A0A077Z175_TRITR Loading...

I-set domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z175, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 330 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	31.3	Very low	251 Å²	251	159.6 Å²	159.6	100%	1.236	88%	0.879	S	S	*	*				0	129.1	0	-74.4	179.8	-151.4	0	0	108.5
2	I	27.9	Very low	30.9	Very low	157 Å²	157	157.9 Å²	157.9	81%	0.805	88%	0.876	S	S	*	*			trans	-69.5	137.9	179.6	-65.7	157.7	0	0	0	109.8
3	R	32.3	Very low	30.8	Very low	244 Å²	244	159.7 Å²	159.7	92%	0.921	88%	0.878	S	S	*	*			trans	-163.7	107.3	130.3	-107	173.2	-172.5	-171.4	2.5	112.4
4	S	30.4	Very low	30.7	Very low	104 Å²	104	160.7 Å²	160.7	73%	0.727	87%	0.873	S	S	*	*			trans	-57.1	142.3	157.1	46.3	0	0	0	0	112.7
5	G	34.6	Very low	30.4	Very low	80 Å²	80	157.1 Å²	157.1	83%	0.825	86%	0.864	S	S	*	*			trans	-147.4	84.9	167	0	0	0	0	0	110.1
6	T	30.4	Very low	30.5	Very low	146 Å²	146	163 Å²	163	90%	0.896	87%	0.87	S	S	*	*			trans	-77.9	123.2	168.8	44.7	0	0	0	0	109.9
7	G	32.8	Very low	30.3	Very low	79 Å²	79	164.4 Å²	164.4	81%	0.814	87%	0.866	S	S	*	*			trans	-131.9	89.9	171.6	0	0	0	0	0	110.5
8	R	29.2	Very low	30.2	Very low	255 Å²	255	163.6 Å²	163.6	96%	0.962	86%	0.861	S	S	*	*			trans	-74	125.6	169.2	-126.5	179.2	-165.4	-172.1	4	108
9	C	32.3	Very low	30	Very low	126 Å²	126	163.4 Å²	163.4	85%	0.851	86%	0.856	S	S	*	*			trans	-140.6	102.7	155.8	-153.5	0	0	0	0	108.1
10	G	27	Very low	29.8	Very low	69 Å²	69	163.8 Å²	163.8	71%	0.711	85%	0.853	S	S	*	*			trans	-82.5	138.5	168.4	0	0	0	0	0	109.9
11	R	32.3	Very low	29.8	Very low	245 Å²	245	162.2 Å²	162.2	93%	0.925	85%	0.85	S	S	*	*			trans	-142.9	118.6	145.3	-87.5	-170.4	-162.8	-179.7	5.7	109
12	V	27.3	Very low	29.8	Very low	139 Å²	139	156.2 Å²	156.2	84%	0.842	83%	0.83	S	S	*	*			trans	-73.7	130.2	163.5	172.2	0	0	0	0	107.4
13	M	29.9	Very low	30	Very low	181 Å²	181	160.8 Å²	160.8	89%	0.892	84%	0.837	S	S	*	*			trans	-149.4	117.5	150.2	-86.6	-126.4	-88.5	0	0	110.9
14	E	28.3	Very low	30.2	Very low	174 Å²	174	153.7 Å²	153.7	81%	0.813	83%	0.831	S	S	*	*			trans	12.3	120.2	158	-73.6	172.1	148.7	0	0	123.6
15	S	27	Very low	30.9	Very low	106 Å²	106	154 Å²	154	74%	0.741	83%	0.833	S	S	*	*				2.4	113.6	129.2	162.3	0	0	0	0	118.6
16	R	31	Very low	31.5	Very low	252 Å²	252	159 Å²	159	95%	0.951	84%	0.835	S	S	*	*			trans	-127.8	129.4	138.3	-77.9	-172.9	177.3	-172.3	-0.6	110.4
17	K	27.3	Very low	32.3	Very low	187 Å²	187	154.6 Å²	154.6	81%	0.813	82%	0.818	S	S	*	*			trans	-81	164.8	177.6	-82.2	177.7	173.3	176	0	112.3
18	L	28.8	Very low	33.2	Very low	149 Å²	149	158.1 Å²	158.1	78%	0.78	81%	0.814	S	S	*	*			trans	103.5	127	165.5	-59	150.3	0	0	0	112.4
19	Q	27	Very low	34.2	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	80%	0.796	S	S	*	*			cis	-167	142.3	6.8	-109.9	170.4	-11.1	0	0	110.1
20	H	25.2	Very low	35.4	Very low	171 Å²	171	148.1 Å²	148.1	79%	0.792	79%	0.787	S	S	*	*			trans	50.4	139.8	144.4	-85.9	-67.8	0	0	0	127.4
21	T	30.6	Very low	36.9	Very low	130 Å²	130	151.6 Å²	151.6	80%	0.798	78%	0.783	S	S	*	*			trans	87.5	143.9	163.6	71.6	0	0	0	0	115.6
22	P	33.8	Very low	38.2	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	77%	0.767	S	S	*	*			cis	-144.7	171.1	43.8	37.8	-15.3	0	0	0	118.3
23	R	32.3	Very low	39.7	Very low	253 Å²	253	142.9 Å²	142.9	96%	0.955	75%	0.754	S	S	*	*			trans	-116.3	122.5	170	-167	178.8	-165.8	175	4	108.3
24	A	37.4	Very low	41.3	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	74%	0.741	S	S	*	*			trans	-141.2	128.5	175.4	0	0	0	0	0	109.6
25	S	45.5	Very low	42.8	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	72%	0.723	S	S	*	*			trans	-172.9	65.2	151.9	65.5	0	0	0	0	111.6
26	Q	46.7	Very low	44.2	Very low	185 Å²	185	136.9 Å²	136.9	86%	0.864	72%	0.715	S	S	*	*	S	Bend	trans	-132.1	-9.8	159.6	-151.9	167.5	17.7	0	0	112.3
27	G	46.3	Very low	45.6	Very low	53 Å²	53	129 Å²	129	55%	0.546	70%	0.696	S	S	.	*	S	Bend	trans	-82.7	-13.6	-179.7	0	0	0	0	0	116.1	A29 C30 F31	G27-A29 PolarHBondContact O-N 3.47Å; G27-C30 PolarHBondContact O-N 3.47Å; G27-F31 PolarHBondContact O-N 3.4Å
28	Q	51.6	Low	46.8	Very low	153 Å²	153	123.9 Å²	123.9	72%	0.715	68%	0.676	S	S	*	*	H	α-helix	trans	-69.8	-33.1	-175.1	-81.6	179.9	-25	0	0	113.2	F31	Q28-F31 PolarHBondContact O-N 3.39Å
29	A	50.9	Low	47.8	Very low	73 Å²	73	120.4 Å²	120.4	60%	0.603	66%	0.661	S	S	*	*	H	α-helix	trans	-69.9	-35.7	178.7	0	0	0	0	0	112.5	G27 F31	G27-A29 PolarHBondContact O-N 3.47Å; A29-F31 VanDerWaalsContact C-N 3.32Å; A29-F31 PolarHBondContact O-N 3.33Å
30	C	56.9	Low	49	Very low	97 Å²	97	117.9 Å²	117.9	66%	0.655	66%	0.657	S	S	*	*	H	α-helix	trans	-69.5	-29.6	176.6	-75.7	0	0	0	0	112.9	G27 F34	G27-C30 PolarHBondContact O-N 3.47Å; C30-F34 PolarHBondContact O-N 3.18Å
31	F	59.5	Low	50.3	Low	143 Å²	143	114 Å²	114	63%	0.627	64%	0.641	S	S	*	*	H	α-helix	trans	-69	-37.8	-177.7	-149.8	-98.1	0	0	0	112.2	G27 Q28 A29 F34 I35	G27-F31 PolarHBondContact O-N 3.4Å; Q28-F31 PolarHBondContact O-N 3.39Å; A29-F31 VanDerWaalsContact C-N 3.32Å; A29-F31 PolarHBondContact O-N 3.33Å; F31-F34 PolarHBondContact O-N 2.87Å; F31-I35 HydrophobicContact CD1-CD1 3.89Å; F31-I35 HydrophobicContact CD1-CG1 4.41Å; F31-I35 HydrophobicContact CE1-CD1 3.9Å; F31-I35 HydrophobicContact CE1-CG1 4.47Å; F31-I35 WeakPolarHBondContact O-CG1 3.46Å; F31-I35 PolarHBondContact O-N 3.47Å
32	I	59.5	Low	50.9	Low	114 Å²	114	112.1 Å²	112.1	59%	0.585	63%	0.633	S	S	*	*	H	α-helix	trans	-68.7	-41.8	-179.9	-61.5	170.9	0	0	0	110.9	F34 I35 L36	I32-F34 VanDerWaalsContact C-N 3.29Å; I32-F34 PolarHBondContact O-N 3.33Å; I32-I35 PolarHBondContact O-N 3.28Å; I32-L36 PolarHBondContact O-N 3.22Å
33	C	58.8	Low	51.1	Low	86 Å²	86	113.5 Å²	113.5	58%	0.581	63%	0.633	S	S	*	*	H	α-helix	trans	-62.2	-35.7	175.2	-75.8	0	0	0	0	112.6	L36 V37	C33-L36 PolarHBondContact O-N 3.49Å; C33-V37 PolarHBondContact O-N 3.25Å
34	F	62.2	Low	51.5	Low	140 Å²	140	105 Å²	105	61%	0.614	62%	0.617	S	S	*	*	H	α-helix	trans	-69.2	-37.6	179.2	-154.1	-98.2	0	0	0	112.3	C30 F31 I32 V37 L38	C30-F34 PolarHBondContact O-N 3.18Å; F31-F34 PolarHBondContact O-N 2.87Å; I32-F34 VanDerWaalsContact C-N 3.29Å; I32-F34 PolarHBondContact O-N 3.33Å; F34-V37 PolarHBondContact O-N 2.57Å; F34-L38 HydrophobicContact CD1-CD1 3.67Å; F34-L38 HydrophobicContact CD1-CG 4.33Å; F34-L38 HydrophobicContact CE1-CD1 3.79Å; F34-L38 HydrophobicContact CE1-CG 4.35Å; F34-L38 WeakPolarHBondContact O-CG 3.44Å; F34-L38 PolarHBondContact O-N 3.33Å
35	I	61.1	Low	51.4	Low	85 Å²	85	110.1 Å²	110.1	44%	0.436	63%	0.625	S	S	.	*	H	α-helix	trans	-65.2	-40.6	176.9	-68.3	-178.3	0	0	0	111.3	F31 I32 V37 L38 T39	F31-I35 HydrophobicContact CD1-CD1 3.89Å; F31-I35 HydrophobicContact CD1-CG1 4.41Å; F31-I35 HydrophobicContact CE1-CD1 3.9Å; F31-I35 HydrophobicContact CE1-CG1 4.47Å; F31-I35 WeakPolarHBondContact O-CG1 3.46Å; F31-I35 PolarHBondContact O-N 3.47Å; I32-I35 PolarHBondContact O-N 3.28Å; I35-V37 PolarHBondContact O-N 3.5Å; I35-L38 PolarHBondContact O-N 3.26Å; I35-T39 HydrophobicContact CG2-CG2 4.45Å; I35-T39 WeakPolarHBondContact O-CG2 3.46Å; I35-T39 PolarHBondContact O-N 2.81Å
36	L	56.7	Low	51.4	Low	110 Å²	110	106.7 Å²	106.7	58%	0.576	61%	0.607	S	S	*	*	H	α-helix	trans	-63.5	-40.5	-179.7	-68.7	172.3	0	0	0	112.3	I32 C33 L38 T39 T40	I32-L36 PolarHBondContact O-N 3.22Å; C33-L36 PolarHBondContact O-N 3.49Å; L36-L38 VanDerWaalsContact C-N 3.34Å; L36-L38 PolarHBondContact O-N 3.31Å; L36-T39 PolarHBondContact O-N 3.04Å; L36-T39 PolarHBondContact O-OG1 3.14Å; L36-T40 PolarHBondContact O-N 3.3Å
37	V	60	Low	51.4	Low	88 Å²	88	103.2 Å²	103.2	53%	0.533	60%	0.603	S	S	.	*	H	α-helix	trans	-67.7	-33	176.6	178.2	0	0	0	0	112.1	C33 F34 I35 T40 L41	C33-V37 PolarHBondContact O-N 3.25Å; F34-V37 PolarHBondContact O-N 2.57Å; I35-V37 PolarHBondContact O-N 3.5Å; V37-T40 PolarHBondContact O-OG1 3.37Å; V37-L41 HydrophobicContact CG1-CD1 4.19Å; V37-L41 WeakPolarHBondContact O-CG 3.44Å; V37-L41 PolarHBondContact O-N 3.42Å
38	L	51.6	Low	51.5	Low	79 Å²	79	104.8 Å²	104.8	41%	0.414	61%	0.605	S	S	.	*	H	α-helix	trans	-71.5	-35.9	176.4	-73.5	168.9	0	0	0	112.4	F34 I35 L36 L41 C42	F34-L38 HydrophobicContact CD1-CD1 3.67Å; F34-L38 HydrophobicContact CD1-CG 4.33Å; F34-L38 HydrophobicContact CE1-CD1 3.79Å; F34-L38 HydrophobicContact CE1-CG 4.35Å; F34-L38 WeakPolarHBondContact O-CG 3.44Å; F34-L38 PolarHBondContact O-N 3.33Å; I35-L38 PolarHBondContact O-N 3.26Å; L36-L38 VanDerWaalsContact C-N 3.34Å; L36-L38 PolarHBondContact O-N 3.31Å; L38-L41 PolarHBondContact O-N 2.76Å; L38-C42 PolarHBondContact O-N 3.06Å; L38-C42 VanDerWaalsContact O-N 3.14Å; L38-C42 PolarHBondContact O-SG 3.06Å
39	T	51.1	Low	51.2	Low	75 Å²	75	100.8 Å²	100.8	46%	0.46	59%	0.592	S	S	.	*	H	α-helix	trans	-67.6	-35.7	177.9	57	0	0	0	0	112.8	I35 L36 L41 C42	I35-T39 HydrophobicContact CG2-CG2 4.45Å; I35-T39 WeakPolarHBondContact O-CG2 3.46Å; I35-T39 PolarHBondContact O-N 2.81Å; L36-T39 PolarHBondContact O-N 3.04Å; L36-T39 PolarHBondContact O-OG1 3.14Å; T39-L41 VanDerWaalsContact C-N 3.29Å; T39-L41 PolarHBondContact O-N 3.37Å; T39-C42 PolarHBondContact O-N 3.17Å
40	T	52	Low	50.8	Low	108 Å²	108	100.4 Å²	100.4	66%	0.663	59%	0.588	S	S	*	*	H	α-helix	trans	-69.3	-29.8	175.6	57.4	0	0	0	0	112.2	L36 V37	L36-T40 PolarHBondContact O-N 3.3Å; V37-T40 PolarHBondContact O-OG1 3.37Å
41	L	51	Low	50.3	Low	89 Å²	89	103 Å²	103	47%	0.466	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-5.7	175.9	-69.7	170.2	0	0	0	114.3	V37 L38 T39 K53	V37-L41 HydrophobicContact CG1-CD1 4.19Å; V37-L41 WeakPolarHBondContact O-CG 3.44Å; V37-L41 PolarHBondContact O-N 3.42Å; L38-L41 PolarHBondContact O-N 2.76Å; T39-L41 VanDerWaalsContact C-N 3.29Å; T39-L41 PolarHBondContact O-N 3.37Å; L41-K53 PolarHBondContact O-NZ 3.43Å
42	C	43.4	Very low	49.5	Very low	91 Å²	91	100.5 Å²	100.5	62%	0.615	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-10.1	179.4	-79.8	0	0	0	0	114.2	L38 T39 A44	L38-C42 PolarHBondContact O-N 3.06Å; L38-C42 VanDerWaalsContact O-N 3.14Å; L38-C42 PolarHBondContact O-SG 3.06Å; T39-C42 PolarHBondContact O-N 3.17Å; C42-A44 PolarHBondContact O-N 3.21Å
43	N	38.5	Very low	48.7	Very low	155 Å²	155	98.6 Å²	98.6	83%	0.829	57%	0.565	S	S	*	*	S	Bend	trans	-96.4	26.5	-179.5	-73.1	-2.5	0	0	0	114.2
44	A	41.2	Very low	48.2	Very low	74 Å²	74	100.4 Å²	100.4	61%	0.612	56%	0.564	S	S	*	*			trans	-127	102.7	171.7	0	0	0	0	0	110	C42	C42-A44 PolarHBondContact O-N 3.21Å
45	E	35.1	Very low	47.3	Very low	204 Å²	204	99.3 Å²	99.3	95%	0.953	56%	0.562	S	S	*	*			trans	-86.2	121.8	179.8	-67.6	-179.8	165.8	0	0	110.6
46	G	44.3	Very low	46.6	Very low	38 Å²	38	102.5 Å²	102.5	39%	0.392	58%	0.577	S	S	.	*			trans	-177.7	128.4	174.6	0	0	0	0	0	113	S48 V49 A50	G46-S48 PolarHBondContact O-N 3.43Å; G46-V49 PolarHBondContact O-N 2.94Å; G46-A50 PolarHBondContact O-N 2.82Å
47	S	48.3	Very low	45.9	Very low	112 Å²	112	103.1 Å²	103.1	78%	0.783	58%	0.58	S	S	*	*	H	α-helix	trans	-61.4	-36.1	-173.1	-176.7	0	0	0	0	114.1	V49 A50 Y51	S47-V49 PolarHBondContact O-N 3.09Å; S47-A50 PolarHBondContact O-N 3.47Å; S47-Y51 PolarHBondContact O-N 3.39Å
48	S	47.1	Very low	45.2	Very low	86 Å²	86	103.7 Å²	103.7	60%	0.601	58%	0.577	S	S	*	*	H	α-helix	trans	-69.4	-32.6	178.8	53.6	0	0	0	0	113	G46 L52	G46-S48 PolarHBondContact O-N 3.43Å; S48-L52 WeakPolarHBondContact O-CB 3.43Å; S48-L52 PolarHBondContact O-N 3.01Å; S48-L52 VanDerWaalsContact O-N 3.13Å
49	V	46	Very low	44.7	Very low	70 Å²	70	109.7 Å²	109.7	42%	0.424	60%	0.599	S	S	.	*	H	α-helix	trans	-76.6	-34.2	178.5	-177.6	0	0	0	0	111.5	G46 S47 Y51 L52 K53	G46-V49 PolarHBondContact O-N 2.94Å; S47-V49 PolarHBondContact O-N 3.09Å; V49-Y51 VanDerWaalsContact C-N 3.34Å; V49-L52 PolarHBondContact O-N 2.97Å; V49-K53 HydrophobicContact CG1-CD 4.39Å; V49-K53 HydrophobicContact CG1-CG 4.4Å; V49-K53 VanDerWaalsContact O-CB 3.28Å; V49-K53 WeakPolarHBondContact O-CB 3.18Å; V49-K53 WeakPolarHBondContact O-CG 2.96Å; V49-K53 PolarHBondContact O-N 2.64Å
50	A	42.8	Very low	44.3	Very low	64 Å²	64	110.7 Å²	110.7	53%	0.529	60%	0.602	S	S	.	*	H	α-helix	trans	-64.5	-38.3	175.7	0	0	0	0	0	112.1	G46 S47 K54	G46-A50 PolarHBondContact O-N 2.82Å; S47-A50 PolarHBondContact O-N 3.47Å; A50-K54 PolarHBondContact O-N 3.27Å; A50-K54 VanDerWaalsContact O-N 3.11Å
51	Y	45.5	Very low	44.2	Very low	151 Å²	151	112.4 Å²	112.4	59%	0.592	61%	0.607	S	S	*	*	H	α-helix	trans	-73.4	-40.5	176.2	-166.5	-96.3	0	0	0	112.4	S47 V49 K54 M55	S47-Y51 PolarHBondContact O-N 3.39Å; V49-Y51 VanDerWaalsContact C-N 3.34Å; Y51-K54 WeakPolarHBondContact O-CB 3.37Å; Y51-K54 PolarHBondContact O-N 3.33Å; Y51-K54 VanDerWaalsContact O-N 3.16Å; Y51-M55 HydrophobicContact CD1-SD 4.06Å; Y51-M55 HydrophobicContact CE1-CG 4.29Å; Y51-M55 HydrophobicContact CE1-SD 3.66Å; Y51-M55 PolarHBondContact O-N 3.28Å
52	L	43.5	Very low	43.9	Very low	92 Å²	92	112.6 Å²	112.6	48%	0.482	62%	0.616	S	S	.	*	H	α-helix	trans	-64.5	-39.4	172.5	-83.4	162	0	0	0	112.5	S48 V49 K54 M55 M56	S48-L52 WeakPolarHBondContact O-CB 3.43Å; S48-L52 PolarHBondContact O-N 3.01Å; S48-L52 VanDerWaalsContact O-N 3.13Å; V49-L52 PolarHBondContact O-N 2.97Å; L52-K54 VanDerWaalsContact C-N 3.26Å; L52-K54 PolarHBondContact O-N 3.45Å; L52-M55 PolarHBondContact O-N 3Å; L52-M56 WeakPolarHBondContact O-CB 3.43Å; L52-M56 WeakPolarHBondContact O-CG 3.44Å; L52-M56 PolarHBondContact O-N 3.16Å
53	K	42.9	Very low	43.8	Very low	73 Å²	73	114.7 Å²	114.7	32%	0.317	62%	0.618	S	S	.	*	H	α-helix	trans	-58.5	-40.5	171.1	-85.6	179.1	-180	174.9	0	110.6	L41 V49 M56 L57	L41-K53 PolarHBondContact O-NZ 3.43Å; V49-K53 HydrophobicContact CG1-CD 4.39Å; V49-K53 HydrophobicContact CG1-CG 4.4Å; V49-K53 VanDerWaalsContact O-CB 3.28Å; V49-K53 WeakPolarHBondContact O-CB 3.18Å; V49-K53 WeakPolarHBondContact O-CG 2.96Å; V49-K53 PolarHBondContact O-N 2.64Å; K53-M56 PolarHBondContact O-N 3.41Å; K53-L57 HydrophobicContact CB-CD1 4.09Å; K53-L57 HydrophobicContact CG-CD1 4.14Å; K53-L57 WeakPolarHBondContact O-CA 3.23Å; K53-L57 WeakPolarHBondContact O-CB 3.21Å; K53-L57 WeakPolarHBondContact O-CG 3.4Å; K53-L57 PolarHBondContact O-N 3.08Å
54	K	47.1	Very low	43.8	Very low	125 Å²	125	117.8 Å²	117.8	54%	0.543	62%	0.618	S	S	.	*	H	α-helix	trans	-62.2	-44.3	175.1	-166.3	174.1	-179.6	-179.2	0	111.7	A50 Y51 L52 E58	A50-K54 PolarHBondContact O-N 3.27Å; A50-K54 VanDerWaalsContact O-N 3.11Å; Y51-K54 WeakPolarHBondContact O-CB 3.37Å; Y51-K54 PolarHBondContact O-N 3.33Å; Y51-K54 VanDerWaalsContact O-N 3.16Å; L52-K54 VanDerWaalsContact C-N 3.26Å; L52-K54 PolarHBondContact O-N 3.45Å; K54-E58 WeakPolarHBondContact CE-OE1 3.12Å; K54-E58 HydrophobicContact CG-CG 4.39Å; K54-E58 WeakPolarHBondContact CG-OE1 3.36Å; K54-E58 VanDerWaalsContact O-CB 3.23Å; K54-E58 WeakPolarHBondContact O-CB 3.28Å; K54-E58 WeakPolarHBondContact O-CG 3.35Å; K54-E58 PolarHBondContact O-N 3.11Å; K54-E58 VanDerWaalsContact O-N 3.09Å
