46Å
421	K	92.8	Very high	91.5	Very high	121 Å²	121	69 Å²	69	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-68.7	-43.7	178.5	-65.1	-179.5	-178.2	178	0	112.3	Y18 D419 H423 A425	Y18-K421 PolarHBondContact OH-NZ 3.33Å; D419-K421 PolarHBondContact O-N 3.19Å; D419-K421 PolarHBondContact OD1-N 3.23Å; K421-H423 VanDerWaalsContact C-N 3.35Å; K421-A425 WeakPolarHBondContact O-CB 3.33Å; K421-A425 PolarHBondContact O-N 3.07Å
422	I	93.3	Very high	91.2	Very high	45 Å²	45	73.4 Å²	73.4	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-68.4	-41.1	178.5	-64.8	175.4	0	0	0	109.4	L365 F407 I409 D419 A425 A426	L365-I422 HydrophobicContact CD2-CG2 4.12Å; F407-I422 HydrophobicContact CB-CG2 4.19Å; F407-I422 HydrophobicContact CG-CG2 4.36Å; I409-I422 HydrophobicContact CG2-CD1 3.95Å; I409-I422 HydrophobicContact CG2-CG2 4.25Å; D419-I422 HydrophobicContact CB-CB 4.31Å; D419-I422 HydrophobicContact CB-CD1 4.06Å; D419-I422 HydrophobicContact CB-CG1 4.14Å; D419-I422 PolarHBondContact O-N 3.36Å; I422-A425 PolarHBondContact O-N 2.71Å; I422-A426 WeakPolarHBondContact O-CB 3.48Å; I422-A426 PolarHBondContact O-N 3.15Å
423	H	93.1	Very high	90.5	Very high	34 Å²	34	68.1 Å²	68.1	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-51.2	176.7	172.9	-136.5	0	0	0	112	D288 W324 L418 D419 K421 A425 A426 A427	D288-H423 IonicContact OD1-CE1 2.89Å; D288-H423 IonicContact OD1-NE2 3.54Å; D288-H423 PolarHBondContact OD1-NE2 2.8Å; D288-H423 IonicContact OD2-CD2 3.51Å; D288-H423 IonicContact OD2-CE1 2.83Å; D288-H423 IonicContact OD2-NE2 3.4Å; D288-H423 PolarHBondContact OD2-NE2 2.73Å; W324-H423 AromaticContact CE2-CD2 3.77Å; W324-H423 AromaticContact CZ2-CD2 3.87Å; W324-H423 AromaticContact NE1-CD2 3.46Å; W324-H423 PolarHBondContact NE1-CD2 3.05Å; W324-H423 AromaticContact NE1-NE2 3.71Å; L418-H423 HydrophobicContact CB-CB 4.27Å; D419-H423 PolarHBondContact O-N 2.98Å; K421-H423 VanDerWaalsContact C-N 3.35Å; H423-A425 PolarHBondContact O-N 3.32Å; H423-A426 PolarHBondContact O-N 2.95Å; H423-A427 WeakPolarHBondContact O-CB 3.48Å; H423-A427 PolarHBondContact O-N 3.07Å
424	Q	92.6	Very high	89.8	Confident	126 Å²	126	63.3 Å²	63.3	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-61.1	-44.4	177	-73	174	2.3	0	0	112.3	P420 A426 A427 N428	P420-Q424 WeakPolarHBondContact O-CB 3.4Å; P420-Q424 VanDerWaalsContact O-CG 3.27Å; P420-Q424 WeakPolarHBondContact O-CG 3.31Å; P420-Q424 PolarHBondContact O-N 3.46Å; Q424-A426 VanDerWaalsContact C-N 3.32Å; Q424-A426 PolarHBondContact O-N 2.64Å; Q424-A427 PolarHBondContact O-N 3.2Å; Q424-N428 WeakPolarHBondContact O-CB 3.43Å; Q424-N428 PolarHBondContact O-N 3.48Å; Q424-N428 PolarHBondContact O-ND2 3.01Å; Q424-N428 PolarHBondContact O-OD1 3.43Å