55	M	44.1	Very low	43.7	Very low	116 Å²	116	119 Å²	119	57%	0.571	62%	0.618	S	S	*	*	H	α-helix	trans	-70.6	-32.4	177.4	-70.7	-178.8	53	0	0	114.6	Y51 L52	Y51-M55 HydrophobicContact CD1-SD 4.06Å; Y51-M55 HydrophobicContact CE1-CG 4.29Å; Y51-M55 HydrophobicContact CE1-SD 3.66Å; Y51-M55 PolarHBondContact O-N 3.28Å; L52-M55 PolarHBondContact O-N 3Å
56	M	46.5	Very low	44	Very low	153 Å²	153	115 Å²	115	75%	0.754	61%	0.61	S	S	*	*	H	α-helix	trans	-91.6	-25.7	-177.3	-67.3	-178	67.4	0	0	113.5	L52 K53	L52-M56 WeakPolarHBondContact O-CB 3.43Å; L52-M56 WeakPolarHBondContact O-CG 3.44Å; L52-M56 PolarHBondContact O-N 3.16Å; K53-M56 PolarHBondContact O-N 3.41Å
57	L	41.8	Very low	44.2	Very low	122 Å²	122	118 Å²	118	64%	0.639	62%	0.621	S	S	*	*	H	α-helix	trans	-103.2	-5.8	-179.7	-62.1	168.1	0	0	0	113.7	K53 K59	K53-L57 HydrophobicContact CB-CD1 4.09Å; K53-L57 HydrophobicContact CG-CD1 4.14Å; K53-L57 WeakPolarHBondContact O-CA 3.23Å; K53-L57 WeakPolarHBondContact O-CB 3.21Å; K53-L57 WeakPolarHBondContact O-CG 3.4Å; K53-L57 PolarHBondContact O-N 3.08Å; L57-K59 PolarHBondContact O-N 3.4Å
58	E	46.5	Very low	44.2	Very low	101 Å²	101	117.4 Å²	117.4	47%	0.472	61%	0.605	S	S	.	*			trans	-70.4	66.5	160	-79.1	175.3	-173.6	0	0	109.3	K54 D60	K54-E58 WeakPolarHBondContact CE-OE1 3.12Å; K54-E58 HydrophobicContact CG-CG 4.39Å; K54-E58 WeakPolarHBondContact CG-OE1 3.36Å; K54-E58 VanDerWaalsContact O-CB 3.23Å; K54-E58 WeakPolarHBondContact O-CB 3.28Å; K54-E58 WeakPolarHBondContact O-CG 3.35Å; K54-E58 PolarHBondContact O-N 3.11Å; K54-E58 VanDerWaalsContact O-N 3.09Å; E58-D60 PolarHBondContact O-N 2.8Å
59	K	40.8	Very low	44.8	Very low	204 Å²	204	119 Å²	119	89%	0.887	61%	0.606	S	S	*	*			trans	-74.5	42.4	150	-144.5	-176.7	-168.2	-178.4	0	108.5	L57 D61	L57-K59 PolarHBondContact O-N 3.4Å; K59-D61 PolarHBondContact O-N 3.44Å
60	D	42.5	Very low	45.5	Very low	97 Å²	97	117.4 Å²	117.4	52%	0.519	60%	0.595	S	S	.	*			trans	-82.1	101.2	173.4	-170.8	40.4	0	0	0	106.6	E58 S62 M63	E58-D60 PolarHBondContact O-N 2.8Å; D60-S62 PolarHBondContact O-N 3.03Å; D60-S62 WeakPolarHBondContact OD2-CB 3.38Å; D60-S62 PolarHBondContact OD2-OG 2.8Å; D60-M63 PolarHBondContact O-N 2.82Å
61	D	50.5	Low	46.6	Very low	143 Å²	143	118.9 Å²	118.9	77%	0.765	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	2.5	179.8	-164.3	38.6	0	0	0	112.7	K59	K59-D61 PolarHBondContact O-N 3.44Å
62	S	43.6	Very low	48	Very low	93 Å²	93	113.9 Å²	113.9	65%	0.65	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-20.9	178.9	95.2	0	0	0	0	114.3	D60 R64	D60-S62 PolarHBondContact O-N 3.03Å; D60-S62 WeakPolarHBondContact OD2-CB 3.38Å; D60-S62 PolarHBondContact OD2-OG 2.8Å; S62-R64 PolarHBondContact O-N 3.17Å
63	M	41.8	Very low	49.5	Very low	136 Å²	136	112.2 Å²	112.2	67%	0.67	56%	0.564	S	S	*	*			trans	-96.8	63.3	177.3	-161.6	129.8	70.9	0	0	112	D60 T65	D60-M63 PolarHBondContact O-N 2.82Å; M63-T65 PolarHBondContact O-N 2.85Å
64	R	37.5	Very low	51.1	Low	220 Å²	220	112.5 Å²	112.5	83%	0.83	57%	0.569	S	S	*	*			trans	-78.8	26.5	-178.4	-146.7	179.8	-164.7	-174.8	5.9	114.8	S62 P66	S62-R64 PolarHBondContact O-N 3.17Å; R64-P66 WeakPolarHBondContact O-CD 3.28Å
65	T	39.4	Very low	52.9	Low	99 Å²	99	115 Å²	115	61%	0.607	58%	0.58	S	S	*	*	S	Bend	trans	-85.4	114.2	160.1	53.2	0	0	0	0	106.9	M63 V67	M63-T65 PolarHBondContact O-N 2.85Å; T65-V67 PolarHBondContact O-N 3.42Å
66	P	42.4	Very low	55	Low	119 Å²	119	111.6 Å²	111.6	77%	0.773	57%	0.566	S	S	*	*			trans	-54.6	118.6	168.4	-8.4	19.5	0	0	0	106	R64 E68	R64-P66 WeakPolarHBondContact O-CD 3.28Å; P66-E68 VanDerWaalsContact C-N 3.26Å; P66-E68 PolarHBondContact O-N 2.88Å
67	V	47.9	Very low	57.1	Low	103 Å²	103	106.9 Å²	106.9	62%	0.624	55%	0.548	S	S	*	.			trans	-59.5	104.5	166	177.3	0	0	0	0	104.5	T65 L69 I136	T65-V67 PolarHBondContact O-N 3.42Å; V67-L69 VanDerWaalsContact C-N 3.3Å; V67-L69 PolarHBondContact O-N 2.83Å; V67-I136 HydrophobicContact CG1-CG2 3.65Å
68	E	49.1	Very low	59.7	Low	98 Å²	98	102.1 Å²	102.1	46%	0.458	52%	0.523	S	S	.	.			trans	-68.9	97.9	177.8	-167.3	171.8	-168.4	0	0	106.7	P66 R71	P66-E68 VanDerWaalsContact C-N 3.26Å; P66-E68 PolarHBondContact O-N 2.88Å; E68-R71 VanDerWaalsContact CD-CZ 3.47Å; E68-R71 IonicContact OE1-CZ 3.93Å; E68-R71 IonicContact OE1-NE 3.66Å; E68-R71 PolarHBondContact OE1-NE 2.66Å; E68-R71 IonicContact OE1-NH2 2.77Å; E68-R71 PolarHBondContact OE1-NH2 2.72Å; E68-R71 IonicContact OE2-CZ 2.74Å; E68-R71 VanDerWaalsContact OE2-CZ 3.29Å; E68-R71 IonicContact OE2-NE 3.77Å; E68-R71 PolarHBondContact OE2-NE 2.92Å; E68-R71 IonicContact OE2-NH2 3.12Å; E68-R71 PolarHBondContact OE2-NH2 3.42Å
69	L	59.5	Low	62.1	Low	120 Å²	120	101.7 Å²	101.7	63%	0.628	52%	0.521	S	S	*	.			trans	-59.4	154.5	177.7	-163.3	68.8	0	0	0	109.3	V67 R71 L132	V67-L69 VanDerWaalsContact C-N 3.3Å; V67-L69 PolarHBondContact O-N 2.83Å; L69-R71 PolarHBondContact O-N 2.82Å; L69-L132 HydrophobicContact CD1-CD1 4.42Å
70	L	60	Low	64.9	Low	36 Å²	36	93.8 Å²	93.8	19%	0.188	49%	0.488	C	S	.	.			trans	-24	124.8	-175.9	-66.6	174.3	0	0	0	114.8	L72 L132 N135 T140	L70-L72 PolarHBondContact O-N 2.84Å; L70-L132 HydrophobicContact CD1-CD1 3.24Å; L70-L132 HydrophobicContact CD2-CD1 4.27Å; L70-L132 HydrophobicContact CG-CD1 3.61Å; L70-N135 HydrophobicContact CD2-CB 3.55Å; L70-N135 WeakPolarHBondContact CD2-O 3.36Å; L70-T140 HydrophobicContact CD2-CG2 4.45Å
71	R	66.6	Low	67.5	Low	96 Å²	96	91.6 Å²	91.6	36%	0.362	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	93.5	170.2	-70.1	-174.3	178.9	169.3	3.3	109.4	E68 L69 V73 K138 E139 T140	E68-R71 VanDerWaalsContact CD-CZ 3.47Å; E68-R71 IonicContact OE1-CZ 3.93Å; E68-R71 IonicContact OE1-NE 3.66Å; E68-R71 PolarHBondContact OE1-NE 2.66Å; E68-R71 IonicContact OE1-NH2 2.77Å; E68-R71 PolarHBondContact OE1-NH2 2.72Å; E68-R71 IonicContact OE2-CZ 2.74Å; E68-R71 VanDerWaalsContact OE2-CZ 3.29Å; E68-R71 IonicContact OE2-NE 3.77Å; E68-R71 PolarHBondContact OE2-NE 2.92Å; E68-R71 IonicContact OE2-NH2 3.12Å; E68-R71 PolarHBondContact OE2-NH2 3.42Å; L69-R71 PolarHBondContact O-N 2.82Å; R71-V73 PolarHBondContact O-N 3.45Å; R71-K138 PolarHBondContact N-O 2.84Å; R71-E139 HydrophobicContact CB-CG 4.16Å; R71-E139 WeakPolarHBondContact O-CA 3.32Å; R71-T140 PolarHBondContact O-N 2.81Å
72	L	73.1	Confident	69.8	Low	45 Å²	45	86.5 Å²	86.5	24%	0.236	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	125.2	170.1	-68.2	174.5	0	0	0	110	L70 D74 P76 I104 P105 T140 Q142 F171	L70-L72 PolarHBondContact O-N 2.84Å; L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 VanDerWaalsContact CB-O 3.29Å; L72-D74 WeakPolarHBondContact CB-O 3.35Å; L72-P76 HydrophobicContact CD1-CG 3.84Å; L72-I104 HydrophobicContact CD1-CG2 4.38Å; L72-I104 HydrophobicContact CD2-CG2 4.17Å; L72-P105 HydrophobicContact CD1-CG 4.31Å; L72-T140 CarbonylContact C-O 3.56Å; L72-T140 VanDerWaalsContact CA-O 3.3Å; L72-T140 WeakPolarHBondContact CA-O 3.46Å; L72-Q142 HydrophobicContact CD2-CB 3.9Å; L72-Q142 HydrophobicContact CD2-CG 3.82Å; L72-F171 HydrophobicContact CD1-CE2 4.48Å
73	V	75.1	Confident	72.4	Confident	57 Å²	57	84.6 Å²	84.6	35%	0.345	45%	0.448	S	S	.	.	S	Bend	trans	-66	-38.3	175.1	175.1	0	0	0	0	110.3	R71 E139 T140 V141 V229	R71-V73 PolarHBondContact O-N 3.45Å; V73-E139 HydrophobicContact CG2-CB 4.33Å; V73-T140 PolarHBondContact N-O 2.84Å; V73-V141 HydrophobicContact CB-CG2 4.01Å; V73-V141 HydrophobicContact CG1-CG2 4.39Å; V73-V141 HydrophobicContact CG2-CG2 4.18Å; V73-V229 HydrophobicContact CG2-CG2 4.25Å
74	D	78.2	Confident	75.1	Confident	80 Å²	80	78.5 Å²	78.5	43%	0.428	42%	0.419	S	S	.	.	S	Bend	trans	-110	154.9	178.8	-69.4	-38.4	0	0	0	111.3	L72 I104	L72-D74 VanDerWaalsContact C-N 3.29Å; L72-D74 VanDerWaalsContact CB-O 3.29Å; L72-D74 WeakPolarHBondContact CB-O 3.35Å; D74-I104 HydrophobicContact CB-CD1 3.73Å
75	K	83.1	Confident	78	Confident	178 Å²	178	76.2 Å²	76.2	77%	0.774	42%	0.415	S	S	*	.			trans	-64	143.6	176.3	-175.6	-177.9	174	-179.2	0	110.2	S77	K75-S77 PolarHBondContact O-N 2.79Å
76	P	88.8	Confident	80.7	Confident	44 Å²	44	77.1 Å²	77.1	29%	0.286	42%	0.416	S	S	.	.			trans	-50.7	132.2	169.7	-27.6	33.8	0	0	0	112.4	L72 I104 F171	L72-P76 HydrophobicContact CD1-CG 3.84Å; P76-I104 CarbonylContact C-O 3.57Å; P76-I104 WeakPolarHBondContact CA-O 3.35Å; P76-F171 HydrophobicContact CB-CB 4.15Å; P76-F171 HydrophobicContact CB-CD1 4.35Å; P76-F171 HydrophobicContact CB-CD2 3.96Å; P76-F171 HydrophobicContact CB-CE2 4.45Å; P76-F171 HydrophobicContact CB-CG 3.89Å; P76-F171 HydrophobicContact CG-CD1 4.13Å; P76-F171 HydrophobicContact CG-CD2 4.13Å; P76-F171 HydrophobicContact CG-CE1 4.17Å; P76-F171 HydrophobicContact CG-CE2 4.17Å; P76-F171 HydrophobicContact CG-CG 4.1Å; P76-F171 HydrophobicContact CG-CZ 4.18Å
77	S	91.2	Very high	83.1	Confident	53 Å²	53	73.2 Å²	73.2	37%	0.371	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	151.8	-179.8	63.9	0	0	0	0	110.1	K75 G103 I104 N169	K75-S77 PolarHBondContact O-N 2.79Å; S77-G103 CarbonylContact O-C 3.5Å; S77-G103 WeakPolarHBondContact O-CA 3.4Å; S77-I104 PolarHBondContact N-O 2.89Å; S77-I104 PolarHBondContact O-N 3.29Å; S77-N169 PolarHBondContact O-ND2 3.35Å
78	L	95.1	Very high	85.3	Confident	22 Å²	22	75.9 Å²	75.9	12%	0.115	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	130.7	176.8	-176.2	59.1	0	0	0	109.4	A101 Q102 P107 A167 N169 T172 V174	L78-A101 HydrophobicContact CD1-CB 4.3Å; L78-Q102 WeakPolarHBondContact CA-O 3.44Å; L78-P107 HydrophobicContact CD1-CB 3.5Å; L78-P107 HydrophobicContact CD1-CG 3.78Å; L78-A167 HydrophobicContact CD1-CB 4.37Å; L78-A167 HydrophobicContact CD2-CB 4.43Å; L78-A167 WeakPolarHBondContact CD2-O 3.3Å; L78-N169 HydrophobicContact CD2-CB 4.38Å; L78-T172 WeakPolarHBondContact CB-OG1 3.31Å; L78-T172 VanDerWaalsContact CD2-O 3.28Å; L78-T172 WeakPolarHBondContact CD2-O 3.1Å; L78-V174 HydrophobicContact CD1-CG2 4.49Å; L78-V174 HydrophobicContact CD2-CG1 4.42Å; L78-V174 HydrophobicContact CD2-CG2 3.88Å; L78-V174 HydrophobicContact CG-CG1 4.33Å; L78-V174 HydrophobicContact CG-CG2 3.69Å
79	H	97.8	Very high	87.3	Confident	92 Å²	92	71.8 Å²	71.8	43%	0.426	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	156.8	171.4	67.8	-75.1	0	0	0	110.6	S81 A101 Q102	H79-S81 PolarHBondContact O-N 3.47Å; H79-A101 CarbonylContact O-C 3.52Å; H79-A101 VanDerWaalsContact O-CA 3.31Å; H79-A101 WeakPolarHBondContact O-CA 3.3Å; H79-Q102 PolarHBondContact N-O 3.43Å; H79-Q102 PolarHBondContact ND1-O 3.39Å; H79-Q102 PolarHBondContact O-N 3.35Å
80	I	98.7	Very high	88.6	Confident	39 Å²	39	69 Å²	69	20%	0.2	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	113.3	170.8	-60.1	-59	0	0	0	107.7	A83 E100 A101 A167 V174 A176	I80-A83 HydrophobicContact CG2-CB 4Å; I80-E100 CarbonylContact C-O 3.59Å; I80-E100 WeakPolarHBondContact CA-O 3.44Å; I80-A101 HydrophobicContact CD1-CB 4.11Å; I80-A167 HydrophobicContact CD1-CB 3.98Å; I80-V174 HydrophobicContact CD1-CG2 3.75Å; I80-V174 HydrophobicContact CG1-CG2 3.89Å; I80-A176 HydrophobicContact CG1-CB 4.15Å; I80-A176 HydrophobicContact CG2-CB 4.05Å
81	S	98.3	Very high	90	Very high	50 Å²	50	71 Å²	71	35%	0.35	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-31.2	178.7	50.5	0	0	0	0	111.4	H79 E100 A101 N145	H79-S81 PolarHBondContact O-N 3.47Å; S81-E100 PolarHBondContact N-O 3.13Å; S81-E100 VanDerWaalsContact OG-CB 3.22Å; S81-E100 WeakPolarHBondContact OG-CB 3.29Å; S81-E100 PolarHBondContact OG-O 3.44Å; S81-E100 VanDerWaalsContact OG-O 3.14Å; S81-A101 PolarHBondContact OG-N 2.96Å; S81-N145 PolarHBondContact OG-OD1 3.4Å
82	A	98.5	Very high	91	Very high	36 Å²	36	67.4 Å²	67.4	30%	0.298	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	115	169.5	0	0	0	0	0	110.7	C99 E100	A82-C99 CarbonylContact O-C 3.46Å; A82-C99 WeakPolarHBondContact O-CA 3.11Å; A82-E100 HydrophobicContact CB-CB 3.82Å; A82-E100 HydrophobicContact CB-CG 3.93Å; A82-E100 PolarHBondContact N-O 3.34Å; A82-E100 PolarHBondContact O-N 3.38Å
83	A	98.4	Very high	91.6	Very high	53 Å²	53	66.1 Å²	66.1	44%	0.438	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-80.1	149.9	177.2	0	0	0	0	0	111.7	I80 A176	I80-A83 HydrophobicContact CG2-CB 4Å; A83-A176 HydrophobicContact CB-CB 3.79Å
84	P	98.4	Very high	92.4	Very high	9 Å²	9	66.8 Å²	66.8	6%	0.058	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-63.2	146.1	170.3	29	-34.2	0	0	0	110.3	L97 R98 W111 C165 A178	P84-L97 HydrophobicContact CB-CB 4.32Å; P84-R98 WeakPolarHBondContact CA-O 3.44Å; P84-W111 HydrophobicContact CB-CH2 4.01Å; P84-W111 HydrophobicContact CB-CZ3 4.18Å; P84-W111 HydrophobicContact CG-CH2 4.34Å; P84-W111 HydrophobicContact CG-CZ3 4.23Å; P84-C165 WeakPolarHBondContact CD-SG 3.33Å; P84-A178 HydrophobicContact CB-CB 3.78Å; P84-A178 HydrophobicContact CG-CB 3.94Å
85	K	97.5	Very high	93.1	Very high	171 Å²	171	63.5 Å²	63.5	74%	0.743	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-98.3	149	-179.3	-62.6	-178.8	-177.8	178.1	0	110.3	V87 L97 A178	K85-V87 PolarHBondContact O-N 2.86Å; K85-L97 WeakPolarHBondContact O-CD2 3.43Å; K85-A178 WeakPolarHBondContact O-CB 3.28Å
86	D	97.2	Very high	93.6	Very high	119 Å²	119	57.6 Å²	57.6	64%	0.636	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-58.4	135	167.8	-73.2	-1	0	0	0	110.1	A178 K179	D86-A178 WeakPolarHBondContact OD1-CA 3.45Å; D86-K179 WeakPolarHBondContact CA-O 3.46Å; D86-K179 PolarHBondContact OD1-N 3.02Å
87	V	93.5	Very high	94.1	Very high	36 Å²	36	55.6 Å²	55.6	22%	0.218	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.3	-179.6	177.1	0	0	0	0	109.1	K85 V89 F95 L97 K179 V180 G181	K85-V87 PolarHBondContact O-N 2.86Å; V87-V89 HydrophobicContact CG1-CB 4.19Å; V87-V89 HydrophobicContact CG1-CG1 4.46Å; V87-F95 HydrophobicContact CG1-CB 4.35Å; V87-L97 HydrophobicContact CG2-CD2 3.81Å; V87-K179 PolarHBondContact N-O 3.47Å; V87-V180 CarbonylContact O-C 3.55Å; V87-V180 WeakPolarHBondContact O-CA 3.45Å; V87-G181 PolarHBondContact O-N 3.39Å
88	R	93.3	Very high	94.4	Very high	159 Å²	159	58.6 Å²	58.6	60%	0.6	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.2	162.5	-60.2	-177.6	178.8	-177.8	-2.2	107.8	G181 F193	R88-G181 VanDerWaalsContact CA-O 3.32Å; R88-G181 WeakPolarHBondContact CA-O 3.46Å; R88-F193 VanDerWaalsContact C-CE1 3.41Å; R88-F193 HydrophobicContact CB-CD1 4.25Å; R88-F193 HydrophobicContact CB-CE1 3.31Å; R88-F193 HydrophobicContact CB-CZ 3.47Å; R88-F193 VanDerWaalsContact CB-CZ 3.47Å; R88-F193 HydrophobicContact CG-CZ 4.41Å; R88-F193 WeakPolarHBondContact O-CD1 3.44Å; R88-F193 VanDerWaalsContact O-CE1 3.3Å; R88-F193 WeakPolarHBondContact O-CE1 3.5Å
89	V	90.4	Very high	94.6	Very high	13 Å²	13	57.6 Å²	57.6	8%	0.079	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.9	-176.6	62.3	0	0	0	0	110.8	V87 L93 F95 A155 G181 I182 G183	V87-V89 HydrophobicContact CG1-CB 4.19Å; V87-V89 HydrophobicContact CG1-CG1 4.46Å; V89-L93 HydrophobicContact CG2-CB 3.7Å; V89-L93 HydrophobicContact CG2-CD1 4.47Å; V89-F95 HydrophobicContact CB-CB 4.41Å; V89-F95 HydrophobicContact CG1-CB 4.23Å; V89-F95 HydrophobicContact CG1-CD1 3.76Å; V89-F95 HydrophobicContact CG1-CE1 4.37Å; V89-F95 HydrophobicContact CG1-CG 4.15Å; V89-F95 HydrophobicContact CG2-CB 4.33Å; V89-A155 HydrophobicContact CG1-CB 3.93Å; V89-A155 HydrophobicContact CG2-CB 4.39Å; V89-G181 PolarHBondContact N-O 2.88Å; V89-I182 HydrophobicContact CG1-CD1 3.23Å; V89-I182 WeakPolarHBondContact O-CA 3.29Å; V89-G183 PolarHBondContact O-N 3.48Å; V89-G183 VanDerWaalsContact O-N 3.13Å
90	R	87.5	Confident	94.6	Very high	60 Å²	60	54.4 Å²	54.4	23%	0.226	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	143.3	174	-171.8	176.6	73.2	107.4	-5.4	110.3	G92 L93 G183 L188 A200 Q201	R90-G92 PolarHBondContact O-N 3.3Å; R90-L93 HydrophobicContact CB-CD1 3.74Å; R90-L93 HydrophobicContact CB-CG 4.12Å; R90-L93 WeakPolarHBondContact O-CB 3.45Å; R90-L93 PolarHBondContact O-N 3.47Å; R90-L93 VanDerWaalsContact O-N 3.17Å; R90-G183 CarbonylContact C-O 3.59Å; R90-G183 WeakPolarHBondContact CA-O 3.48Å; R90-L188 HydrophobicContact CB-CD1 3.7Å; R90-L188 VanDerWaalsContact CD-CD1 3.47Å; R90-L188 HydrophobicContact CG-CD1 3.58Å; R90-A200 PolarHBondContact NH2-O 3.5Å; R90-Q201 PolarHBondContact NH2-O 2.63Å
91	E	89.1	Confident	94.6	Very high	78 Å²	78	52.6 Å²	52.6	36%	0.364	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	138.4	169.3	-175.6	167.4	-141.9	0	0	111.6	L93 Y157 I182 G183	E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.49Å; E91-Y157 WeakPolarHBondContact OE1-CD2 3.44Å; E91-Y157 WeakPolarHBondContact OE2-CE2 3.5Å; E91-I182 HydrophobicContact CB-CG2 4.15Å; E91-G183 PolarHBondContact N-O 3.46Å
92	G	87.2	Confident	94.6	Very high	21 Å²	21	53.1 Å²	53.1	22%	0.216	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	2.1	-177.9	0	0	0	0	0	115.2	R90 A155 G203 C204	R90-G92 PolarHBondContact O-N 3.3Å; G92-A155 PolarHBondContact N-O 3.14Å; G92-G203 CarbonylContact O-C 3.37Å; G92-G203 VanDerWaalsContact O-CA 3.26Å; G92-G203 WeakPolarHBondContact O-CA 3.47Å; G92-C204 PolarHBondContact O-N 3.08Å; G92-C204 PolarHBondContact O-SG 3.11Å
93	L	87.6	Confident	94.4	Very high	18 Å²	18	51.4 Å²	51.4	9%	0.094	26%	0.258	C	S	.	.			trans	-99.1	149.4	173	-64.3	-176.5	0	0	0	112.3	V89 R90 E91 A155 L196 A200	V89-L93 HydrophobicContact CG2-CB 3.7Å; V89-L93 HydrophobicContact CG2-CD1 4.47Å; R90-L93 HydrophobicContact CB-CD1 3.74Å; R90-L93 HydrophobicContact CB-CG 4.12Å; R90-L93 WeakPolarHBondContact O-CB 3.45Å; R90-L93 PolarHBondContact O-N 3.47Å; R90-L93 VanDerWaalsContact O-N 3.17Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.49Å; L93-A155 WeakPolarHBondContact O-CB 3.32Å; L93-A155 PolarHBondContact O-N 2.72Å; L93-L196 HydrophobicContact CD1-CD1 3.57Å; L93-A200 WeakPolarHBondContact CD2-O 3.39Å
94	P	90.2	Very high	94	Very high	72 Å²	72	49.5 Å²	49.5	47%	0.468	24%	0.241	S	C	.	.			trans	-70	148.3	170.4	28.3	-33.6	0	0	0	111.3	I152 P153	P94-I152 VanDerWaalsContact CA-O 3.32Å; P94-I152 WeakPolarHBondContact CA-O 3.25Å; P94-P153 WeakPolarHBondContact CA-O 3.43Å; P94-P153 VanDerWaalsContact CB-O 3.25Å; P94-P153 WeakPolarHBondContact CB-O 3.39Å
95	F	93.2	Very high	93.7	Very high	11 Å²	11	50 Å²	50	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163	165.8	72.9	-88.8	0	0	0	111.2	V87 V89 L97 Q151 I152 A155 H159 V180 I182	V87-F95 HydrophobicContact CG1-CB 4.35Å; V89-F95 HydrophobicContact CB-CB 4.41Å; V89-F95 HydrophobicContact CG1-CB 4.23Å; V89-F95 HydrophobicContact CG1-CD1 3.76Å; V89-F95 HydrophobicContact CG1-CE1 4.37Å; V89-F95 HydrophobicContact CG1-CG 4.15Å; V89-F95 HydrophobicContact CG2-CB 4.33Å; F95-L97 HydrophobicContact CE2-CG 4.45Å; F95-Q151 PolarHBondContact O-NE2 3.25Å; F95-I152 HydrophobicContact CD1-CB 3.88Å; F95-I152 HydrophobicContact CD1-CG2 4.16Å; F95-I152 HydrophobicContact CE1-CB 3.5Å; F95-I152 VanDerWaalsContact CE1-CB 3.5Å; F95-I152 HydrophobicContact CE1-CG1 3.85Å; F95-I152 HydrophobicContact CE1-CG2 3.59Å; F95-I152 HydrophobicContact CE2-CB 4.17Å; F95-I152 HydrophobicContact CE2-CG1 3.84Å; F95-I152 HydrophobicContact CG-CB 4.4Å; F95-I152 HydrophobicContact CZ-CB 3.66Å; F95-I152 HydrophobicContact CZ-CG1 3.44Å; F95-I152 VanDerWaalsContact CZ-CG1 3.44Å; F95-I152 HydrophobicContact CZ-CG2 4.08Å; F95-I152 PolarHBondContact N-O 2.82Å; F95-I152 PolarHBondContact O-N 2.96Å; F95-A155 HydrophobicContact CD1-CB 4.1Å; F95-A155 HydrophobicContact CE1-CB 4.26Å; F95-H159 HydrophobicContact CE1-CB 4.22Å; F95-H159 HydrophobicContact CZ-CB 4.25Å; F95-V180 HydrophobicContact CD2-CG1 4.48Å; F95-V180 HydrophobicContact CE1-CG1 4.24Å; F95-V180 HydrophobicContact CE2-CG1 3.93Å; F95-V180 HydrophobicContact CE2-CG2 3.91Å; F95-V180 HydrophobicContact CZ-CG1 3.78Å; F95-V180 HydrophobicContact CZ-CG2 4.43Å; F95-I182 HydrophobicContact CE1-CD1 4.29Å
96	S	94.9	Very high	93.4	Very high	53 Å²	53	42.4 Å²	42.4	37%	0.371	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.6	-178.6	66.2	0	0	0	0	111	L150	S96-L150 CarbonylContact C-O 3.57Å; S96-L150 VanDerWaalsContact CA-O 3.23Å; S96-L150 WeakPolarHBondContact CA-O 3.19Å
97	L	98.1	Very high	93.3	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	131.3	168.6	-61.2	178.1	0	0	0	108.5	P84 K85 V87 F95 W111 Q149 L150 Y163 A178 V180	P84-L97 HydrophobicContact CB-CB 4.32Å; K85-L97 WeakPolarHBondContact O-CD2 3.43Å; V87-L97 HydrophobicContact CG2-CD2 3.81Å; F95-L97 HydrophobicContact CE2-CG 4.45Å; L97-W111 HydrophobicContact CB-CH2 3.6Å; L97-W111 HydrophobicContact CB-CZ2 4.37Å; L97-W111 HydrophobicContact CB-CZ3 3.88Å; L97-W111 HydrophobicContact CD1-CZ3 4.16Å; L97-Q149 CarbonylContact O-C 3.58Å; L97-Q149 WeakPolarHBondContact O-CA 3.38Å; L97-L150 HydrophobicContact CB-CB 4.43Å; L97-L150 HydrophobicContact CD1-CD2 4.34Å; L97-L150 PolarHBondContact N-O 3.29Å; L97-L150 PolarHBondContact O-N 3.38Å; L97-Y163 VanDerWaalsContact CD1-CB 3.4Å; L97-Y163 HydrophobicContact CD1-CD1 4.01Å; L97-Y163 HydrophobicContact CD1-CD2 3.91Å; L97-Y163 HydrophobicContact CD1-CG 3.5Å; L97-Y163 VanDerWaalsContact CD1-CG 3.5Å; L97-A178 HydrophobicContact CD2-CB 4.46Å; L97-V180 HydrophobicContact CD1-CG2 3.98Å; L97-V180 HydrophobicContact CD2-CG2 4.2Å; L97-V180 HydrophobicContact CG-CG2 4.47Å
98	R	98.1	Very high	93.4	Very high	116 Å²	116	35.8 Å²	35.8	44%	0.438	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138	177.2	-179.3	172	173.8	155.5	-1.2	109.3	P84 E100 A148	P84-R98 WeakPolarHBondContact CA-O 3.44Å; R98-E100 IonicContact CZ-OE1 2.79Å; R98-E100 IonicContact NE-OE1 3.75Å; R98-E100 PolarHBondContact NE-OE1 3.4Å; R98-E100 IonicContact NH2-OE1 2.95Å; R98-E100 PolarHBondContact NH2-OE1 3.23Å; R98-A148 WeakPolarHBondContact CA-O 3.43Å
99	C	98.5	Very high	93.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.7	174.1	-180	0	0	0	0	109.3	A82 W111 A148 C165	A82-C99 CarbonylContact O-C 3.46Å; A82-C99 WeakPolarHBondContact O-CA 3.11Å; C99-W111 HydrophobicContact CB-CH2 3.74Å; C99-W111 HydrophobicContact CB-CZ2 3.79Å; C99-A148 PolarHBondContact N-O 3.07Å; C99-A148 PolarHBondContact O-N 3.35Å; C99-C165 HydrophobicContact CB-CB 3.41Å; C99-C165 VanDerWaalsContact CB-CB 3.41Å; C99-C165 WeakPolarHBondContact CB-SG 3.3Å; C99-C165 WeakPolarHBondContact SG-CB 3.31Å; C99-C165 CovalentContact SG-SG 2.05Å; C99-C165 PolarHBondContact SG-SG 2.8Å
100	E	98.6	Very high	93.8	Very high	26 Å²	26	29.4 Å²	29.4	12%	0.121	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142.3	177.2	-56.2	179.7	-157.7	0	0	109.9	I80 S81 A82 R98 N145 T146 A147	I80-E100 CarbonylContact C-O 3.59Å; I80-E100 WeakPolarHBondContact CA-O 3.44Å; S81-E100 PolarHBondContact N-O 3.13Å; S81-E100 VanDerWaalsContact OG-CB 3.22Å; S81-E100 WeakPolarHBondContact OG-CB 3.29Å; S81-E100 PolarHBondContact OG-O 3.44Å; S81-E100 VanDerWaalsContact OG-O 3.14Å; A82-E100 HydrophobicContact CB-CB 3.82Å; A82-E100 HydrophobicContact CB-CG 3.93Å; A82-E100 PolarHBondContact N-O 3.34Å; A82-E100 PolarHBondContact O-N 3.38Å; R98-E100 IonicContact CZ-OE1 2.79Å; R98-E100 IonicContact NE-OE1 3.75Å; R98-E100 PolarHBondContact NE-OE1 3.4Å; R98-E100 IonicContact NH2-OE1 2.95Å; R98-E100 PolarHBondContact NH2-OE1 3.23Å; E100-N145 PolarHBondContact OE2-ND2 3.21Å; E100-T146 VanDerWaalsContact CA-O 3.28Å; E100-T146 WeakPolarHBondContact CA-O 3.45Å; E100-A147 HydrophobicContact CG-CB 3.85Å
101	A	98.5	Very high	94.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	129.5	178.2	0	0	0	0	0	110.3	L78 H79 I80 S81 P107 I109 N145 T146 A167	L78-A101 HydrophobicContact CD1-CB 4.3Å; H79-A101 CarbonylContact O-C 3.52Å; H79-A101 VanDerWaalsContact O-CA 3.31Å; H79-A101 WeakPolarHBondContact O-CA 3.3Å; I80-A101 HydrophobicContact CD1-CB 4.11Å; S81-A101 PolarHBondContact OG-N 2.96Å; A101-P107 HydrophobicContact CB-CG 4.02Å; A101-P107 VanDerWaalsContact O-CG 3.3Å; A101-P107 WeakPolarHBondContact O-CG 3.31Å; A101-I109 HydrophobicContact CB-CD1 3.98Å; A101-I109 HydrophobicContact CB-CG1 4.25Å; A101-N145 WeakPolarHBondContact O-CA 3.4Å; A101-N145 PolarHBondContact O-OD1 3.28Å; A101-T146 PolarHBondContact N-O 2.69Å; A101-T146 PolarHBondContact O-N 3.39Å; A101-A167 HydrophobicContact CB-CB 3.42Å; A101-A167 VanDerWaalsContact CB-CB 3.42Å
102	Q	97.8	Very high	94.7	Very high	61 Å²	61	25.8 Å²	25.8	29%	0.285	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.6	174.3	-178	179.5	10.3	0	0	109.8	L78 H79 S144 N145 F225	L78-Q102 WeakPolarHBondContact CA-O 3.44Å; H79-Q102 PolarHBondContact N-O 3.43Å; H79-Q102 PolarHBondContact ND1-O 3.39Å; H79-Q102 PolarHBondContact O-N 3.35Å; Q102-S144 VanDerWaalsContact CA-O 3.3Å; Q102-S144 WeakPolarHBondContact CA-O 3.48Å; Q102-N145 HydrophobicContact CB-CB 4.38Å; Q102-F225 HydrophobicContact CG-CZ 4.19Å
103	G	93.7	Very high	95.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	164.1	-176.7	0	0	0	0	0	115	S77 P105 S144	S77-G103 CarbonylContact O-C 3.5Å; S77-G103 WeakPolarHBondContact O-CA 3.4Å; G103-P105 CarbonylContact C-O 3.52Å; G103-S144 PolarHBondContact N-O 2.82Å; G103-S144 PolarHBondContact O-N 3.12Å; G103-S144 VanDerWaalsContact O-N 3.08Å
104	I	90.8	Very high	95.7	Very high	14 Å²	14	30.2 Å²	30.2	7%	0.072	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	114.7	169.9	-63	171.1	0	0	0	106.2	L72 D74 P76 S77 V141 N169	L72-I104 HydrophobicContact CD1-CG2 4.38Å; L72-I104 HydrophobicContact CD2-CG2 4.17Å; D74-I104 HydrophobicContact CB-CD1 3.73Å; P76-I104 CarbonylContact C-O 3.57Å; P76-I104 WeakPolarHBondContact CA-O 3.35Å; S77-I104 PolarHBondContact N-O 2.89Å; S77-I104 PolarHBondContact O-N 3.29Å; I104-V141 VanDerWaalsContact CG2-O 3.25Å; I104-V141 WeakPolarHBondContact CG2-O 3.46Å; I104-N169 PolarHBondContact O-ND2 3.47Å
105	P	91.5	Very high	96	Very high	20 Å²	20	29.7 Å²	29.7	13%	0.13	17%	0.166	C	C	.	.	S	Bend	cis	-63.7	175.5	-10.8	-21.6	35.3	0	0	0	114	L72 G103 Q142 N169 F171	L72-P105 HydrophobicContact CD1-CG 4.31Å; G103-P105 CarbonylContact C-O 3.52Å; P105-Q142 CarbonylContact C-O 3.51Å; P105-Q142 WeakPolarHBondContact CA-O 3.48Å; P105-Q142 HydrophobicContact CB-CB 3.96Å; P105-Q142 VanDerWaalsContact CG-OE1 3.31Å; P105-N169 WeakPolarHBondContact O-CB 3.14Å; P105-F171 HydrophobicContact CG-CD2 4.38Å; P105-F171 HydrophobicContact CG-CE2 3.91Å
106	A	92.7	Very high	96.2	Very high	10 Å²	10	36.8 Å²	36.8	8%	0.083	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-51.7	124.3	175.8	0	0	0	0	0	111.7	Q142 S144	A106-Q142 PolarHBondContact N-O 3.09Å; A106-Q142 VanDerWaalsContact N-O 3.07Å; A106-S144 VanDerWaalsContact CB-CB 3.48Å
107	P	94.5	Very high	96.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-85.5	151.8	-176.4	31.8	-32.8	0	0	0	112.8	L78 A101 T146 E168 N169	L78-P107 HydrophobicContact CD1-CB 3.5Å; L78-P107 HydrophobicContact CD1-CG 3.78Å; A101-P107 HydrophobicContact CB-CG 4.02Å; A101-P107 VanDerWaalsContact O-CG 3.3Å; A101-P107 WeakPolarHBondContact O-CG 3.31Å; P107-T146 VanDerWaalsContact O-CB 3.27Å; P107-T146 WeakPolarHBondContact O-CB 3.47Å; P107-T146 WeakPolarHBondContact O-CG2 3.41Å; P107-T146 PolarHBondContact O-OG1 3.28Å; P107-E168 VanDerWaalsContact CA-O 3.28Å; P107-E168 WeakPolarHBondContact CA-O 3.46Å; P107-N169 HydrophobicContact CB-CB 4.45Å
108	V	94.4	Very high	96	Very high	16 Å²	16	39.8 Å²	39.8	10%	0.097	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	147.6	163.2	-65.7	0	0	0	0	109.5	A167 E168 F237	V108-A167 CarbonylContact O-C 3.48Å; V108-A167 VanDerWaalsContact O-CA 3.3Å; V108-A167 WeakPolarHBondContact O-CA 3.46Å; V108-E168 PolarHBondContact N-O 3.05Å; V108-E168 PolarHBondContact O-N 3.14Å; V108-F237 HydrophobicContact CG1-CE2 4.26Å; V108-F237 HydrophobicContact CG1-CZ 4.06Å
109	I	96.4	Very high	95.7	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.3	178.5	-59.7	175.2	0	0	0	109.1	A101 T146 A148 C165 V166 A167	A101-I109 HydrophobicContact CB-CD1 3.98Å; A101-I109 HydrophobicContact CB-CG1 4.25Å; I109-T146 HydrophobicContact CD1-CG2 4.2Å; I109-T146 VanDerWaalsContact CD1-O 3.29Å; I109-T146 WeakPolarHBondContact CD1-O 3.4Å; I109-T146 HydrophobicContact CG1-CG2 4.28Å; I109-A148 HydrophobicContact CB-CB 3.78Å; I109-A148 HydrophobicContact CD1-CB 4.04Å; I109-A148 HydrophobicContact CG1-CB 4.49Å; I109-A148 HydrophobicContact CG2-CB 3.69Å; I109-C165 HydrophobicContact CG2-CB 4.18Å; I109-V166 CarbonylContact C-O 3.15Å; I109-V166 WeakPolarHBondContact CA-O 3.46Å; I109-A167 HydrophobicContact CG1-CB 4.12Å
110	S	96.3	Very high	95.4	Very high	37 Å²	37	41.3 Å²	41.3	26%	0.259	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	162	172.4	61.7	0	0	0	0	111.3	E124 C165 V166	S110-E124 WeakPolarHBondContact CA-OE1 3.16Å; S110-C165 WeakPolarHBondContact O-CA 3.25Å; S110-V166 PolarHBondContact N-O 3.35Å; S110-V166 PolarHBondContact O-N 3.31Å; S110-V166 PolarHBondContact OG-O 3.49Å
111	W	97.6	Very high	95	Very high	2 Å²	2	41 Å²	41	1%	0.008	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.6	-180	-68.4	91.3	0	0	0	112.8	P84 L97 C99 T117 I118 L150 E164 C165	P84-W111 HydrophobicContact CB-CH2 4.01Å; P84-W111 HydrophobicContact CB-CZ3 4.18Å; P84-W111 HydrophobicContact CG-CH2 4.34Å; P84-W111 HydrophobicContact CG-CZ3 4.23Å; L97-W111 HydrophobicContact CB-CH2 3.6Å; L97-W111 HydrophobicContact CB-CZ2 4.37Å; L97-W111 HydrophobicContact CB-CZ3 3.88Å; L97-W111 HydrophobicContact CD1-CZ3 4.16Å; C99-W111 HydrophobicContact CB-CH2 3.74Å; C99-W111 HydrophobicContact CB-CZ2 3.79Å; W111-T117 WeakPolarHBondContact O-CA 3.49Å; W111-I118 HydrophobicContact CB-CD1 3.98Å; W111-I118 HydrophobicContact CB-CG1 3.63Å; W111-I118 PolarHBondContact O-N 2.95Å; W111-L150 HydrophobicContact CB-CD2 4.5Å; W111-L150 HydrophobicContact CD2-CB 3.83Å; W111-L150 HydrophobicContact CD2-CD2 4.07Å; W111-L150 HydrophobicContact CE3-CB 4.35Å; W111-L150 HydrophobicContact CE3-CD2 4.03Å; W111-L150 HydrophobicContact CG-CB 4.14Å; W111-L150 HydrophobicContact CG-CD2 4.29Å; W111-L150 HydrophobicContact CZ2-CB 4.03Å; W111-E164 CarbonylContact C-O 3.59Å; W111-E164 WeakPolarHBondContact CA-O 3.15Å; W111-C165 HydrophobicContact CD2-CB 4.22Å; W111-C165 HydrophobicContact CE3-CB 3.9Å; W111-C165 HydrophobicContact CH2-CB 3.87Å; W111-C165 HydrophobicContact CZ2-CB 4.17Å; W111-C165 HydrophobicContact CZ3-CB 3.72Å