425	A	93.1	Very high	88.3	Confident	40 Å²	40	64.8 Å²	64.8	33%	0.331	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-40.9	177.7	0	0	0	0	0	112.1	F407 K421 I422 H423 A429	F407-A425 HydrophobicContact CE1-CB 4.12Å; F407-A425 HydrophobicContact CZ-CB 4Å; K421-A425 WeakPolarHBondContact O-CB 3.33Å; K421-A425 PolarHBondContact O-N 3.07Å; I422-A425 PolarHBondContact O-N 2.71Å; H423-A425 PolarHBondContact O-N 3.32Å; A425-A429 WeakPolarHBondContact O-CB 3.44Å; A425-A429 PolarHBondContact O-N 3.19Å
426	A	92.9	Very high	86.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-70.4	-42.5	178.4	0	0	0	0	0	112	W324 L365 L403 F407 I422 H423 Q424 A429 I430	W324-A426 HydrophobicContact CE3-CB 4.26Å; W324-A426 HydrophobicContact CH2-CB 3.45Å; W324-A426 VanDerWaalsContact CH2-CB 3.45Å; W324-A426 HydrophobicContact CZ2-CB 4.25Å; W324-A426 HydrophobicContact CZ3-CB 3.47Å; W324-A426 VanDerWaalsContact CZ3-CB 3.47Å; L365-A426 HydrophobicContact CD2-CB 3.86Å; L403-A426 HydrophobicContact CD1-CB 4.15Å; L403-A426 HydrophobicContact CD2-CB 3.97Å; L403-A426 WeakPolarHBondContact CD2-O 3.34Å; F407-A426 HydrophobicContact CD2-CB 4.19Å; F407-A426 HydrophobicContact CE2-CB 3.86Å; I422-A426 WeakPolarHBondContact O-CB 3.48Å; I422-A426 PolarHBondContact O-N 3.15Å; H423-A426 PolarHBondContact O-N 2.95Å; Q424-A426 VanDerWaalsContact C-N 3.32Å; Q424-A426 PolarHBondContact O-N 2.64Å; A426-A429 PolarHBondContact O-N 3.42Å; A426-I430 WeakPolarHBondContact O-CG1 3.26Å; A426-I430 PolarHBondContact O-N 3.2Å; A426-I430 VanDerWaalsContact O-N 3.08Å
427	A	91	Very high	84.3	Confident	23 Å²	23	75.3 Å²	75.3	19%	0.19	41%	0.407	C	S	.	.	H	α-helix	trans	-58.7	-49.2	175.9	0	0	0	0	0	111.2	W324 H423 Q424 A429 I430 E431	W324-A427 HydrophobicContact CZ2-CB 4.35Å; H423-A427 WeakPolarHBondContact O-CB 3.48Å; H423-A427 PolarHBondContact O-N 3.07Å; Q424-A427 PolarHBondContact O-N 3.2Å; A427-A429 VanDerWaalsContact C-N 3.3Å; A427-A429 PolarHBondContact O-N 2.93Å; A427-I430 PolarHBondContact O-N 2.69Å; A427-I430 VanDerWaalsContact O-N 3.15Å; A427-E431 PolarHBondContact O-N 3.47Å
428	N	90.4	Very high	83.8	Confident	87 Å²	87	75.5 Å²	75.5	47%	0.465	40%	0.402	S	S	.	.	H	α-helix	trans	-59.8	-40	176.3	-67	-12.1	0	0	0	112	Q424 I430 E431 M432	Q424-N428 WeakPolarHBondContact O-CB 3.43Å; Q424-N428 PolarHBondContact O-N 3.48Å; Q424-N428 PolarHBondContact O-ND2 3.01Å; Q424-N428 PolarHBondContact O-OD1 3.43Å; N428-I430 VanDerWaalsContact C-N 3.31Å; N428-I430 PolarHBondContact O-N 3.06Å; N428-E431 PolarHBondContact O-N 3.14Å; N428-M432 VanDerWaalsContact O-CG 3.29Å; N428-M432 WeakPolarHBondContact O-CG 3.46Å; N428-M432 PolarHBondContact O-N 3.41Å