112	K	97.9	Very high	94.5	Very high	60 Å²	60	49.3 Å²	49.3	26%	0.261	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.9	166.6	-60.4	175.2	-177.1	166.2	0	110.3	K116 Y163 E164 V166	K112-K116 CarbonylContact C-O 3.56Å; K112-K116 VanDerWaalsContact CA-O 3.26Å; K112-K116 WeakPolarHBondContact CA-O 3.47Å; K112-Y163 CarbonylContact O-C 3.6Å; K112-Y163 WeakPolarHBondContact O-CA 3.33Å; K112-E164 HydrophobicContact CB-CB 4.29Å; K112-E164 WeakPolarHBondContact CD-OE2 3.43Å; K112-E164 PolarHBondContact N-O 2.81Å; K112-E164 IonicContact NZ-OE2 3.58Å; K112-E164 PolarHBondContact O-N 2.99Å; K112-V166 HydrophobicContact CD-CG2 4.06Å; K112-V166 HydrophobicContact CG-CG2 4.33Å
113	F	98.2	Very high	94	Very high	41 Å²	41	48 Å²	48	18%	0.18	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.2	170.4	173.9	-119.4	0	0	0	109.4	G115 K116 I118 K158 A160 Y163	F113-G115 PolarHBondContact O-N 3.39Å; F113-K116 PolarHBondContact N-O 3.15Å; F113-K116 PolarHBondContact O-N 3.14Å; F113-I118 HydrophobicContact CB-CD1 4.09Å; F113-I118 HydrophobicContact CB-CG2 3.89Å; F113-K158 WeakPolarHBondContact CE1-O 3.37Å; F113-K158 WeakPolarHBondContact CZ-O 3.21Å; F113-A160 WeakPolarHBondContact CZ-O 3.27Å; F113-Y163 HydrophobicContact CB-CD1 4.18Å; F113-Y163 HydrophobicContact CB-CE1 3.94Å; F113-Y163 AromaticContact CD2-CD1 3.99Å; F113-Y163 HydrophobicContact CD2-CD1 3.99Å; F113-Y163 AromaticContact CD2-CD2 3.96Å; F113-Y163 HydrophobicContact CD2-CD2 3.96Å; F113-Y163 AromaticContact CD2-CE1 3.56Å; F113-Y163 HydrophobicContact CD2-CE1 3.56Å; F113-Y163 AromaticContact CD2-CE2 3.53Å; F113-Y163 HydrophobicContact CD2-CE2 3.53Å; F113-Y163 HydrophobicContact CD2-CG 4.19Å; F113-Y163 AromaticContact CD2-CZ 3.32Å; F113-Y163 HydrophobicContact CE2-CD2 4.33Å; F113-Y163 HydrophobicContact CE2-CE1 4.34Å; F113-Y163 AromaticContact CE2-CE2 3.63Å; F113-Y163 HydrophobicContact CE2-CE2 3.63Å; F113-Y163 AromaticContact CE2-CZ 3.65Å; F113-Y163 AromaticContact CG-CE1 3.99Å; F113-Y163 HydrophobicContact CG-CE1 3.99Å
114	N	97.4	Very high	93.6	Very high	90 Å²	90	48.7 Å²	48.7	48%	0.481	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	44	-175.2	-64.1	-29	0	0	0	112.3	K116 Y162	N114-K116 VanDerWaalsContact C-N 3.26Å; N114-K116 PolarHBondContact O-N 3.27Å; N114-Y162 PolarHBondContact N-O 3.46Å; N114-Y162 PolarHBondContact OD1-N 3.4Å
115	G	96	Very high	93	Very high	61 Å²	61	51.2 Å²	51.2	63%	0.629	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-11.9	-179.6	0	0	0	0	0	115.7	F113	F113-G115 PolarHBondContact O-N 3.39Å
116	K	97.3	Very high	92.6	Very high	160 Å²	160	53.9 Å²	53.9	70%	0.696	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	127	177.5	-175.4	-179.9	177.1	-177.5	0	110.7	K112 F113 N114 I118	K112-K116 CarbonylContact C-O 3.56Å; K112-K116 VanDerWaalsContact CA-O 3.26Å; K112-K116 WeakPolarHBondContact CA-O 3.47Å; F113-K116 PolarHBondContact N-O 3.15Å; F113-K116 PolarHBondContact O-N 3.14Å; N114-K116 VanDerWaalsContact C-N 3.26Å; N114-K116 PolarHBondContact O-N 3.27Å; K116-I118 PolarHBondContact O-N 3.39Å
117	T	95.2	Very high	92	Very high	80 Å²	80	57 Å²	57	49%	0.491	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	133.5	173.8	-55.7	0	0	0	0	111.1	W111	W111-T117 WeakPolarHBondContact O-CA 3.49Å
118	I	94.7	Very high	91.6	Very high	40 Å²	40	58.1 Å²	58.1	21%	0.205	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.8	173.7	55.7	171.7	0	0	0	108.3	W111 F113 K116 L150 Y163	W111-I118 HydrophobicContact CB-CD1 3.98Å; W111-I118 HydrophobicContact CB-CG1 3.63Å; W111-I118 PolarHBondContact O-N 2.95Å; F113-I118 HydrophobicContact CB-CD1 4.09Å; F113-I118 HydrophobicContact CB-CG2 3.89Å; K116-I118 PolarHBondContact O-N 3.39Å; I118-L150 HydrophobicContact CD1-CD1 3.87Å; I118-L150 HydrophobicContact CD1-CD2 3.63Å; I118-L150 HydrophobicContact CD1-CG 4.44Å; I118-Y163 HydrophobicContact CD1-CD1 4.18Å; I118-Y163 HydrophobicContact CD1-CE1 3.98Å
119	T	92.4	Very high	91	Very high	107 Å²	107	64.1 Å²	64.1	66%	0.656	35%	0.352	S	S	*	.			trans	-103.8	136.8	-178.2	54	0	0	0	0	110.5	E124	T119-E124 WeakPolarHBondContact CA-OE2 2.88Å
120	Q	91.5	Very high	90.5	Very high	41 Å²	41	65.5 Å²	65.5	19%	0.192	36%	0.364	C	S	.	.	S	Bend	trans	-91.7	-26.7	174.4	-62.2	-58.5	-88.2	0	0	112.4	E124 L150 Y220 S241	Q120-E124 PolarHBondContact N-OE2 2.97Å; Q120-L150 HydrophobicContact CG-CD1 4.32Å; Q120-Y220 HydrophobicContact CB-CD1 3.88Å; Q120-Y220 HydrophobicContact CB-CD2 3.8Å; Q120-Y220 HydrophobicContact CB-CE1 4.44Å; Q120-Y220 HydrophobicContact CB-CE2 4.39Å; Q120-Y220 HydrophobicContact CB-CG 3.52Å; Q120-Y220 HydrophobicContact CG-CG 4.39Å; Q120-S241 WeakPolarHBondContact O-CB 2.95Å; Q120-S241 PolarHBondContact O-OG 2.87Å
121	G	89.9	Confident	90.2	Very high	19 Å²	19	63.9 Å²	63.9	20%	0.196	35%	0.352	C	S	.	.	S	Bend	trans	-162.7	175.2	176.2	0	0	0	0	0	112.4	H123	G121-H123 VanDerWaalsContact C-N 3.31Å; G121-H123 PolarHBondContact O-N 2.8Å
122	E	87.7	Confident	89.7	Confident	174 Å²	174	66.7 Å²	66.7	81%	0.813	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-33.5	-175	-60.5	-169.9	168.3	0	0	112.6	E124	E122-E124 PolarHBondContact O-N 3.4Å
123	H	88.1	Confident	89.1	Confident	35 Å²	35	68.8 Å²	68.8	16%	0.162	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	7.4	-173.9	-55.1	-62.4	0	0	0	114.9	G121 G125 E126 R239 N269	G121-H123 VanDerWaalsContact C-N 3.31Å; G121-H123 PolarHBondContact O-N 2.8Å; H123-G125 VanDerWaalsContact C-N 3.29Å; H123-G125 PolarHBondContact O-N 2.79Å; H123-E126 HydrophobicContact CB-CG 4.45Å; H123-E126 IonicContact CE1-OE1 2.8Å; H123-E126 IonicContact CG-OE1 3.13Å; H123-E126 IonicContact ND1-OE1 3.54Å; H123-E126 PolarHBondContact ND1-OE1 2.87Å; H123-E126 IonicContact ND1-OE2 2.85Å; H123-E126 PolarHBondContact O-N 2.7Å; H123-R239 WeakPolarHBondContact O-CD 2.89Å; H123-R239 PolarHBondContact O-NH1 2.79Å; H123-N269 HydrophobicContact CB-CB 3.8Å
124	E	84.2	Confident	88.7	Confident	13 Å²	13	70 Å²	70	6%	0.061	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-34.8	-175.1	-170.7	171.1	173.4	0	0	112.9	S110 T119 Q120 E122 Y220 R239	S110-E124 WeakPolarHBondContact CA-OE1 3.16Å; T119-E124 WeakPolarHBondContact CA-OE2 2.88Å; Q120-E124 PolarHBondContact N-OE2 2.97Å; E122-E124 PolarHBondContact O-N 3.4Å; E124-Y220 HydrophobicContact CB-CE2 4Å; E124-Y220 HydrophobicContact CG-CE2 4.19Å; E124-Y220 PolarHBondContact N-OH 3.06Å; E124-R239 PolarHBondContact O-NH1 3.07Å
125	G	78.3	Confident	88.4	Confident	68 Å²	68	65.8 Å²	65.8	70%	0.701	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-6	180	0	0	0	0	0	115.6	H123	H123-G125 VanDerWaalsContact C-N 3.29Å; H123-G125 PolarHBondContact O-N 2.79Å
126	E	84.8	Confident	87.9	Confident	75 Å²	75	66.4 Å²	66.4	35%	0.35	35%	0.353	S	S	.	.			trans	-73.7	137.8	-174.3	-67.9	-175	-169	0	0	112.8	H123 R239 N269	H123-E126 HydrophobicContact CB-CG 4.45Å; H123-E126 IonicContact CE1-OE1 2.8Å; H123-E126 IonicContact CG-OE1 3.13Å; H123-E126 IonicContact ND1-OE1 3.54Å; H123-E126 PolarHBondContact ND1-OE1 2.87Å; H123-E126 IonicContact ND1-OE2 2.85Å; H123-E126 PolarHBondContact O-N 2.7Å; E126-R239 PolarHBondContact O-NH1 2.96Å; E126-R239 PolarHBondContact O-NH2 3.21Å; E126-N269 VanDerWaalsContact OE2-CB 3.25Å; E126-N269 WeakPolarHBondContact OE2-CB 3.34Å; E126-N269 PolarHBondContact OE2-ND2 2.96Å
127	R	80.2	Confident	87.1	Confident	76 Å²	76	60.9 Å²	60.9	29%	0.287	34%	0.341	S	S	.	.			trans	-103.2	166.8	179.4	-54.7	-67.5	-68.9	-98.4	-2.3	110.8	F129 E168 N169	R127-F129 HydrophobicContact CB-CD2 3.93Å; R127-F129 HydrophobicContact CB-CE2 3.67Å; R127-F129 HydrophobicContact CB-CZ 4.09Å; R127-F129 HydrophobicContact CG-CE2 4.15Å; R127-F129 HydrophobicContact CG-CZ 4.36Å; R127-F129 PolarHBondContact O-N 2.76Å; R127-E168 IonicContact CZ-OE1 3.41Å; R127-E168 IonicContact NH1-OE1 2.64Å; R127-E168 PolarHBondContact NH1-OE1 3.36Å; R127-N169 PolarHBondContact NH2-O 3.06Å
128	N	84.9	Confident	86.6	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.128	33%	0.33	C	S	.	.			trans	-79.7	50.1	-175.6	-53.7	14	0	0	0	111.6	A130 E131 L132 F237	N128-A130 VanDerWaalsContact C-N 3.25Å; N128-A130 PolarHBondContact O-N 3.3Å; N128-E131 HydrophobicContact CB-CB 3.96Å; N128-E131 PolarHBondContact O-N 3.44Å; N128-L132 PolarHBondContact O-N 3.07Å; N128-F237 WeakPolarHBondContact ND2-CZ 3.43Å; N128-F237 WeakPolarHBondContact OD1-CE1 3.2Å; N128-F237 WeakPolarHBondContact OD1-CZ 3.41Å
129	F	82.5	Confident	86.1	Confident	142 Å²	142	60.7 Å²	60.7	62%	0.623	33%	0.333	S	S	*	.	H	α-helix	trans	-60.6	-35.8	-176.9	-71.5	-69.3	0	0	0	112.1	R127 L132 L133	R127-F129 HydrophobicContact CB-CD2 3.93Å; R127-F129 HydrophobicContact CB-CE2 3.67Å; R127-F129 HydrophobicContact CB-CZ 4.09Å; R127-F129 HydrophobicContact CG-CE2 4.15Å; R127-F129 HydrophobicContact CG-CZ 4.36Å; R127-F129 PolarHBondContact O-N 2.76Å; F129-L132 HydrophobicContact CD1-CD2 4.42Å; F129-L132 PolarHBondContact O-N 2.92Å; F129-L133 WeakPolarHBondContact O-CB 3.12Å; F129-L133 PolarHBondContact O-N 3.31Å
130	A	84.9	Confident	86	Confident	31 Å²	31	55.6 Å²	55.6	26%	0.256	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-46.8	175.6	0	0	0	0	0	111.7	N128 L133 M134 L267 L273	N128-A130 VanDerWaalsContact C-N 3.25Å; N128-A130 PolarHBondContact O-N 3.3Å; A130-L133 PolarHBondContact O-N 3.44Å; A130-M134 WeakPolarHBondContact O-CG 3.41Å; A130-M134 PolarHBondContact O-N 3.46Å; A130-M134 VanDerWaalsContact O-N 3.15Å; A130-L267 HydrophobicContact CB-CD1 4.32Å; A130-L273 HydrophobicContact CB-CD2 4.23Å
131	E	90.4	Very high	85.9	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.009	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-47	174.7	-172.4	-173.8	137.4	0	0	111.6	N128 L133 M134 N135 Q142 R226 S233 Q235	N128-E131 HydrophobicContact CB-CB 3.96Å; N128-E131 PolarHBondContact O-N 3.44Å; E131-L133 VanDerWaalsContact C-N 3.34Å; E131-L133 PolarHBondContact O-N 2.93Å; E131-M134 PolarHBondContact O-N 3.49Å; E131-N135 WeakPolarHBondContact CG-ND2 3.28Å; E131-N135 WeakPolarHBondContact O-CB 3.47Å; E131-N135 PolarHBondContact O-N 2.79Å; E131-N135 VanDerWaalsContact O-N 3.14Å; E131-N135 PolarHBondContact O-ND2 2.91Å; E131-Q142 PolarHBondContact OE1-NE2 2.88Å; E131-R226 IonicContact OE1-CZ 3.68Å; E131-R226 IonicContact OE1-NH2 3.81Å; E131-R226 PolarHBondContact OE1-NH2 3.04Å; E131-R226 IonicContact OE2-NH2 2.72Å; E131-S233 WeakPolarHBondContact CG-O 3.3Å; E131-Q235 HydrophobicContact CB-CB 4.09Å; E131-Q235 PolarHBondContact OE2-N 2.85Å
132	L	86.5	Confident	85.9	Confident	62 Å²	62	54 Å²	54	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-55	-48.6	178.8	172.2	61.8	0	0	0	111.5	L69 L70 N128 F129 N135 I136	L69-L132 HydrophobicContact CD1-CD1 4.42Å; L70-L132 HydrophobicContact CD1-CD1 3.24Å; L70-L132 HydrophobicContact CD2-CD1 4.27Å; L70-L132 HydrophobicContact CG-CD1 3.61Å; N128-L132 PolarHBondContact O-N 3.07Å; F129-L132 HydrophobicContact CD1-CD2 4.42Å; F129-L132 PolarHBondContact O-N 2.92Å; L132-N135 PolarHBondContact O-N 2.96Å; L132-I136 PolarHBondContact O-N 3.32Å
133	L	86.2	Confident	86.2	Confident	103 Å²	103	46.4 Å²	46.4	54%	0.539	26%	0.257	S	S	.	.	H	α-helix	trans	-64.3	-42	-179.4	-179.7	61.8	0	0	0	112.3	F129 A130 E131 N135 I136	F129-L133 WeakPolarHBondContact O-CB 3.12Å; F129-L133 PolarHBondContact O-N 3.31Å; A130-L133 PolarHBondContact O-N 3.44Å; E131-L133 VanDerWaalsContact C-N 3.34Å; E131-L133 PolarHBondContact O-N 2.93Å; L133-N135 PolarHBondContact O-N 2.78Å; L133-I136 HydrophobicContact CD1-CD1 3.82Å; L133-I136 WeakPolarHBondContact O-CG1 3.49Å
134	M	88.9	Confident	86.6	Confident	68 Å²	68	44.8 Å²	44.8	34%	0.335	25%	0.249	S	C	.	.	H	α-helix	trans	-74.1	-14.5	-177.6	-68	-169.6	-175.3	0	0	114.2	A130 E131 S233 L273 R275	A130-M134 WeakPolarHBondContact O-CG 3.41Å; A130-M134 PolarHBondContact O-N 3.46Å; A130-M134 VanDerWaalsContact O-N 3.15Å; E131-M134 PolarHBondContact O-N 3.49Å; M134-S233 WeakPolarHBondContact CB-OG 3.44Å; M134-L273 HydrophobicContact CE-CD2 3.48Å; M134-L273 VanDerWaalsContact CE-CD2 3.48Å; M134-L273 HydrophobicContact SD-CD1 4.31Å; M134-L273 HydrophobicContact SD-CD2 3.76Å; M134-L273 HydrophobicContact SD-CG 4.34Å; M134-R275 HydrophobicContact CE-CG 4.36Å; M134-R275 HydrophobicContact SD-CG 3.66Å
135	N	91.2	Very high	87.3	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	6.8	-178.2	-70.7	-23.9	0	0	0	113.9	L70 E131 L132 L133 G137 K138 T140 S233	L70-N135 HydrophobicContact CD2-CB 3.55Å; L70-N135 WeakPolarHBondContact CD2-O 3.36Å; E131-N135 WeakPolarHBondContact CG-ND2 3.28Å; E131-N135 WeakPolarHBondContact O-CB 3.47Å; E131-N135 PolarHBondContact O-N 2.79Å; E131-N135 VanDerWaalsContact O-N 3.14Å; E131-N135 PolarHBondContact O-ND2 2.91Å; L132-N135 PolarHBondContact O-N 2.96Å; L133-N135 PolarHBondContact O-N 2.78Å; N135-G137 PolarHBondContact O-N 3Å; N135-K138 WeakPolarHBondContact O-CB 3.11Å; N135-K138 PolarHBondContact O-N 3.21Å; N135-T140 HydrophobicContact CB-CG2 3.89Å; N135-S233 PolarHBondContact ND2-O 2.98Å; N135-S233 PolarHBondContact OD1-N 3.44Å
136	I	85.3	Confident	88.2	Confident	75 Å²	75	41.1 Å²	41.1	39%	0.385	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	130.6	173.2	-64.4	176.7	0	0	0	110	V67 L132 L133 K138	V67-I136 HydrophobicContact CG1-CG2 3.65Å; L132-I136 PolarHBondContact O-N 3.32Å; L133-I136 HydrophobicContact CD1-CD1 3.82Å; L133-I136 WeakPolarHBondContact O-CG1 3.49Å; I136-K138 PolarHBondContact O-N 2.89Å
137	G	80.6	Confident	88.8	Confident	44 Å²	44	37.5 Å²	37.5	45%	0.454	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	-0.6	-178.3	0	0	0	0	0	115.8	N135	N135-G137 PolarHBondContact O-N 3Å
138	K	85.2	Confident	89.7	Confident	59 Å²	59	34 Å²	34	26%	0.257	18%	0.184	S	C	.	.	S	Bend	trans	-93.8	154.8	176.2	-60.3	-172.9	-179	177	0	111.5	R71 N135 I136 G231 H276	R71-K138 PolarHBondContact N-O 2.84Å; N135-K138 WeakPolarHBondContact O-CB 3.11Å; N135-K138 PolarHBondContact O-N 3.21Å; I136-K138 PolarHBondContact O-N 2.89Å; K138-G231 PolarHBondContact NZ-O 3.38Å; K138-H276 PolarHBondContact NZ-CD2 2.86Å; K138-H276 VanDerWaalsContact NZ-CD2 3.28Å; K138-H276 PolarHBondContact NZ-NE2 3.46Å
139	E	84.8	Confident	90.3	Very high	57 Å²	57	35.6 Å²	35.6	27%	0.266	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	132.7	166.9	-76.9	161.5	-146.5	0	0	108.8	R71 V73 K328	R71-E139 HydrophobicContact CB-CG 4.16Å; R71-E139 WeakPolarHBondContact O-CA 3.32Å; V73-E139 HydrophobicContact CG2-CB 4.33Å; E139-K328 VanDerWaalsContact OE1-CE 3.28Å; E139-K328 WeakPolarHBondContact OE1-CE 3.23Å; E139-K328 IonicContact OE1-NZ 3.29Å; E139-K328 PolarHBondContact OE1-NZ 3.25Å
140	T	89.6	Confident	90.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.2	-175.8	58	0	0	0	0	111	L70 R71 L72 V73 N135 E228 A232	L70-T140 HydrophobicContact CD2-CG2 4.45Å; R71-T140 PolarHBondContact O-N 2.81Å; L72-T140 CarbonylContact C-O 3.56Å; L72-T140 VanDerWaalsContact CA-O 3.3Å; L72-T140 WeakPolarHBondContact CA-O 3.46Å; V73-T140 PolarHBondContact N-O 2.84Å; N135-T140 HydrophobicContact CB-CG2 3.89Å; T140-E228 WeakPolarHBondContact CA-OE1 3.28Å; T140-E228 WeakPolarHBondContact CB-OE1 3.45Å; T140-A232 HydrophobicContact CG2-CB 4.11Å
141	V	88.8	Confident	91.2	Very high	16 Å²	16	29.9 Å²	29.9	10%	0.097	16%	0.161	C	C	.	.			trans	-90.7	-38.4	171.8	168.6	0	0	0	0	110.8	V73 I104 S143 E228 V229	V73-V141 HydrophobicContact CB-CG2 4.01Å; V73-V141 HydrophobicContact CG1-CG2 4.39Å; V73-V141 HydrophobicContact CG2-CG2 4.18Å; I104-V141 VanDerWaalsContact CG2-O 3.25Å; I104-V141 WeakPolarHBondContact CG2-O 3.46Å; V141-S143 PolarHBondContact O-N 2.91Å; V141-E228 PolarHBondContact N-OE1 2.82Å; V141-V229 HydrophobicContact CB-CG2 4.49Å; V141-V229 HydrophobicContact CG2-CG2 3.77Å
142	Q	90.8	Very high	91.3	Very high	9 Å²	9	30.8 Å²	30.8	4%	0.042	17%	0.166	C	C	.	.			trans	54.1	21.5	179.9	-55.3	-160.8	-46.6	0	0	116.5	L72 P105 A106 E131 R226 E228	L72-Q142 HydrophobicContact CD2-CB 3.9Å; L72-Q142 HydrophobicContact CD2-CG 3.82Å; P105-Q142 CarbonylContact C-O 3.51Å; P105-Q142 WeakPolarHBondContact CA-O 3.48Å; P105-Q142 HydrophobicContact CB-CB 3.96Å; P105-Q142 VanDerWaalsContact CG-OE1 3.31Å; A106-Q142 PolarHBondContact N-O 3.09Å; A106-Q142 VanDerWaalsContact N-O 3.07Å; E131-Q142 PolarHBondContact OE1-NE2 2.88Å; Q142-R226 VanDerWaalsContact C-NH1 3.26Å; Q142-E228 WeakPolarHBondContact CA-OE2 3.34Å; Q142-E228 WeakPolarHBondContact CG-OE2 3.42Å; Q142-E228 PolarHBondContact N-OE2 2.88Å
143	S	93.4	Very high	91.3	Very high	16 Å²	16	31.2 Å²	31.2	11%	0.112	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	128.3	-179.9	179.6	0	0	0	0	111	V141 R226 F227	V141-S143 PolarHBondContact O-N 2.91Å; S143-R226 WeakPolarHBondContact O-CD 3.25Å; S143-R226 PolarHBondContact O-NH1 2.94Å; S143-F227 PolarHBondContact N-O 2.75Å; S143-F227 PolarHBondContact O-N 2.74Å
144	S	96.9	Very high	91.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	149.3	180	-161.9	0	0	0	0	112.2	Q102 G103 A106 T223 F225 R226	Q102-S144 VanDerWaalsContact CA-O 3.3Å; Q102-S144 WeakPolarHBondContact CA-O 3.48Å; G103-S144 PolarHBondContact N-O 2.82Å; G103-S144 PolarHBondContact O-N 3.12Å; G103-S144 VanDerWaalsContact O-N 3.08Å; A106-S144 VanDerWaalsContact CB-CB 3.48Å; S144-T223 WeakPolarHBondContact OG-CG2 3.31Å; S144-F225 VanDerWaalsContact CA-O 3.27Å; S144-F225 WeakPolarHBondContact CA-O 3.49Å; S144-F225 PolarHBondContact OG-O 2.83Å; S144-R226 WeakPolarHBondContact OG-CD 3.38Å
145	N	98.4	Very high	91.5	Very high	4 Å²	4	25.4 Å²	25.4	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.7	159	-172.5	49.7	0	0	0	108.3	S81 E100 A101 Q102 D224 F225	S81-N145 PolarHBondContact OG-OD1 3.4Å; E100-N145 PolarHBondContact OE2-ND2 3.21Å; A101-N145 WeakPolarHBondContact O-CA 3.4Å; A101-N145 PolarHBondContact O-OD1 3.28Å; Q102-N145 HydrophobicContact CB-CB 4.38Å; N145-D224 HydrophobicContact CB-CB 4.23Å; N145-D224 PolarHBondContact ND2-OD2 2.74Å; N145-D224 PolarHBondContact O-N 2.94Å; N145-F225 HydrophobicContact CB-CD1 3.58Å; N145-F225 HydrophobicContact CB-CD2 4.22Å; N145-F225 HydrophobicContact CB-CE1 3.24Å; N145-F225 HydrophobicContact CB-CE2 3.91Å; N145-F225 HydrophobicContact CB-CG 4.08Å; N145-F225 HydrophobicContact CB-CZ 3.43Å; N145-F225 VanDerWaalsContact CB-CZ 3.43Å; N145-F225 PolarHBondContact N-O 3.36Å
146	T	98	Very high	91.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.3	174.3	-61.1	0	0	0	0	108.1	E100 A101 P107 I109 M221 F237	E100-T146 VanDerWaalsContact CA-O 3.28Å; E100-T146 WeakPolarHBondContact CA-O 3.45Å; A101-T146 PolarHBondContact N-O 2.69Å; A101-T146 PolarHBondContact O-N 3.39Å; P107-T146 VanDerWaalsContact O-CB 3.27Å; P107-T146 WeakPolarHBondContact O-CB 3.47Å; P107-T146 WeakPolarHBondContact O-CG2 3.41Å; P107-T146 PolarHBondContact O-OG1 3.28Å; I109-T146 HydrophobicContact CD1-CG2 4.2Å; I109-T146 VanDerWaalsContact CD1-O 3.29Å; I109-T146 WeakPolarHBondContact CD1-O 3.4Å; I109-T146 HydrophobicContact CG1-CG2 4.28Å; T146-M221 HydrophobicContact CG2-CG 3.64Å; T146-M221 HydrophobicContact CG2-SD 3.78Å; T146-F237 HydrophobicContact CG2-CD2 3.94Å; T146-F237 HydrophobicContact CG2-CE2 4.32Å
147	A	98.4	Very high	92	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143.1	174	0	0	0	0	0	110	E100 M221 W222	E100-A147 HydrophobicContact CG-CB 3.85Å; A147-M221 WeakPolarHBondContact O-CA 3.07Å; A147-W222 HydrophobicContact CB-CD2 4Å; A147-W222 VanDerWaalsContact CB-CE2 3.44Å; A147-W222 HydrophobicContact CB-CH2 4.11Å; A147-W222 HydrophobicContact CB-CZ2 3.5Å; A147-W222 PolarHBondContact N-O 2.84Å; A147-W222 PolarHBondContact O-N 2.8Å
148	A	98	Very high	92.7	Very high	2 Å²	2	36 Å²	36	2%	0.017	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147.2	175.7	0	0	0	0	0	111.6	R98 C99 I109 Y220 M221	R98-A148 WeakPolarHBondContact CA-O 3.43Å; C99-A148 PolarHBondContact N-O 3.07Å; C99-A148 PolarHBondContact O-N 3.35Å; I109-A148 HydrophobicContact CB-CB 3.78Å; I109-A148 HydrophobicContact CD1-CB 4.04Å; I109-A148 HydrophobicContact CG1-CB 4.49Å; I109-A148 HydrophobicContact CG2-CB 3.69Å; A148-Y220 CarbonylContact C-O 3.52Å; A148-Y220 WeakPolarHBondContact CA-O 3.32Å; A148-Y220 WeakPolarHBondContact CB-O 3.04Å; A148-M221 HydrophobicContact CB-CG 4.47Å
149	Q	96.9	Very high	93.2	Very high	57 Å²	57	35.8 Å²	35.8	27%	0.266	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.5	-180	-173.7	168	-49.5	0	0	111.1	L97 Q151 Y220 W222	L97-Q149 CarbonylContact O-C 3.58Å; L97-Q149 WeakPolarHBondContact O-CA 3.38Å; Q149-Q151 VanDerWaalsContact NE2-OE1 3.11Å; Q149-Y220 PolarHBondContact N-O 2.88Å; Q149-W222 HydrophobicContact CB-CH2 4.1Å; Q149-W222 HydrophobicContact CB-CZ3 3.99Å
150	L	96.3	Very high	93.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	118.2	169.2	169.4	62.7	0	0	0	108.5	S96 L97 W111 I118 Q120 I152 Y163	S96-L150 CarbonylContact C-O 3.57Å; S96-L150 VanDerWaalsContact CA-O 3.23Å; S96-L150 WeakPolarHBondContact CA-O 3.19Å; L97-L150 HydrophobicContact CB-CB 4.43Å; L97-L150 HydrophobicContact CD1-CD2 4.34Å; L97-L150 PolarHBondContact N-O 3.29Å; L97-L150 PolarHBondContact O-N 3.38Å; W111-L150 HydrophobicContact CB-CD2 4.5Å; W111-L150 HydrophobicContact CD2-CB 3.83Å; W111-L150 HydrophobicContact CD2-CD2 4.07Å; W111-L150 HydrophobicContact CE3-CB 4.35Å; W111-L150 HydrophobicContact CE3-CD2 4.03Å; W111-L150 HydrophobicContact CG-CB 4.14Å; W111-L150 HydrophobicContact CG-CD2 4.29Å; W111-L150 HydrophobicContact CZ2-CB 4.03Å; I118-L150 HydrophobicContact CD1-CD1 3.87Å; I118-L150 HydrophobicContact CD1-CD2 3.63Å; I118-L150 HydrophobicContact CD1-CG 4.44Å; Q120-L150 HydrophobicContact CG-CD1 4.32Å; L150-I152 HydrophobicContact CD1-CD1 4.12Å; L150-Y163 HydrophobicContact CD2-CD1 3.38Å; L150-Y163 HydrophobicContact CD2-CE1 3.54Å; L150-Y163 HydrophobicContact CD2-CG 4.42Å
151	Q	91.3	Very high	94.1	Very high	53 Å²	53	35.3 Å²	35.3	25%	0.248	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.9	-179.4	-172.9	75.5	31.3	0	0	110.7	F95 Q149 P153 K218	F95-Q151 PolarHBondContact O-NE2 3.25Å; Q149-Q151 VanDerWaalsContact NE2-OE1 3.11Å; Q151-P153 WeakPolarHBondContact O-CD 3.05Å; Q151-K218 HydrophobicContact CB-CD 4.26Å; Q151-K218 HydrophobicContact CG-CD 4.23Å
152	I	91.9	Very high	94.6	Very high	22 Å²	22	40.5 Å²	40.5	11%	0.113	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	111	170.3	-58	-56.5	0	0	0	107.9	P94 F95 L150 C154	P94-I152 VanDerWaalsContact CA-O 3.32Å; P94-I152 WeakPolarHBondContact CA-O 3.25Å; F95-I152 HydrophobicContact CD1-CB 3.88Å; F95-I152 HydrophobicContact CD1-CG2 4.16Å; F95-I152 HydrophobicContact CE1-CB 3.5Å; F95-I152 VanDerWaalsContact CE1-CB 3.5Å; F95-I152 HydrophobicContact CE1-CG1 3.85Å; F95-I152 HydrophobicContact CE1-CG2 3.59Å; F95-I152 HydrophobicContact CE2-CB 4.17Å; F95-I152 HydrophobicContact CE2-CG1 3.84Å; F95-I152 HydrophobicContact CG-CB 4.4Å; F95-I152 HydrophobicContact CZ-CB 3.66Å; F95-I152 HydrophobicContact CZ-CG1 3.44Å; F95-I152 VanDerWaalsContact CZ-CG1 3.44Å; F95-I152 HydrophobicContact CZ-CG2 4.08Å; F95-I152 PolarHBondContact N-O 2.82Å; F95-I152 PolarHBondContact O-N 2.96Å; L150-I152 HydrophobicContact CD1-CD1 4.12Å; I152-C154 VanDerWaalsContact C-N 3.3Å; I152-C154 WeakPolarHBondContact CG2-O 3.41Å; I152-C154 PolarHBondContact O-N 3Å
153	P	86	Confident	94.9	Very high	71 Å²	71	40.2 Å²	40.2	46%	0.461	20%	0.203	S	C	.	.	S	Bend	trans	-67.2	-33.6	-176.9	25.8	-32.7	0	0	0	111.9	P94 Q151 C204	P94-P153 WeakPolarHBondContact CA-O 3.43Å; P94-P153 VanDerWaalsContact CB-O 3.25Å; P94-P153 WeakPolarHBondContact CB-O 3.39Å; Q151-P153 WeakPolarHBondContact O-CD 3.05Å; P153-C204 PolarHBondContact O-SG 2.94Å
154	C	88.3	Confident	95.2	Very high	47 Å²	47	41.8 Å²	41.8	32%	0.318	21%	0.208	S	C	.	.	S	Bend	trans	-135.4	109	-179.2	-58.6	0	0	0	0	111.8	I152 T156 H159 C204	I152-C154 VanDerWaalsContact C-N 3.3Å; I152-C154 WeakPolarHBondContact CG2-O 3.41Å; I152-C154 PolarHBondContact O-N 3Å; C154-T156 PolarHBondContact O-N 3.16Å; C154-H159 PolarHBondContact O-CE1 3.38Å; C154-H159 PolarHBondContact O-ND1 2.77Å; C154-H159 VanDerWaalsContact O-ND1 3.08Å; C154-C204 WeakPolarHBondContact CA-SG 3.46Å; C154-C204 HydrophobicContact CB-CB 4.13Å; C154-C204 WeakPolarHBondContact CB-SG 3.31Å; C154-C204 WeakPolarHBondContact SG-CB 3.35Å; C154-C204 CovalentContact SG-SG 2.03Å; C154-C204 PolarHBondContact SG-SG 3.4Å
155	A	92.1	Very high	95.2	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	21%	0.208	C	C	.	.			trans	-59.7	132	170.2	0	0	0	0	0	111.1	V89 G92 L93 F95 I182	V89-A155 HydrophobicContact CG1-CB 3.93Å; V89-A155 HydrophobicContact CG2-CB 4.39Å; G92-A155 PolarHBondContact N-O 3.14Å; L93-A155 WeakPolarHBondContact O-CB 3.32Å; L93-A155 PolarHBondContact O-N 2.72Å; F95-A155 HydrophobicContact CD1-CB 4.1Å; F95-A155 HydrophobicContact CE1-CB 4.26Å; A155-I182 HydrophobicContact CB-CD1 3.96Å; A155-I182 HydrophobicContact CB-CG2 4.42Å
156	T	92.3	Very high	95.2	Very high	47 Å²	47	42.2 Å²	42.2	29%	0.288	21%	0.211	S	C	.	.			trans	-137.8	162.8	168	70.8	0	0	0	0	107.2	C154 K158 H159	C154-T156 PolarHBondContact O-N 3.16Å; T156-K158 PolarHBondContact O-N 2.78Å; T156-K158 PolarHBondContact OG1-N 2.86Å; T156-H159 PolarHBondContact N-ND1 3.45Å; T156-H159 WeakPolarHBondContact O-CB 2.91Å; T156-H159 PolarHBondContact O-N 2.83Å; T156-H159 PolarHBondContact OG1-ND1 2.94Å
157	Y	94.1	Very high	95.2	Very high	118 Å²	118	42.2 Å²	42.2	46%	0.463	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-57	-22.6	176.8	-68.7	-75.6	0	0	0	114.1	E91 H159 A160 I182 N184	E91-Y157 WeakPolarHBondContact OE1-CD2 3.44Å; E91-Y157 WeakPolarHBondContact OE2-CE2 3.5Å; Y157-H159 PolarHBondContact O-N 2.79Å; Y157-A160 WeakPolarHBondContact O-CB 3.45Å; Y157-A160 PolarHBondContact O-N 2.84Å; Y157-A160 VanDerWaalsContact O-N 3.16Å; Y157-I182 HydrophobicContact CD1-CB 4.29Å; Y157-I182 HydrophobicContact CD1-CG2 4.38Å; Y157-I182 HydrophobicContact CE1-CG2 4.48Å; Y157-I182 WeakPolarHBondContact CE1-O 3.39Å; Y157-N184 PolarHBondContact OH-N 2.85Å
158	K	94.8	Very high	94.9	Very high	177 Å²	177	45.7 Å²	45.7	77%	0.77	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-67.8	-18.8	174.4	-62	-179.5	179.7	176.9	0	113.4	F113 T156	F113-K158 WeakPolarHBondContact CE1-O 3.37Å; F113-K158 WeakPolarHBondContact CZ-O 3.21Å; T156-K158 PolarHBondContact O-N 2.78Å; T156-K158 PolarHBondContact OG1-N 2.86Å
159	H	95.9	Very high	94.5	Very high	54 Å²	54	45.8 Å²	45.8	25%	0.25	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-92.5	-0.9	176.2	-56.3	137.1	0	0	0	112.6	F95 C154 T156 Y157 Y163	F95-H159 HydrophobicContact CE1-CB 4.22Å; F95-H159 HydrophobicContact CZ-CB 4.25Å; C154-H159 PolarHBondContact O-CE1 3.38Å; C154-H159 PolarHBondContact O-ND1 2.77Å; C154-H159 VanDerWaalsContact O-ND1 3.08Å; T156-H159 PolarHBondContact N-ND1 3.45Å; T156-H159 WeakPolarHBondContact O-CB 2.91Å; T156-H159 PolarHBondContact O-N 2.83Å; T156-H159 PolarHBondContact OG1-ND1 2.94Å; Y157-H159 PolarHBondContact O-N 2.79Å; H159-Y163 WeakPolarHBondContact O-CE2 3.27Å; H159-Y163 PolarHBondContact O-OH 3.44Å; H159-Y163 VanDerWaalsContact O-OH 3.13Å
160	A	96.6	Very high	94	Very high	36 Å²	36	45.2 Å²	45.2	30%	0.298	24%	0.237	S	C	.	.			trans	-74.4	133.4	173.3	0	0	0	0	0	110.2	F113 Y157 V180 I182	F113-A160 WeakPolarHBondContact CZ-O 3.27Å; Y157-A160 WeakPolarHBondContact O-CB 3.45Å; Y157-A160 PolarHBondContact O-N 2.84Å; Y157-A160 VanDerWaalsContact O-N 3.16Å; A160-V180 WeakPolarHBondContact CA-O 3.48Å; A160-I182 HydrophobicContact CB-CB 4.31Å; A160-I182 HydrophobicContact CB-CG1 3.83Å
161	G	97.5	Very high	93.5	Very high	12 Å²	12	51.5 Å²	51.5	12%	0.124	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.7	-159.7	179	0	0	0	0	0	114.3	V180	G161-V180 PolarHBondContact N-O 3.14Å; G161-V180 PolarHBondContact O-N 2.72Å
162	Y	98.4	Very high	93.4	Very high	125 Å²	125	52.1 Å²	52.1	49%	0.49	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.7	-179.1	-66.5	-86.5	0	0	0	109.8	N114 T177 K179	N114-Y162 PolarHBondContact N-O 3.46Å; N114-Y162 PolarHBondContact OD1-N 3.4Å; Y162-T177 HydrophobicContact CD1-CG2 4.12Å; Y162-K179 HydrophobicContact CD1-CB 4.33Å; Y162-K179 HydrophobicContact CD1-CG 4.43Å; Y162-K179 HydrophobicContact CE1-CB 4.2Å; Y162-K179 HydrophobicContact CE1-CD 3.95Å; Y162-K179 HydrophobicContact CE1-CG 4.12Å; Y162-K179 PolarHBondContact OH-NZ 3.08Å
163	Y	98.5	Very high	93.6	Very high	3 Å²	3	55.1 Å²	55.1	1%	0.012	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132	173.8	-72.2	-94.1	0	0	0	109.1	L97 K112 F113 I118 L150 H159 T177 A178 V180	L97-Y163 VanDerWaalsContact CD1-CB 3.4Å; L97-Y163 HydrophobicContact CD1-CD1 4.01Å; L97-Y163 HydrophobicContact CD1-CD2 3.91Å; L97-Y163 HydrophobicContact CD1-CG 3.5Å; L97-Y163 VanDerWaalsContact CD1-CG 3.5Å; K112-Y163 CarbonylContact O-C 3.6Å; K112-Y163 WeakPolarHBondContact O-CA 3.33Å; F113-Y163 HydrophobicContact CB-CD1 4.18Å; F113-Y163 HydrophobicContact CB-CE1 3.94Å; F113-Y163 AromaticContact CD2-CD1 3.99Å; F113-Y163 HydrophobicContact CD2-CD1 3.99Å; F113-Y163 AromaticContact CD2-CD2 3.96Å; F113-Y163 HydrophobicContact CD2-CD2 3.96Å; F113-Y163 AromaticContact CD2-CE1 3.56Å; F113-Y163 HydrophobicContact CD2-CE1 3.56Å; F113-Y163 AromaticContact CD2-CE2 3.53Å; F113-Y163 HydrophobicContact CD2-CE2 3.53Å; F113-Y163 HydrophobicContact CD2-CG 4.19Å; F113-Y163 AromaticContact CD2-CZ 3.32Å; F113-Y163 HydrophobicContact CE2-CD2 4.33Å; F113-Y163 HydrophobicContact CE2-CE1 4.34Å; F113-Y163 AromaticContact CE2-CE2 3.63Å; F113-Y163 HydrophobicContact CE2-CE2 3.63Å; F113-Y163 AromaticContact CE2-CZ 3.65Å; F113-Y163 AromaticContact CG-CE1 3.99Å; F113-Y163 HydrophobicContact CG-CE1 3.99Å; I118-Y163 HydrophobicContact CD1-CD1 4.18Å; I118-Y163 HydrophobicContact CD1-CE1 3.98Å; L150-Y163 HydrophobicContact CD2-CD1 3.38Å; L150-Y163 HydrophobicContact CD2-CE1 3.54Å; L150-Y163 HydrophobicContact CD2-CG 4.42Å; H159-Y163 WeakPolarHBondContact O-CE2 3.27Å; H159-Y163 PolarHBondContact O-OH 3.44Å; H159-Y163 VanDerWaalsContact O-OH 3.13Å; Y163-T177 CarbonylContact O-C 3.53Å; Y163-T177 VanDerWaalsContact O-CA 3.25Å; Y163-T177 WeakPolarHBondContact O-CA 3.27Å; Y163-T177 WeakPolarHBondContact O-CG2 3.35Å; Y163-A178 PolarHBondContact N-O 2.94Å; Y163-A178 PolarHBondContact O-N 2.95Å; Y163-V180 HydrophobicContact CD2-CB 3.95Å; Y163-V180 HydrophobicContact CD2-CG2 3.45Å; Y163-V180 VanDerWaalsContact CD2-CG2 3.45Å; Y163-V180 HydrophobicContact CE2-CB 3.75Å; Y163-V180 HydrophobicContact CE2-CG1 4.45Å; Y163-V180 HydrophobicContact CE2-CG2 3.6Å; Y163-V180 HydrophobicContact CG-CG2 4.46Å