429	A	91	Very high	83.3	Confident	11 Å²	11	78.8 Å²	78.8	9%	0.091	42%	0.42	C	S	.	.	H	α-helix	trans	-65	-33.5	178.8	0	0	0	0	0	112.8	L403 P404 A425 A426 A427 N433	L403-A429 HydrophobicContact CD2-CB 4Å; P404-A429 HydrophobicContact CG-CB 4.24Å; A425-A429 WeakPolarHBondContact O-CB 3.44Å; A425-A429 PolarHBondContact O-N 3.19Å; A426-A429 PolarHBondContact O-N 3.42Å; A427-A429 VanDerWaalsContact C-N 3.3Å; A427-A429 PolarHBondContact O-N 2.93Å; A429-N433 PolarHBondContact O-N 3.19Å
430	I	87.5	Confident	82.7	Confident	13 Å²	13	78.5 Å²	78.5	7%	0.067	42%	0.418	C	S	.	.	H	α-helix	trans	-72.2	-45.4	175.1	-65.7	-177	0	0	0	110.6	W324 C368 R401 L403 A426 A427 N428 M432 N433 V434	W324-I430 HydrophobicContact CH2-CD1 3.53Å; W324-I430 HydrophobicContact CH2-CG1 4.35Å; W324-I430 HydrophobicContact CZ3-CD1 3.65Å; C368-I430 HydrophobicContact CB-CD1 4.28Å; C368-I430 WeakPolarHBondContact SG-CD1 3.36Å; R401-I430 HydrophobicContact CB-CD1 4.49Å; R401-I430 HydrophobicContact CB-CG2 4.37Å; L403-I430 HydrophobicContact CD2-CD1 3.97Å; L403-I430 HydrophobicContact CD2-CG1 3.5Å; L403-I430 VanDerWaalsContact CD2-CG1 3.5Å; L403-I430 HydrophobicContact CG-CD1 4.32Å; L403-I430 HydrophobicContact CG-CG1 4.23Å; A426-I430 WeakPolarHBondContact O-CG1 3.26Å; A426-I430 PolarHBondContact O-N 3.2Å; A426-I430 VanDerWaalsContact O-N 3.08Å; A427-I430 PolarHBondContact O-N 2.69Å; A427-I430 VanDerWaalsContact O-N 3.15Å; N428-I430 VanDerWaalsContact C-N 3.31Å; N428-I430 PolarHBondContact O-N 3.06Å; I430-M432 VanDerWaalsContact C-N 3.31Å; I430-M432 PolarHBondContact O-N 3.05Å; I430-N433 PolarHBondContact O-N 3.19Å; I430-N433 VanDerWaalsContact O-N 3.12Å; I430-V434 HydrophobicContact CG2-CG2 4.48Å; I430-V434 WeakPolarHBondContact O-CG2 3.17Å; I430-V434 PolarHBondContact O-N 3.21Å; I430-V434 VanDerWaalsContact O-N 3.1Å
431	E	85.2	Confident	82.1	Confident	119 Å²	119	78.2 Å²	78.2	56%	0.556	41%	0.411	S	S	*	.	H	α-helix	trans	-59.7	-41.5	178.8	-71.2	179.3	-179	0	0	112	A427 N428 N433 V434 Q435	A427-E431 PolarHBondContact O-N 3.47Å; N428-E431 PolarHBondContact O-N 3.14Å; E431-N433 VanDerWaalsContact C-N 3.33Å; E431-N433 PolarHBondContact O-N 3.49Å; E431-V434 PolarHBondContact O-N 2.78Å; E431-Q435 PolarHBondContact O-N 3.38Å