164	E	98.4	Very high	94.2	Very high	48 Å²	48	53.7 Å²	53.7	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	121.2	178.8	-178.9	-175.5	-162.1	0	0	108.2	W111 K112 V166 S175 A176	W111-E164 CarbonylContact C-O 3.59Å; W111-E164 WeakPolarHBondContact CA-O 3.15Å; K112-E164 HydrophobicContact CB-CB 4.29Å; K112-E164 WeakPolarHBondContact CD-OE2 3.43Å; K112-E164 PolarHBondContact N-O 2.81Å; K112-E164 IonicContact NZ-OE2 3.58Å; K112-E164 PolarHBondContact O-N 2.99Å; E164-V166 HydrophobicContact CG-CG2 3.92Å; E164-S175 WeakPolarHBondContact OE1-CB 3.12Å; E164-S175 PolarHBondContact OE1-OG 2.69Å; E164-A176 CarbonylContact C-O 3.59Å; E164-A176 WeakPolarHBondContact CA-O 3.34Å
165	C	98.2	Very high	94.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.9	164.5	67.3	0	0	0	0	109	P84 C99 I109 S110 W111 S175 A176	P84-C165 WeakPolarHBondContact CD-SG 3.33Å; C99-C165 HydrophobicContact CB-CB 3.41Å; C99-C165 VanDerWaalsContact CB-CB 3.41Å; C99-C165 WeakPolarHBondContact CB-SG 3.3Å; C99-C165 WeakPolarHBondContact SG-CB 3.31Å; C99-C165 CovalentContact SG-SG 2.05Å; C99-C165 PolarHBondContact SG-SG 2.8Å; I109-C165 HydrophobicContact CG2-CB 4.18Å; S110-C165 WeakPolarHBondContact O-CA 3.25Å; W111-C165 HydrophobicContact CD2-CB 4.22Å; W111-C165 HydrophobicContact CE3-CB 3.9Å; W111-C165 HydrophobicContact CH2-CB 3.87Å; W111-C165 HydrophobicContact CZ2-CB 4.17Å; W111-C165 HydrophobicContact CZ3-CB 3.72Å; C165-S175 CarbonylContact O-C 3.47Å; C165-S175 WeakPolarHBondContact O-CA 3.41Å; C165-S175 WeakPolarHBondContact O-CB 3.39Å; C165-A176 PolarHBondContact N-O 3.08Å; C165-A176 PolarHBondContact O-N 2.77Å
166	V	97.6	Very high	95	Very high	14 Å²	14	55 Å²	55	9%	0.085	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	115.6	-176.9	-176.9	0	0	0	0	108.2	I109 S110 K112 E164 T173	I109-V166 CarbonylContact C-O 3.15Å; I109-V166 WeakPolarHBondContact CA-O 3.46Å; S110-V166 PolarHBondContact N-O 3.35Å; S110-V166 PolarHBondContact O-N 3.31Å; S110-V166 PolarHBondContact OG-O 3.49Å; K112-V166 HydrophobicContact CD-CG2 4.06Å; K112-V166 HydrophobicContact CG-CG2 4.33Å; E164-V166 HydrophobicContact CG-CG2 3.92Å; V166-T173 HydrophobicContact CG1-CG2 3.45Å; V166-T173 VanDerWaalsContact CG1-CG2 3.45Å
167	A	97	Very high	95.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	138.6	176.4	0	0	0	0	0	110.8	L78 I80 A101 V108 I109 T173 V174	L78-A167 HydrophobicContact CD1-CB 4.37Å; L78-A167 HydrophobicContact CD2-CB 4.43Å; L78-A167 WeakPolarHBondContact CD2-O 3.3Å; I80-A167 HydrophobicContact CD1-CB 3.98Å; A101-A167 HydrophobicContact CB-CB 3.42Å; A101-A167 VanDerWaalsContact CB-CB 3.42Å; V108-A167 CarbonylContact O-C 3.48Å; V108-A167 VanDerWaalsContact O-CA 3.3Å; V108-A167 WeakPolarHBondContact O-CA 3.46Å; I109-A167 HydrophobicContact CG1-CB 4.12Å; A167-T173 VanDerWaalsContact O-CA 3.32Å; A167-T173 WeakPolarHBondContact O-CA 3.47Å; A167-V174 HydrophobicContact CB-CG2 3.95Å; A167-V174 PolarHBondContact N-O 3.36Å; A167-V174 PolarHBondContact O-N 2.95Å
168	E	93.1	Very high	95.5	Very high	72 Å²	72	50.9 Å²	50.9	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.2	179.5	-165.8	-161.9	127.3	0	0	111.5	P107 V108 R127 T172	P107-E168 VanDerWaalsContact CA-O 3.28Å; P107-E168 WeakPolarHBondContact CA-O 3.46Å; V108-E168 PolarHBondContact N-O 3.05Å; V108-E168 PolarHBondContact O-N 3.14Å; R127-E168 IonicContact CZ-OE1 3.41Å; R127-E168 IonicContact NH1-OE1 2.64Å; R127-E168 PolarHBondContact NH1-OE1 3.36Å; E168-T172 WeakPolarHBondContact CA-O 3.3Å
169	N	89.4	Confident	95.6	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	26%	0.264	C	S	.	.			trans	-116.3	7.3	175.3	70.9	-2.2	0	0	0	113.8	S77 L78 I104 P105 P107 R127 F171 T172	S77-N169 PolarHBondContact O-ND2 3.35Å; L78-N169 HydrophobicContact CD2-CB 4.38Å; I104-N169 PolarHBondContact O-ND2 3.47Å; P105-N169 WeakPolarHBondContact O-CB 3.14Å; P107-N169 HydrophobicContact CB-CB 4.45Å; R127-N169 PolarHBondContact NH2-O 3.06Å; N169-F171 VanDerWaalsContact C-N 3.34Å; N169-F171 PolarHBondContact OD1-N 2.98Å; N169-T172 PolarHBondContact N-O 2.74Å; N169-T172 PolarHBondContact OD1-N 3.43Å; N169-T172 PolarHBondContact OD1-O 3.22Å; N169-T172 PolarHBondContact OD1-OG1 3.28Å
170	G	85.8	Confident	95.7	Very high	46 Å²	46	44.8 Å²	44.8	47%	0.474	25%	0.252	S	S	.	.	S	Bend	trans	87.7	-8.2	-176.7	0	0	0	0	0	115.3
171	F	86.4	Confident	95.6	Very high	132 Å²	132	44.5 Å²	44.5	58%	0.579	25%	0.252	S	S	*	.	S	Bend	trans	-113.2	-40	173.3	-65	-87.5	0	0	0	111.6	L72 P76 P105 N169	L72-F171 HydrophobicContact CD1-CE2 4.48Å; P76-F171 HydrophobicContact CB-CB 4.15Å; P76-F171 HydrophobicContact CB-CD1 4.35Å; P76-F171 HydrophobicContact CB-CD2 3.96Å; P76-F171 HydrophobicContact CB-CE2 4.45Å; P76-F171 HydrophobicContact CB-CG 3.89Å; P76-F171 HydrophobicContact CG-CD1 4.13Å; P76-F171 HydrophobicContact CG-CD2 4.13Å; P76-F171 HydrophobicContact CG-CE1 4.17Å; P76-F171 HydrophobicContact CG-CE2 4.17Å; P76-F171 HydrophobicContact CG-CG 4.1Å; P76-F171 HydrophobicContact CG-CZ 4.18Å; P105-F171 HydrophobicContact CG-CD2 4.38Å; P105-F171 HydrophobicContact CG-CE2 3.91Å; N169-F171 VanDerWaalsContact C-N 3.34Å; N169-F171 PolarHBondContact OD1-N 2.98Å
172	T	89.3	Confident	95.4	Very high	65 Å²	65	44.9 Å²	44.9	40%	0.399	25%	0.251	S	S	.	.			trans	-136.9	155.2	-178.8	53.5	0	0	0	0	110.5	L78 E168 N169	L78-T172 WeakPolarHBondContact CB-OG1 3.31Å; L78-T172 VanDerWaalsContact CD2-O 3.28Å; L78-T172 WeakPolarHBondContact CD2-O 3.1Å; E168-T172 WeakPolarHBondContact CA-O 3.3Å; N169-T172 PolarHBondContact N-O 2.74Å; N169-T172 PolarHBondContact OD1-N 3.43Å; N169-T172 PolarHBondContact OD1-O 3.22Å; N169-T172 PolarHBondContact OD1-OG1 3.28Å
173	T	95.6	Very high	94.9	Very high	86 Å²	86	39.5 Å²	39.5	53%	0.528	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.6	172.2	-48.8	0	0	0	0	107.9	V166 A167	V166-T173 HydrophobicContact CG1-CG2 3.45Å; V166-T173 VanDerWaalsContact CG1-CG2 3.45Å; A167-T173 VanDerWaalsContact O-CA 3.32Å; A167-T173 WeakPolarHBondContact O-CA 3.47Å
174	V	98.3	Very high	94.2	Very high	40 Å²	40	42 Å²	42	24%	0.242	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.2	173.9	-60.2	0	0	0	0	109.1	L78 I80 A167	L78-V174 HydrophobicContact CD1-CG2 4.49Å; L78-V174 HydrophobicContact CD2-CG1 4.42Å; L78-V174 HydrophobicContact CD2-CG2 3.88Å; L78-V174 HydrophobicContact CG-CG1 4.33Å; L78-V174 HydrophobicContact CG-CG2 3.69Å; I80-V174 HydrophobicContact CD1-CG2 3.75Å; I80-V174 HydrophobicContact CG1-CG2 3.89Å; A167-V174 HydrophobicContact CB-CG2 3.95Å; A167-V174 PolarHBondContact N-O 3.36Å; A167-V174 PolarHBondContact O-N 2.95Å
175	S	98.3	Very high	92.8	Very high	59 Å²	59	42.7 Å²	42.7	41%	0.413	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.8	177.5	63.9	0	0	0	0	112.9	E164 C165	E164-S175 WeakPolarHBondContact OE1-CB 3.12Å; E164-S175 PolarHBondContact OE1-OG 2.69Å; C165-S175 CarbonylContact O-C 3.47Å; C165-S175 WeakPolarHBondContact O-CA 3.41Å; C165-S175 WeakPolarHBondContact O-CB 3.39Å
176	A	98.6	Very high	91.3	Very high	16 Å²	16	50.1 Å²	50.1	13%	0.132	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.7	172	0	0	0	0	0	110.1	I80 A83 E164 C165	I80-A176 HydrophobicContact CG1-CB 4.15Å; I80-A176 HydrophobicContact CG2-CB 4.05Å; A83-A176 HydrophobicContact CB-CB 3.79Å; E164-A176 CarbonylContact C-O 3.59Å; E164-A176 WeakPolarHBondContact CA-O 3.34Å; C165-A176 PolarHBondContact N-O 3.08Å; C165-A176 PolarHBondContact O-N 2.77Å
177	T	98.5	Very high	89.5	Confident	78 Å²	78	52.2 Å²	52.2	48%	0.479	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142	-170.9	-57.5	0	0	0	0	111.1	Y162 Y163	Y162-T177 HydrophobicContact CD1-CG2 4.12Å; Y163-T177 CarbonylContact O-C 3.53Å; Y163-T177 VanDerWaalsContact O-CA 3.25Å; Y163-T177 WeakPolarHBondContact O-CA 3.27Å; Y163-T177 WeakPolarHBondContact O-CG2 3.35Å
178	A	98.5	Very high	87.6	Confident	1 Å²	1	54 Å²	54	1%	0.008	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.4	170.2	0	0	0	0	0	110.6	P84 K85 D86 L97 Y163	P84-A178 HydrophobicContact CB-CB 3.78Å; P84-A178 HydrophobicContact CG-CB 3.94Å; K85-A178 WeakPolarHBondContact O-CB 3.28Å; D86-A178 WeakPolarHBondContact OD1-CA 3.45Å; L97-A178 HydrophobicContact CD2-CB 4.46Å; Y163-A178 PolarHBondContact N-O 2.94Å; Y163-A178 PolarHBondContact O-N 2.95Å
179	K	98.1	Very high	85.8	Confident	103 Å²	103	58 Å²	58	45%	0.448	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.3	173.6	-170.2	173.5	-175.7	167.4	0	110.2	D86 V87 Y162	D86-K179 WeakPolarHBondContact CA-O 3.46Å; D86-K179 PolarHBondContact OD1-N 3.02Å; V87-K179 PolarHBondContact N-O 3.47Å; Y162-K179 HydrophobicContact CD1-CB 4.33Å; Y162-K179 HydrophobicContact CD1-CG 4.43Å; Y162-K179 HydrophobicContact CE1-CB 4.2Å; Y162-K179 HydrophobicContact CE1-CD 3.95Å; Y162-K179 HydrophobicContact CE1-CG 4.12Å; Y162-K179 PolarHBondContact OH-NZ 3.08Å
180	V	97.2	Very high	84	Confident	1 Å²	1	64 Å²	64	1%	0.006	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	119.1	172.9	178	0	0	0	0	109.3	V87 F95 L97 A160 G161 Y163 I182	V87-V180 CarbonylContact O-C 3.55Å; V87-V180 WeakPolarHBondContact O-CA 3.45Å; F95-V180 HydrophobicContact CD2-CG1 4.48Å; F95-V180 HydrophobicContact CE1-CG1 4.24Å; F95-V180 HydrophobicContact CE2-CG1 3.93Å; F95-V180 HydrophobicContact CE2-CG2 3.91Å; F95-V180 HydrophobicContact CZ-CG1 3.78Å; F95-V180 HydrophobicContact CZ-CG2 4.43Å; L97-V180 HydrophobicContact CD1-CG2 3.98Å; L97-V180 HydrophobicContact CD2-CG2 4.2Å; L97-V180 HydrophobicContact CG-CG2 4.47Å; A160-V180 WeakPolarHBondContact CA-O 3.48Å; G161-V180 PolarHBondContact N-O 3.14Å; G161-V180 PolarHBondContact O-N 2.72Å; Y163-V180 HydrophobicContact CD2-CB 3.95Å; Y163-V180 HydrophobicContact CD2-CG2 3.45Å; Y163-V180 VanDerWaalsContact CD2-CG2 3.45Å; Y163-V180 HydrophobicContact CE2-CB 3.75Å; Y163-V180 HydrophobicContact CE2-CG1 4.45Å; Y163-V180 HydrophobicContact CE2-CG2 3.6Å; Y163-V180 HydrophobicContact CG-CG2 4.46Å; V180-I182 HydrophobicContact CG1-CD1 3.66Å; V180-I182 HydrophobicContact CG1-CG1 4.46Å
181	G	95.3	Very high	82.4	Confident	29 Å²	29	68.4 Å²	68.4	30%	0.299	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	132	172.2	0	0	0	0	0	111.3	V87 R88 V89	V87-G181 PolarHBondContact O-N 3.39Å; R88-G181 VanDerWaalsContact CA-O 3.32Å; R88-G181 WeakPolarHBondContact CA-O 3.46Å; V89-G181 PolarHBondContact N-O 2.88Å
182	I	93.2	Very high	81.1	Confident	20 Å²	20	65.4 Å²	65.4	10%	0.103	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.5	177.3	-47.8	-60.3	0	0	0	108.9	V89 E91 F95 A155 Y157 A160 V180	V89-I182 HydrophobicContact CG1-CD1 3.23Å; V89-I182 WeakPolarHBondContact O-CA 3.29Å; E91-I182 HydrophobicContact CB-CG2 4.15Å; F95-I182 HydrophobicContact CE1-CD1 4.29Å; A155-I182 HydrophobicContact CB-CD1 3.96Å; A155-I182 HydrophobicContact CB-CG2 4.42Å; Y157-I182 HydrophobicContact CD1-CB 4.29Å; Y157-I182 HydrophobicContact CD1-CG2 4.38Å; Y157-I182 HydrophobicContact CE1-CG2 4.48Å; Y157-I182 WeakPolarHBondContact CE1-O 3.39Å; A160-I182 HydrophobicContact CB-CB 4.31Å; A160-I182 HydrophobicContact CB-CG1 3.83Å; V180-I182 HydrophobicContact CG1-CD1 3.66Å; V180-I182 HydrophobicContact CG1-CG1 4.46Å
183	G	87.8	Confident	79.5	Confident	12 Å²	12	65.3 Å²	65.3	12%	0.124	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	164.6	178	0	0	0	0	0	113.2	V89 R90 E91 S187	V89-G183 PolarHBondContact O-N 3.48Å; V89-G183 VanDerWaalsContact O-N 3.13Å; R90-G183 CarbonylContact C-O 3.59Å; R90-G183 WeakPolarHBondContact CA-O 3.48Å; E91-G183 PolarHBondContact N-O 3.46Å; G183-S187 WeakPolarHBondContact CA-OG 3.33Å
184	N	82.8	Confident	77.5	Confident	57 Å²	57	68.9 Å²	68.9	31%	0.305	40%	0.4	S	S	.	.			trans	-88.8	171.6	172.5	67.1	0.3	0	0	0	111.5	Y157 E186 S187 L188	Y157-N184 PolarHBondContact OH-N 2.85Å; N184-E186 PolarHBondContact O-N 2.86Å; N184-E186 PolarHBondContact OD1-N 2.97Å; N184-S187 PolarHBondContact N-OG 2.96Å; N184-S187 VanDerWaalsContact N-OG 3.15Å; N184-S187 PolarHBondContact O-N 2.93Å; N184-S187 PolarHBondContact O-OG 3.3Å; N184-S187 WeakPolarHBondContact OD1-CB 3.2Å; N184-S187 PolarHBondContact OD1-N 2.9Å; N184-S187 PolarHBondContact OD1-OG 2.83Å; N184-L188 VanDerWaalsContact O-CG 3.26Å; N184-L188 WeakPolarHBondContact O-CG 3.21Å
185	A	69.4	Low	75.2	Confident	61 Å²	61	72.1 Å²	72.1	50%	0.504	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-54.8	-35.7	177.9	0	0	0	0	0	113.7	L188	A185-L188 PolarHBondContact O-N 3.3Å
186	E	66.7	Low	73	Confident	157 Å²	157	74.1 Å²	74.1	73%	0.734	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-73.5	-30	-177.1	-61.6	175	171.5	0	0	113.1	N184 L188	N184-E186 PolarHBondContact O-N 2.86Å; N184-E186 PolarHBondContact OD1-N 2.97Å; E186-L188 PolarHBondContact O-N 3.02Å
187	S	59.6	Low	70.7	Confident	57 Å²	57	77.9 Å²	77.9	40%	0.399	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-73	-9.7	176.3	69.2	0	0	0	0	113.9	G183 N184	G183-S187 WeakPolarHBondContact CA-OG 3.33Å; N184-S187 PolarHBondContact N-OG 2.96Å; N184-S187 VanDerWaalsContact N-OG 3.15Å; N184-S187 PolarHBondContact O-N 2.93Å; N184-S187 PolarHBondContact O-OG 3.3Å; N184-S187 WeakPolarHBondContact OD1-CB 3.2Å; N184-S187 PolarHBondContact OD1-N 2.9Å; N184-S187 PolarHBondContact OD1-OG 2.83Å
188	L	57.3	Low	68.4	Low	39 Å²	39	77.3 Å²	77.3	20%	0.204	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-95.2	8.2	-169.6	-59.7	169.9	0	0	0	114.6	R90 N184 A185 E186 Q190 F193	R90-L188 HydrophobicContact CB-CD1 3.7Å; R90-L188 VanDerWaalsContact CD-CD1 3.47Å; R90-L188 HydrophobicContact CG-CD1 3.58Å; N184-L188 VanDerWaalsContact O-CG 3.26Å; N184-L188 WeakPolarHBondContact O-CG 3.21Å; A185-L188 PolarHBondContact O-N 3.3Å; E186-L188 PolarHBondContact O-N 3.02Å; L188-Q190 PolarHBondContact O-N 3.3Å; L188-F193 HydrophobicContact CD2-CD1 3.56Å; L188-F193 HydrophobicContact CD2-CD2 3.45Å; L188-F193 VanDerWaalsContact CD2-CD2 3.45Å; L188-F193 HydrophobicContact CD2-CE1 3.32Å; L188-F193 HydrophobicContact CD2-CE2 3.27Å; L188-F193 HydrophobicContact CD2-CG 3.6Å; L188-F193 HydrophobicContact CD2-CZ 3.19Å
189	N	54.7	Low	66.2	Low	156 Å²	156	84.9 Å²	84.9	83%	0.834	50%	0.502	S	S	*	.			trans	-67.7	6.7	172.4	-72	-16	0	0	0	113.7
190	Q	52	Low	64	Low	130 Å²	130	81.5 Å²	81.5	61%	0.607	49%	0.492	S	S	*	.	S	Bend	trans	-95.8	128.8	167.9	-74.5	178.4	-2.3	0	0	109.9	L188 S192	L188-Q190 PolarHBondContact O-N 3.3Å; Q190-S192 PolarHBondContact O-N 3.38Å
191	S	53.6	Low	61.9	Low	138 Å²	138	87.9 Å²	87.9	97%	0.965	52%	0.522	S	S	*	.	S	Bend	trans	-58.5	19.6	-177.7	52.4	0	0	0	0	117
192	S	58.1	Low	60	Low	69 Å²	69	91.2 Å²	91.2	48%	0.483	53%	0.533	S	S	.	.			trans	-99.5	9.3	-175.5	65.7	0	0	0	0	115.1	Q190	Q190-S192 PolarHBondContact O-N 3.38Å
193	F	55.1	Low	58.6	Low	62 Å²	62	91.2 Å²	91.2	27%	0.272	54%	0.539	S	S	.	.	S	Bend	trans	-115.4	140.3	-178.2	-69.8	-94.3	0	0	0	112.1	R88 L188 A195	R88-F193 VanDerWaalsContact C-CE1 3.41Å; R88-F193 HydrophobicContact CB-CD1 4.25Å; R88-F193 HydrophobicContact CB-CE1 3.31Å; R88-F193 HydrophobicContact CB-CZ 3.47Å; R88-F193 VanDerWaalsContact CB-CZ 3.47Å; R88-F193 HydrophobicContact CG-CZ 4.41Å; R88-F193 WeakPolarHBondContact O-CD1 3.44Å; R88-F193 VanDerWaalsContact O-CE1 3.3Å; R88-F193 WeakPolarHBondContact O-CE1 3.5Å; L188-F193 HydrophobicContact CD2-CD1 3.56Å; L188-F193 HydrophobicContact CD2-CD2 3.45Å; L188-F193 VanDerWaalsContact CD2-CD2 3.45Å; L188-F193 HydrophobicContact CD2-CE1 3.32Å; L188-F193 HydrophobicContact CD2-CE2 3.27Å; L188-F193 HydrophobicContact CD2-CG 3.6Å; L188-F193 HydrophobicContact CD2-CZ 3.19Å; F193-A195 PolarHBondContact O-N 2.63Å
194	L	55.3	Low	57.7	Low	162 Å²	162	92 Å²	92	85%	0.848	54%	0.542	S	S	*	.			trans	-59.3	120.6	176.3	-60.1	-178.9	0	0	0	109.6	L196	L194-L196 PolarHBondContact O-N 2.78Å; L194-L196 VanDerWaalsContact O-N 3.07Å
195	A	50.1	Low	56.8	Low	107 Å²	107	94.1 Å²	94.1	88%	0.884	56%	0.561	S	S	*	*			trans	-64	107.9	171.8	0	0	0	0	0	108.9	F193	F193-A195 PolarHBondContact O-N 2.63Å
196	L	51.3	Low	55.8	Low	102 Å²	102	97.1 Å²	97.1	53%	0.534	57%	0.568	S	S	.	*			trans	-87.1	149.1	175.8	-75.5	155.5	0	0	0	110.6	L93 L194 A200	L93-L196 HydrophobicContact CD1-CD1 3.57Å; L194-L196 PolarHBondContact O-N 2.78Å; L194-L196 VanDerWaalsContact O-N 3.07Å; L196-A200 HydrophobicContact CB-CB 3.65Å; L196-A200 HydrophobicContact CD1-CB 4.01Å; L196-A200 HydrophobicContact CD2-CB 4.24Å; L196-A200 HydrophobicContact CG-CB 4.19Å
197	P	50.7	Low	55.2	Low	95 Å²	95	94.6 Å²	94.6	62%	0.617	56%	0.564	S	S	*	*			trans	-54.9	147.8	168	-19.8	30.1	0	0	0	111.1	I199 A200	P197-I199 PolarHBondContact O-N 3.32Å; P197-A200 WeakPolarHBondContact O-CB 3.26Å; P197-A200 PolarHBondContact O-N 2.91Å
198	A	50.5	Low	55.1	Low	65 Å²	65	97.7 Å²	97.7	54%	0.537	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-52.7	-23.8	-175.5	0	0	0	0	0	114.9	A200 Q201	A198-A200 PolarHBondContact O-N 3.13Å; A198-Q201 VanDerWaalsContact O-CB 3.23Å; A198-Q201 WeakPolarHBondContact O-CB 3.19Å; A198-Q201 VanDerWaalsContact O-CG 3.27Å; A198-Q201 WeakPolarHBondContact O-CG 3.34Å; A198-Q201 PolarHBondContact O-N 2.87Å
199	I	51.3	Low	55.2	Low	161 Å²	161	103.7 Å²	103.7	83%	0.826	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-62.6	-25.8	175.5	-61.8	167.8	0	0	0	112	P197 Q201	P197-I199 PolarHBondContact O-N 3.32Å; I199-Q201 VanDerWaalsContact C-N 3.28Å; I199-Q201 PolarHBondContact O-N 3.39Å
200	A	51.7	Low	55.7	Low	31 Å²	31	98.9 Å²	98.9	26%	0.256	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-79.6	-3.3	175.1	0	0	0	0	0	114.1	R90 L93 L196 P197 A198 N202 G203	R90-A200 PolarHBondContact NH2-O 3.5Å; L93-A200 WeakPolarHBondContact CD2-O 3.39Å; L196-A200 HydrophobicContact CB-CB 3.65Å; L196-A200 HydrophobicContact CD1-CB 4.01Å; L196-A200 HydrophobicContact CD2-CB 4.24Å; L196-A200 HydrophobicContact CG-CB 4.19Å; P197-A200 WeakPolarHBondContact O-CB 3.26Å; P197-A200 PolarHBondContact O-N 2.91Å; A198-A200 PolarHBondContact O-N 3.13Å; A200-N202 VanDerWaalsContact C-N 3.25Å; A200-N202 PolarHBondContact O-N 2.81Å; A200-G203 PolarHBondContact O-N 2.9Å
201	Q	53.4	Low	56.8	Low	136 Å²	136	99.4 Å²	99.4	64%	0.636	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-65.9	-31.5	177.7	-68.3	179	-2.8	0	0	111.6	R90 A198 I199 G203	R90-Q201 PolarHBondContact NH2-O 2.63Å; A198-Q201 VanDerWaalsContact O-CB 3.23Å; A198-Q201 WeakPolarHBondContact O-CB 3.19Å; A198-Q201 VanDerWaalsContact O-CG 3.27Å; A198-Q201 WeakPolarHBondContact O-CG 3.34Å; A198-Q201 PolarHBondContact O-N 2.87Å; I199-Q201 VanDerWaalsContact C-N 3.28Å; I199-Q201 PolarHBondContact O-N 3.39Å; Q201-G203 PolarHBondContact O-N 3.42Å
202	N	56.6	Low	57.7	Low	98 Å²	98	102.6 Å²	102.6	52%	0.524	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-82.3	14.5	-178.4	-68.6	-7.7	0	0	0	114.9	A200 S205	A200-N202 VanDerWaalsContact C-N 3.25Å; A200-N202 PolarHBondContact O-N 2.81Å; N202-S205 WeakPolarHBondContact O-CB 3.47Å; N202-S205 PolarHBondContact O-N 2.86Å
203	G	62.5	Low	58.7	Low	21 Å²	21	101.5 Å²	101.5	22%	0.216	59%	0.587	C	S	.	*	G	3₁₀ helix	trans	53.6	-158.8	172.3	0	0	0	0	0	113.9	G92 A200 Q201 S205	G92-G203 CarbonylContact O-C 3.37Å; G92-G203 VanDerWaalsContact O-CA 3.26Å; G92-G203 WeakPolarHBondContact O-CA 3.47Å; A200-G203 PolarHBondContact O-N 2.9Å; Q201-G203 PolarHBondContact O-N 3.42Å; G203-S205 PolarHBondContact O-N 2.87Å
204	C	69.4	Low	60.3	Low	29 Å²	29	100.2 Å²	100.2	20%	0.196	58%	0.582	C	S	.	*	G	3₁₀ helix	trans	-59.5	-10.2	171.9	-73.1	0	0	0	0	114.9	G92 P153 C154 N206 T207	G92-C204 PolarHBondContact O-N 3.08Å; G92-C204 PolarHBondContact O-SG 3.11Å; P153-C204 PolarHBondContact O-SG 2.94Å; C154-C204 WeakPolarHBondContact CA-SG 3.46Å; C154-C204 HydrophobicContact CB-CB 4.13Å; C154-C204 WeakPolarHBondContact CB-SG 3.31Å; C154-C204 WeakPolarHBondContact SG-CB 3.35Å; C154-C204 CovalentContact SG-SG 2.03Å; C154-C204 PolarHBondContact SG-SG 3.4Å; C204-N206 PolarHBondContact O-N 2.89Å; C204-N206 VanDerWaalsContact O-N 3.16Å; C204-T207 PolarHBondContact O-OG1 2.63Å
205	S	63	Low	61.9	Low	101 Å²	101	99.4 Å²	99.4	71%	0.706	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-72.2	-6.7	-171.6	-57.6	0	0	0	0	114.1	N202 G203	N202-S205 WeakPolarHBondContact O-CB 3.47Å; N202-S205 PolarHBondContact O-N 2.86Å; G203-S205 PolarHBondContact O-N 2.87Å
206	N	50.3	Low	63.9	Low	123 Å²	123	96.8 Å²	96.8	66%	0.658	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-129.6	9.1	180	-88.5	0.9	0	0	0	115.2	C204	C204-N206 PolarHBondContact O-N 2.89Å; C204-N206 VanDerWaalsContact O-N 3.16Å
207	T	53.4	Low	66	Low	104 Å²	104	92.1 Å²	92.1	64%	0.638	52%	0.517	S	S	*	.	S	Bend	trans	-74	130.3	166.6	37.4	0	0	0	0	108.6	C204 L209	C204-T207 PolarHBondContact O-OG1 2.63Å; T207-L209 PolarHBondContact O-N 2.93Å
208	V	57.8	Low	68.1	Low	123 Å²	123	90.8 Å²	90.8	75%	0.745	50%	0.501	S	S	*	.			trans	-5.5	113.4	175.9	179.6	0	0	0	0	112.7	L210	V208-L210 HydrophobicContact CG1-CD2 4.23Å; V208-L210 PolarHBondContact O-N 2.95Å
209	L	59	Low	70.4	Confident	165 Å²	165	88.3 Å²	88.3	86%	0.864	48%	0.479	S	S	*	.			trans	-61.1	80.1	176.9	-63.5	171	0	0	0	109.8	T207	T207-L209 PolarHBondContact O-N 2.93Å
210	L	65.3	Low	72.6	Confident	54 Å²	54	81 Å²	81	28%	0.283	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-67.9	131.2	160.9	-64	-177.5	0	0	0	106.4	V208 Q214 V216 Y293	V208-L210 HydrophobicContact CG1-CD2 4.23Å; V208-L210 PolarHBondContact O-N 2.95Å; L210-Q214 HydrophobicContact CB-CB 3.86Å; L210-Q214 WeakPolarHBondContact CD1-O 3.28Å; L210-Q214 HydrophobicContact CD2-CB 4.38Å; L210-V216 HydrophobicContact CD1-CG1 4.09Å; L210-Y293 HydrophobicContact CD2-CD1 3.84Å; L210-Y293 HydrophobicContact CD2-CG 3.78Å
211	E	74	Confident	74.7	Confident	141 Å²	141	79.5 Å²	79.5	66%	0.659	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-64.1	163.1	173.5	-54.8	177.5	148.2	0	0	109.8	G213 Q214	E211-G213 PolarHBondContact O-N 2.72Å; E211-Q214 HydrophobicContact CB-CG 4.34Å; E211-Q214 WeakPolarHBondContact O-CB 3.29Å; E211-Q214 PolarHBondContact O-N 2.94Å; E211-Q214 PolarHBondContact OE2-NE2 2.85Å
212	E	74.2	Confident	76.9	Confident	205 Å²	205	74.3 Å²	74.3	96%	0.958	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	117.8	-178.2	-168.1	167.5	-166.6	0	0	111.2
213	G	79.2	Confident	78.9	Confident	46 Å²	46	69.6 Å²	69.6	47%	0.474	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.3	-22	-178.5	0	0	0	0	0	115.2	E211 Y243	E211-G213 PolarHBondContact O-N 2.72Å; G213-Y243 WeakPolarHBondContact O-CB 3.41Å; G213-Y243 WeakPolarHBondContact O-CD1 3.07Å
214	Q	87.3	Confident	80.6	Confident	35 Å²	35	71.2 Å²	71.2	16%	0.164	38%	0.382	C	S	.	.			trans	-73.8	132.7	179.6	-64.4	171	-0.4	0	0	111.2	L210 E211 Y293	L210-Q214 HydrophobicContact CB-CB 3.86Å; L210-Q214 WeakPolarHBondContact CD1-O 3.28Å; L210-Q214 HydrophobicContact CD2-CB 4.38Å; E211-Q214 HydrophobicContact CB-CG 4.34Å; E211-Q214 WeakPolarHBondContact O-CB 3.29Å; E211-Q214 PolarHBondContact O-N 2.94Å; E211-Q214 PolarHBondContact OE2-NE2 2.85Å; Q214-Y293 HydrophobicContact CB-CD2 4.06Å; Q214-Y293 HydrophobicContact CB-CE2 3.67Å; Q214-Y293 HydrophobicContact CG-CD2 4.4Å; Q214-Y293 HydrophobicContact CG-CE1 4.24Å; Q214-Y293 HydrophobicContact CG-CE2 3.53Å; Q214-Y293 VanDerWaalsContact CG-CZ 3.48Å; Q214-Y293 WeakPolarHBondContact CG-OH 2.99Å; Q214-Y293 PolarHBondContact NE2-OH 2.85Å
215	R	90.1	Very high	82	Confident	146 Å²	146	71.9 Å²	71.9	55%	0.551	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	125.7	-177.9	-63.2	-178.6	-66.7	172.9	4.1	110.6	Y243 N291	R215-Y243 PolarHBondContact N-O 3.49Å; R215-Y243 PolarHBondContact O-N 3.44Å; R215-N291 PolarHBondContact O-ND2 2.78Å
216	V	91.6	Very high	83.6	Confident	52 Å²	52	67 Å²	67	32%	0.315	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	150.1	172.4	-67.5	0	0	0	0	111.4	L210	L210-V216 HydrophobicContact CD1-CG1 4.09Å
217	P	95.6	Very high	85.8	Confident	4 Å²	4	64.1 Å²	64.1	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	139.8	176.3	-21.8	36.6	0	0	0	110.7	S241 P246 A289 N291 G294 S296	P217-S241 CarbonylContact C-O 3.58Å; P217-S241 VanDerWaalsContact CA-O 3.28Å; P217-S241 WeakPolarHBondContact CA-O 3.35Å; P217-P246 HydrophobicContact CB-CB 3.9Å; P217-P246 HydrophobicContact CB-CG 3.74Å; P217-P246 HydrophobicContact CG-CB 4.11Å; P217-P246 HydrophobicContact CG-CG 4.07Å; P217-A289 HydrophobicContact CB-CB 3.98Å; P217-N291 VanDerWaalsContact CD-OD1 3.26Å; P217-N291 WeakPolarHBondContact CD-OD1 2.88Å; P217-N291 HydrophobicContact CG-CB 4.07Å; P217-G294 VanDerWaalsContact CD-C 3.47Å; P217-G294 WeakPolarHBondContact CD-O 3.3Å; P217-G294 WeakPolarHBondContact CG-O 3.26Å; P217-S296 WeakPolarHBondContact O-CB 3.22Å
218	K	94.9	Very high	87.8	Confident	66 Å²	66	59.2 Å²	59.2	29%	0.287	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	112.6	174.1	-68.7	179.6	-178.9	172.6	0	109.3	Q151 Y220 A240 S241	Q151-K218 HydrophobicContact CB-CD 4.26Å; Q151-K218 HydrophobicContact CG-CD 4.23Å; K218-Y220 PolarHBondContact O-N 2.88Å; K218-A240 CarbonylContact O-C 3.53Å; K218-A240 WeakPolarHBondContact O-CA 2.92Å; K218-S241 PolarHBondContact N-O 2.83Å; K218-S241 PolarHBondContact O-N 2.94Å; K218-S241 PolarHBondContact O-OG 3.3Å
219	I	97.8	Very high	89.4	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.072	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	115.5	169.2	-63	167.6	0	0	0	107.7	W222 R239 A240 A289 S296	I219-W222 HydrophobicContact CG2-CB 4.16Å; I219-W222 HydrophobicContact CG2-CD2 4.43Å; I219-W222 HydrophobicContact CG2-CE3 3.87Å; I219-R239 CarbonylContact C-O 3.57Å; I219-R239 WeakPolarHBondContact CA-O 3.32Å; I219-A240 HydrophobicContact CG1-CB 4Å; I219-A289 HydrophobicContact CD1-CB 4.24Å; I219-A289 HydrophobicContact CG1-CB 3.89Å; I219-S296 WeakPolarHBondContact CD1-O 3.25Å; I219-S296 PolarHBondContact N-OG 3.43Å; I219-S296 VanDerWaalsContact N-OG 3.16Å
220	Y	97	Very high	91	Very high	6 Å²	6	48.6 Å²	48.6	2%	0.024	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-17.9	-176.7	62	-100.7	0	0	0	112.8	Q120 E124 A148 Q149 K218 R239 A240	Q120-Y220 HydrophobicContact CB-CD1 3.88Å; Q120-Y220 HydrophobicContact CB-CD2 3.8Å; Q120-Y220 HydrophobicContact CB-CE1 4.44Å; Q120-Y220 HydrophobicContact CB-CE2 4.39Å; Q120-Y220 HydrophobicContact CB-CG 3.52Å; Q120-Y220 HydrophobicContact CG-CG 4.39Å; E124-Y220 HydrophobicContact CB-CE2 4Å; E124-Y220 HydrophobicContact CG-CE2 4.19Å; E124-Y220 PolarHBondContact N-OH 3.06Å; A148-Y220 CarbonylContact C-O 3.52Å; A148-Y220 WeakPolarHBondContact CA-O 3.32Å; A148-Y220 WeakPolarHBondContact CB-O 3.04Å; Q149-Y220 PolarHBondContact N-O 2.88Å; K218-Y220 PolarHBondContact O-N 2.88Å; Y220-R239 WeakPolarHBondContact CD1-O 3.34Å; Y220-R239 HydrophobicContact CD2-CB 4.49Å; Y220-R239 HydrophobicContact CE1-CB 4.04Å; Y220-R239 HydrophobicContact CE2-CB 3.75Å; Y220-R239 VanDerWaalsContact CZ-CB 3.49Å; Y220-R239 PolarHBondContact N-O 3.49Å; Y220-R239 WeakPolarHBondContact OH-CB 3.33Å; Y220-A240 VanDerWaalsContact CE1-C 3.42Å; Y220-A240 WeakPolarHBondContact CE1-O 3.49Å
221	M	97.7	Very high	92.3	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	136.1	173.4	-172	172.3	64	0	0	110.7	T146 A147 A148 F237 R239	T146-M221 HydrophobicContact CG2-CG 3.64Å; T146-M221 HydrophobicContact CG2-SD 3.78Å; A147-M221 WeakPolarHBondContact O-CA 3.07Å; A148-M221 HydrophobicContact CB-CG 4.47Å; M221-F237 HydrophobicContact CE-CD2 4.36Å; M221-R239 HydrophobicContact CE-CG 4.33Å; M221-R239 VanDerWaalsContact CE-CZ 3.4Å; M221-R239 PolarHBondContact N-O 2.82Å; M221-R239 PolarHBondContact O-N 2.8Å
222	W	98.3	Very high	93.2	Very high	26 Å²	26	40.6 Å²	40.6	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	161.9	177.2	65.2	100.1	0	0	0	111.3	A147 Q149 I219 F237	A147-W222 HydrophobicContact CB-CD2 4Å; A147-W222 VanDerWaalsContact CB-CE2 3.44Å; A147-W222 HydrophobicContact CB-CH2 4.11Å; A147-W222 HydrophobicContact CB-CZ2 3.5Å; A147-W222 PolarHBondContact N-O 2.84Å; A147-W222 PolarHBondContact O-N 2.8Å; Q149-W222 HydrophobicContact CB-CH2 4.1Å; Q149-W222 HydrophobicContact CB-CZ3 3.99Å; I219-W222 HydrophobicContact CG2-CB 4.16Å; I219-W222 HydrophobicContact CG2-CD2 4.43Å; I219-W222 HydrophobicContact CG2-CE3 3.87Å; W222-F237 WeakPolarHBondContact CA-O 3.44Å; W222-F237 WeakPolarHBondContact CB-O 3.45Å
223	T	98.3	Very high	94.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.3	170.8	-60.6	0	0	0	0	109.2	S144 F225 R226 L236 F237 T300	S144-T223 WeakPolarHBondContact OG-CG2 3.31Å; T223-F225 VanDerWaalsContact CG2-O 3.31Å; T223-F225 WeakPolarHBondContact CG2-O 3.33Å; T223-R226 HydrophobicContact CG2-CB 3.97Å; T223-L236 HydrophobicContact CG2-CD2 4.48Å; T223-F237 PolarHBondContact N-O 3.5Å; T223-F237 VanDerWaalsContact N-O 3.11Å; T223-F237 PolarHBondContact OG1-N 2.79Å; T223-T300 HydrophobicContact CG2-CG2 3.77Å; T223-T300 WeakPolarHBondContact O-CA 3.32Å; T223-T300 VanDerWaalsContact O-CB 3.26Å; T223-T300 WeakPolarHBondContact O-CB 3.17Å; T223-T300 WeakPolarHBondContact O-CG2 3.35Å; T223-T300 PolarHBondContact O-OG1 2.76Å
224	D	98.1	Very high	95	Very high	55 Å²	55	28.7 Å²	28.7	29%	0.294	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-52.8	174.6	178.6	53.2	0	0	0	110.1	N145 T300 F301	N145-D224 HydrophobicContact CB-CB 4.23Å; N145-D224 PolarHBondContact ND2-OD2 2.74Å; N145-D224 PolarHBondContact O-N 2.94Å; D224-T300 WeakPolarHBondContact O-CA 3.09Å; D224-F301 PolarHBondContact O-N 3.15Å