432	M	81	Confident	81.4	Confident	127 Å²	127	75.5 Å²	75.5	63%	0.626	40%	0.403	S	S	*	.	H	α-helix	trans	-61.9	-39	175.1	-72.4	179.3	177.5	0	0	112.4	N428 I430 Q435 T436	N428-M432 VanDerWaalsContact O-CG 3.29Å; N428-M432 WeakPolarHBondContact O-CG 3.46Å; N428-M432 PolarHBondContact O-N 3.41Å; I430-M432 VanDerWaalsContact C-N 3.31Å; I430-M432 PolarHBondContact O-N 3.05Å; M432-Q435 PolarHBondContact O-N 3.5Å; M432-T436 WeakPolarHBondContact O-CG2 3.44Å; M432-T436 PolarHBondContact O-N 3.1Å; M432-T436 PolarHBondContact O-OG1 3.43Å
433	N	76.9	Confident	80.6	Confident	54 Å²	54	77.5 Å²	77.5	29%	0.289	42%	0.415	S	S	.	.	H	α-helix	trans	-71.4	-30.4	-179.3	-164.7	18.5	0	0	0	112.8	P404 A429 I430 E431 Q435 T436 N437	P404-N433 HydrophobicContact CG-CB 4.38Å; A429-N433 PolarHBondContact O-N 3.19Å; I430-N433 PolarHBondContact O-N 3.19Å; I430-N433 VanDerWaalsContact O-N 3.12Å; E431-N433 VanDerWaalsContact C-N 3.33Å; E431-N433 PolarHBondContact O-N 3.49Å; N433-Q435 VanDerWaalsContact C-N 3.29Å; N433-T436 WeakPolarHBondContact CA-OG1 3.37Å; N433-T436 PolarHBondContact O-N 3.06Å; N433-T436 PolarHBondContact O-OG1 3.38Å; N433-T436 VanDerWaalsContact O-OG1 3.06Å; N433-N437 PolarHBondContact O-N 2.9Å; N433-N437 PolarHBondContact O-ND2 3.24Å; N433-N437 PolarHBondContact OD1-ND2 2.88Å
434	V	70.5	Confident	79.8	Confident	84 Å²	84	80.6 Å²	80.6	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-72	-24.4	175.3	175.7	0	0	0	0	111.7	I430 E431 N437	I430-V434 HydrophobicContact CG2-CG2 4.48Å; I430-V434 WeakPolarHBondContact O-CG2 3.17Å; I430-V434 PolarHBondContact O-N 3.21Å; I430-V434 VanDerWaalsContact O-N 3.1Å; E431-V434 PolarHBondContact O-N 2.78Å; V434-N437 VanDerWaalsContact O-OXT 3.08Å
435	Q	61.1	Low	78.8	Confident	164 Å²	164	77.2 Å²	77.2	77%	0.766	42%	0.421	S	S	*	.	H	α-helix	trans	-83.1	-21.3	176	-69	174.4	2.8	0	0	113	E431 M432 N433	E431-Q435 PolarHBondContact O-N 3.38Å; M432-Q435 PolarHBondContact O-N 3.5Å; N433-Q435 VanDerWaalsContact C-N 3.29Å
436	T	58.1	Low	77.6	Confident	108 Å²	108	80.3 Å²	80.3	66%	0.663	43%	0.429	S	S	*	.	H	α-helix	trans	-93.5	-10.2	-177.3	51.9	0	0	0	0	114.4	M432 N433	M432-T436 WeakPolarHBondContact O-CG2 3.44Å; M432-T436 PolarHBondContact O-N 3.1Å; M432-T436 PolarHBondContact O-OG1 3.43Å; N433-T436 WeakPolarHBondContact CA-OG1 3.37Å; N433-T436 PolarHBondContact O-N 3.06Å; N433-T436 PolarHBondContact O-OG1 3.38Å; N433-T436 VanDerWaalsContact O-OG1 3.06Å
437	N	45.3	Very low	76.2	Confident	173 Å²	173	87.5 Å²	87.5	93%	0.925	47%	0.468	S	S	*	.			trans	-120.1	0	174.2	-61.6	-69	0	0	0	109.6	N433 V434	N433-N437 PolarHBondContact O-N 2.9Å; N433-N437 PolarHBondContact O-ND2 3.24Å; N433-N437 PolarHBondContact OD1-ND2 2.88Å; V434-N437 VanDerWaalsContact O-OXT 3.08Å

Retrieved 437 of 437 residues in 346.7 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).