225	F	98.5	Very high	95.4	Very high	42 Å²	42	27.2 Å²	27.2	18%	0.184	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	158.5	169.1	66.7	-105.3	0	0	0	113.5	Q102 S144 N145 T223 F227 F301	Q102-F225 HydrophobicContact CG-CZ 4.19Å; S144-F225 VanDerWaalsContact CA-O 3.27Å; S144-F225 WeakPolarHBondContact CA-O 3.49Å; S144-F225 PolarHBondContact OG-O 2.83Å; N145-F225 HydrophobicContact CB-CD1 3.58Å; N145-F225 HydrophobicContact CB-CD2 4.22Å; N145-F225 HydrophobicContact CB-CE1 3.24Å; N145-F225 HydrophobicContact CB-CE2 3.91Å; N145-F225 HydrophobicContact CB-CG 4.08Å; N145-F225 HydrophobicContact CB-CZ 3.43Å; N145-F225 VanDerWaalsContact CB-CZ 3.43Å; N145-F225 PolarHBondContact N-O 3.36Å; T223-F225 VanDerWaalsContact CG2-O 3.31Å; T223-F225 WeakPolarHBondContact CG2-O 3.33Å; F225-F227 AromaticContact CD2-CD2 3.67Å; F225-F227 HydrophobicContact CD2-CD2 3.67Å; F225-F227 AromaticContact CD2-CE2 3.28Å; F225-F227 HydrophobicContact CD2-CE2 3.28Å; F225-F227 HydrophobicContact CD2-CZ 4.26Å; F225-F227 AromaticContact CE2-CD2 3.91Å; F225-F227 HydrophobicContact CE2-CD2 3.91Å; F225-F227 AromaticContact CE2-CE2 3.57Å; F225-F227 HydrophobicContact CE2-CE2 3.57Å; F225-F227 HydrophobicContact CG-CE2 4.09Å; F225-F301 CarbonylContact C-O 3.58Å; F225-F301 WeakPolarHBondContact CA-O 3.32Å; F225-F301 HydrophobicContact CB-CB 4.3Å
226	R	97.9	Very high	95.8	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	128.7	-179.5	-169	68.8	178.1	77.3	8.6	111.7	E131 Q142 S143 S144 T223 E228 V234 L236 F301 Y302 Y303	E131-R226 IonicContact OE1-CZ 3.68Å; E131-R226 IonicContact OE1-NH2 3.81Å; E131-R226 PolarHBondContact OE1-NH2 3.04Å; E131-R226 IonicContact OE2-NH2 2.72Å; Q142-R226 VanDerWaalsContact C-NH1 3.26Å; S143-R226 WeakPolarHBondContact O-CD 3.25Å; S143-R226 PolarHBondContact O-NH1 2.94Å; S144-R226 WeakPolarHBondContact OG-CD 3.38Å; T223-R226 HydrophobicContact CG2-CB 3.97Å; R226-E228 IonicContact CZ-OE2 3.74Å; R226-E228 IonicContact NH1-OE2 3.47Å; R226-E228 PolarHBondContact NH1-OE2 2.89Å; R226-E228 VanDerWaalsContact NH1-OE2 3.12Å; R226-E228 IonicContact NH2-OE2 3.14Å; R226-E228 PolarHBondContact NH2-OE2 2.05Å; R226-V234 HydrophobicContact CG-CG2 3.3Å; R226-L236 HydrophobicContact CB-CD2 3.73Å; R226-L236 HydrophobicContact CG-CD2 3.84Å; R226-F301 PolarHBondContact N-O 2.8Å; R226-Y302 HydrophobicContact CB-CD2 4.26Å; R226-Y302 HydrophobicContact CG-CD2 4.35Å; R226-Y302 WeakPolarHBondContact O-CD2 3.3Å; R226-Y303 PolarHBondContact O-N 3.22Å
227	F	95.8	Very high	96.1	Very high	62 Å²	62	17.8 Å²	17.8	27%	0.272	9%	0.091	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.7	174.9	-59.9	-77.7	0	0	0	110.7	S143 F225 F301 Y303 T305	S143-F227 PolarHBondContact N-O 2.75Å; S143-F227 PolarHBondContact O-N 2.74Å; F225-F227 AromaticContact CD2-CD2 3.67Å; F225-F227 HydrophobicContact CD2-CD2 3.67Å; F225-F227 AromaticContact CD2-CE2 3.28Å; F225-F227 HydrophobicContact CD2-CE2 3.28Å; F225-F227 HydrophobicContact CD2-CZ 4.26Å; F225-F227 AromaticContact CE2-CD2 3.91Å; F225-F227 HydrophobicContact CE2-CD2 3.91Å; F225-F227 AromaticContact CE2-CE2 3.57Å; F225-F227 HydrophobicContact CE2-CE2 3.57Å; F225-F227 HydrophobicContact CG-CE2 4.09Å; F227-F301 HydrophobicContact CE1-CE1 4.28Å; F227-Y303 WeakPolarHBondContact CA-O 3.38Å; F227-Y303 HydrophobicContact CD1-CD1 4.27Å; F227-Y303 HydrophobicContact CD1-CG 4.45Å; F227-Y303 HydrophobicContact CE1-CD1 4.42Å; F227-Y303 HydrophobicContact CE1-CG 4.39Å; F227-T305 HydrophobicContact CB-CG2 4.12Å
228	E	94.9	Very high	96.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	149.6	-176	-169.3	51.3	-92.6	0	0	112.4	T140 V141 Q142 R226 A232 Y302 Y303 P304 T305	T140-E228 WeakPolarHBondContact CA-OE1 3.28Å; T140-E228 WeakPolarHBondContact CB-OE1 3.45Å; V141-E228 PolarHBondContact N-OE1 2.82Å; Q142-E228 WeakPolarHBondContact CA-OE2 3.34Å; Q142-E228 WeakPolarHBondContact CG-OE2 3.42Å; Q142-E228 PolarHBondContact N-OE2 2.88Å; R226-E228 IonicContact CZ-OE2 3.74Å; R226-E228 IonicContact NH1-OE2 3.47Å; R226-E228 PolarHBondContact NH1-OE2 2.89Å; R226-E228 VanDerWaalsContact NH1-OE2 3.12Å; R226-E228 IonicContact NH2-OE2 3.14Å; R226-E228 PolarHBondContact NH2-OE2 2.05Å; E228-A232 HydrophobicContact CG-CB 3.83Å; E228-Y302 HydrophobicContact CB-CE2 4.16Å; E228-Y303 PolarHBondContact N-O 3.01Å; E228-P304 CarbonylContact O-C 3.54Å; E228-P304 VanDerWaalsContact O-C 3.3Å; E228-P304 WeakPolarHBondContact O-CA 3.45Å; E228-T305 PolarHBondContact O-N 2.78Å; E228-T305 PolarHBondContact O-OG1 3.2Å
229	V	91.7	Very high	96.3	Very high	5 Å²	5	14.5 Å²	14.5	3%	0.03	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	136.8	178.2	179	0	0	0	0	111	V73 V141 G231 A232 T305 V307	V73-V229 HydrophobicContact CG2-CG2 4.25Å; V141-V229 HydrophobicContact CB-CG2 4.49Å; V141-V229 HydrophobicContact CG2-CG2 3.77Å; V229-G231 PolarHBondContact O-N 3.19Å; V229-A232 VanDerWaalsContact O-CB 3.31Å; V229-A232 WeakPolarHBondContact O-CB 3.18Å; V229-A232 PolarHBondContact O-N 3.14Å; V229-T305 WeakPolarHBondContact CA-O 3.42Å; V229-V307 HydrophobicContact CG1-CB 4.46Å; V229-V307 HydrophobicContact CG1-CG1 3.41Å; V229-V307 VanDerWaalsContact CG1-CG1 3.41Å
230	I	93.4	Very high	96.3	Very high	61 Å²	61	14.1 Å²	14.1	31%	0.313	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	133.3	172.7	-176.2	161.4	0	0	0	111.9	A232 G277 W279 P304 T305	I230-A232 VanDerWaalsContact C-N 3.25Å; I230-A232 PolarHBondContact O-N 2.9Å; I230-G277 WeakPolarHBondContact CG1-O 3.21Å; I230-W279 VanDerWaalsContact CD1-CD1 3.41Å; I230-W279 HydrophobicContact CD1-CD2 4.37Å; I230-W279 HydrophobicContact CD1-CG 4.08Å; I230-W279 VanDerWaalsContact CD1-NE1 3.28Å; I230-P304 HydrophobicContact CB-CB 4.47Å; I230-T305 PolarHBondContact N-O 2.84Å
231	G	92.4	Very high	96.2	Very high	26 Å²	26	14.8 Å²	14.8	27%	0.268	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	-7.7	-178.8	0	0	0	0	0	115	K138 V229 H276 G277	K138-G231 PolarHBondContact NZ-O 3.38Å; V229-G231 PolarHBondContact O-N 3.19Å; G231-H276 PolarHBondContact O-CD2 2.87Å; G231-H276 VanDerWaalsContact O-CD2 3.31Å; G231-G277 PolarHBondContact N-O 2.9Å
232	A	93.3	Very high	96	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.008	8%	0.082	C	C	.	.	S	Bend	trans	-77.3	157.8	162.9	0	0	0	0	0	110.3	T140 E228 V229 I230 G277	T140-A232 HydrophobicContact CG2-CB 4.11Å; E228-A232 HydrophobicContact CG-CB 3.83Å; V229-A232 VanDerWaalsContact O-CB 3.31Å; V229-A232 WeakPolarHBondContact O-CB 3.18Å; V229-A232 PolarHBondContact O-N 3.14Å; I230-A232 VanDerWaalsContact C-N 3.25Å; I230-A232 PolarHBondContact O-N 2.9Å; A232-G277 PolarHBondContact O-N 3.05Å
233	S	95	Very high	95.7	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.007	10%	0.101	C	C	.	.			trans	-89.7	151	173.7	-50.3	0	0	0	0	109.7	E131 M134 N135 I274	E131-S233 WeakPolarHBondContact CG-O 3.3Å; M134-S233 WeakPolarHBondContact CB-OG 3.44Å; N135-S233 PolarHBondContact ND2-O 2.98Å; N135-S233 PolarHBondContact OD1-N 3.44Å; S233-I274 CarbonylContact C-O 3.52Å; S233-I274 WeakPolarHBondContact CA-O 3.28Å
234	V	95.6	Very high	95.6	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	137.9	-177.2	62.1	0	0	0	0	110.7	R226 L236 L273 I274 Y302	R226-V234 HydrophobicContact CG-CG2 3.3Å; V234-L236 HydrophobicContact CG2-CD2 3.96Å; V234-L273 WeakPolarHBondContact O-CA 3.35Å; V234-I274 HydrophobicContact CG1-CB 3.68Å; V234-I274 HydrophobicContact CG1-CD1 4.05Å; V234-I274 HydrophobicContact CG1-CG1 4.11Å; V234-I274 PolarHBondContact N-O 3.2Å; V234-I274 PolarHBondContact O-N 2.89Å; V234-Y302 HydrophobicContact CB-CE2 4.24Å; V234-Y302 HydrophobicContact CG1-CD2 4.18Å; V234-Y302 HydrophobicContact CG1-CE1 4.22Å; V234-Y302 HydrophobicContact CG1-CE2 3.69Å; V234-Y302 HydrophobicContact CG2-CD2 4.4Å; V234-Y302 HydrophobicContact CG2-CE2 4.21Å
235	Q	95.9	Very high	95.4	Very high	3 Å²	3	24.5 Å²	24.5	1%	0.014	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.7	172.9	-175.6	172.1	-20.6	0	0	109.7	E131 F237 L267 D271 L272 L273	E131-Q235 HydrophobicContact CB-CB 4.09Å; E131-Q235 PolarHBondContact OE2-N 2.85Å; Q235-F237 HydrophobicContact CG-CE1 4.47Å; Q235-L267 HydrophobicContact CG-CD1 4.39Å; Q235-D271 HydrophobicContact CG-CB 3.85Å; Q235-D271 PolarHBondContact NE2-OD2 2.81Å; Q235-L272 CarbonylContact C-O 3.37Å; Q235-L272 WeakPolarHBondContact CA-O 3.09Å; Q235-L273 HydrophobicContact CB-CD1 4.44Å
236	L	97.8	Very high	95.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.8	176	-51.5	-177.3	0	0	0	109	T223 R226 V234 W250 D271 L272 I274 Y285 T300	T223-L236 HydrophobicContact CG2-CD2 4.48Å; R226-L236 HydrophobicContact CB-CD2 3.73Å; R226-L236 HydrophobicContact CG-CD2 3.84Å; V234-L236 HydrophobicContact CG2-CD2 3.96Å; L236-W250 HydrophobicContact CB-CH2 3.87Å; L236-W250 HydrophobicContact CB-CZ2 4.33Å; L236-D271 CarbonylContact O-C 3.59Å; L236-D271 VanDerWaalsContact O-CA 3.27Å; L236-D271 WeakPolarHBondContact O-CA 3.46Å; L236-D271 WeakPolarHBondContact O-CB 3.49Å; L236-L272 HydrophobicContact CB-CB 4.36Å; L236-L272 HydrophobicContact CD1-CD2 4.36Å; L236-L272 PolarHBondContact N-O 2.9Å; L236-L272 PolarHBondContact O-N 3.16Å; L236-I274 HydrophobicContact CD1-CD1 4Å; L236-Y285 HydrophobicContact CD1-CD2 4.31Å; L236-Y285 HydrophobicContact CD1-CG 4.18Å; L236-T300 HydrophobicContact CB-CG2 4.39Å; L236-T300 HydrophobicContact CD1-CG2 3.98Å; L236-T300 HydrophobicContact CD2-CG2 4.02Å; L236-T300 HydrophobicContact CG-CG2 4.36Å
237	F	97.6	Very high	95.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.			trans	-76.1	137	-177.6	-59.8	-34.7	0	0	0	112.5	V108 N128 T146 M221 W222 T223 Q235 D271	V108-F237 HydrophobicContact CG1-CE2 4.26Å; V108-F237 HydrophobicContact CG1-CZ 4.06Å; N128-F237 WeakPolarHBondContact ND2-CZ 3.43Å; N128-F237 WeakPolarHBondContact OD1-CE1 3.2Å; N128-F237 WeakPolarHBondContact OD1-CZ 3.41Å; T146-F237 HydrophobicContact CG2-CD2 3.94Å; T146-F237 HydrophobicContact CG2-CE2 4.32Å; M221-F237 HydrophobicContact CE-CD2 4.36Å; W222-F237 WeakPolarHBondContact CA-O 3.44Å; W222-F237 WeakPolarHBondContact CB-O 3.45Å; T223-F237 PolarHBondContact N-O 3.5Å; T223-F237 VanDerWaalsContact N-O 3.11Å; T223-F237 PolarHBondContact OG1-N 2.79Å; Q235-F237 HydrophobicContact CG-CE1 4.47Å; F237-D271 VanDerWaalsContact CA-OD1 3.29Å; F237-D271 WeakPolarHBondContact CA-OD1 3.36Å; F237-D271 VanDerWaalsContact CD1-OD2 3.32Å; F237-D271 WeakPolarHBondContact CD1-OD2 3.47Å
238	C	98	Very high	95.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	95.2	159	-177	0	0	0	0	109.6	W250 G270 D271 C287	C238-W250 HydrophobicContact CB-CH2 3.96Å; C238-W250 HydrophobicContact CB-CZ2 3.28Å; C238-G270 CarbonylContact O-C 3.52Å; C238-D271 PolarHBondContact N-OD1 2.79Å; C238-D271 VanDerWaalsContact N-OD1 3.08Å; C238-C287 HydrophobicContact CB-CB 3.49Å; C238-C287 VanDerWaalsContact CB-CB 3.49Å; C238-C287 WeakPolarHBondContact CB-SG 3.39Å; C238-C287 WeakPolarHBondContact SG-CB 3.41Å; C238-C287 CovalentContact SG-SG 2Å; C238-C287 PolarHBondContact SG-SG 2.96Å
239	R	96.9	Very high	95.5	Very high	1 Å²	1	30.1 Å²	30.1	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.7	-177.2	-53.6	-169.4	-171.6	163.2	1.3	109.4	H123 E124 E126 I219 Y220 M221 D271	H123-R239 WeakPolarHBondContact O-CD 2.89Å; H123-R239 PolarHBondContact O-NH1 2.79Å; E124-R239 PolarHBondContact O-NH1 3.07Å; E126-R239 PolarHBondContact O-NH1 2.96Å; E126-R239 PolarHBondContact O-NH2 3.21Å; I219-R239 CarbonylContact C-O 3.57Å; I219-R239 WeakPolarHBondContact CA-O 3.32Å; Y220-R239 WeakPolarHBondContact CD1-O 3.34Å; Y220-R239 HydrophobicContact CD2-CB 4.49Å; Y220-R239 HydrophobicContact CE1-CB 4.04Å; Y220-R239 HydrophobicContact CE2-CB 3.75Å; Y220-R239 VanDerWaalsContact CZ-CB 3.49Å; Y220-R239 PolarHBondContact N-O 3.49Å; Y220-R239 WeakPolarHBondContact OH-CB 3.33Å; M221-R239 HydrophobicContact CE-CG 4.33Å; M221-R239 VanDerWaalsContact CE-CZ 3.4Å; M221-R239 PolarHBondContact N-O 2.82Å; M221-R239 PolarHBondContact O-N 2.8Å; R239-D271 WeakPolarHBondContact CG-OD1 3.47Å; R239-D271 IonicContact CZ-OD2 3.07Å; R239-D271 IonicContact NE-OD1 2.72Å; R239-D271 PolarHBondContact NE-OD1 2.87Å; R239-D271 IonicContact NE-OD2 2.76Å; R239-D271 PolarHBondContact NE-OD2 2.8Å; R239-D271 IonicContact NH2-OD2 2.66Å; R239-D271 PolarHBondContact NH2-OD2 2Å; R239-D271 VanDerWaalsContact NH2-OD2 3.14Å
240	A	97.1	Very high	95.8	Very high	6 Å²	6	29.9 Å²	29.9	5%	0.05	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	161	-178.8	0	0	0	0	0	111.6	K218 I219 Y220 P246 I248 A289	K218-A240 CarbonylContact O-C 3.53Å; K218-A240 WeakPolarHBondContact O-CA 2.92Å; I219-A240 HydrophobicContact CG1-CB 4Å; Y220-A240 VanDerWaalsContact CE1-C 3.42Å; Y220-A240 WeakPolarHBondContact CE1-O 3.49Å; A240-P246 HydrophobicContact CB-CB 4.44Å; A240-P246 HydrophobicContact CB-CG 4.36Å; A240-I248 HydrophobicContact CB-CD1 3.76Å; A240-A289 HydrophobicContact CB-CB 3.56Å
241	S	95	Very high	96	Very high	20 Å²	20	29.3 Å²	29.3	14%	0.14	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.9	171.2	62.1	0	0	0	0	108.9	Q120 P217 K218	Q120-S241 WeakPolarHBondContact O-CB 2.95Å; Q120-S241 PolarHBondContact O-OG 2.87Å; P217-S241 CarbonylContact C-O 3.58Å; P217-S241 VanDerWaalsContact CA-O 3.28Å; P217-S241 WeakPolarHBondContact CA-O 3.35Å; K218-S241 PolarHBondContact N-O 2.83Å; K218-S241 PolarHBondContact O-N 2.94Å; K218-S241 PolarHBondContact O-OG 3.3Å
242	G	93.6	Very high	96.1	Very high	3 Å²	3	31.7 Å²	31.7	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	177.6	178.3	0	0	0	0	0	110.3	P244	G242-P244 CarbonylContact C-O 3.43Å
243	Y	93.3	Very high	96.1	Very high	131 Å²	131	40 Å²	40	51%	0.514	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	122.9	166.2	-173.2	-97.2	0	0	0	110.2	G213 R215	G213-Y243 WeakPolarHBondContact O-CB 3.41Å; G213-Y243 WeakPolarHBondContact O-CD1 3.07Å; R215-Y243 PolarHBondContact N-O 3.49Å; R215-Y243 PolarHBondContact O-N 3.44Å
244	P	94.8	Very high	95.9	Very high	46 Å²	46	44.5 Å²	44.5	30%	0.299	21%	0.205	S	C	.	.	S	Bend	cis	-50.6	157.9	-7.9	-28.3	33.3	0	0	0	114.3	G242 N291 Y293	G242-P244 CarbonylContact C-O 3.43Å; P244-N291 PolarHBondContact O-ND2 3.47Å; P244-Y293 HydrophobicContact CG-CE2 4.5Å
245	E	94.5	Very high	95.8	Very high	107 Å²	107	47 Å²	47	50%	0.5	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-53.7	126.8	-178.6	-171.4	59.9	-155.8	0	0	110.1	I247	E245-I247 PolarHBondContact O-N 2.89Å
246	P	96.8	Very high	95.6	Very high	11 Å²	11	53.7 Å²	53.7	7%	0.071	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-65.5	136.2	-177.3	-22.3	34	0	0	0	112.6	P217 A240 I248 A289 S290	P217-P246 HydrophobicContact CB-CB 3.9Å; P217-P246 HydrophobicContact CB-CG 3.74Å; P217-P246 HydrophobicContact CG-CB 4.11Å; P217-P246 HydrophobicContact CG-CG 4.07Å; A240-P246 HydrophobicContact CB-CB 4.44Å; A240-P246 HydrophobicContact CB-CG 4.36Å; P246-I248 HydrophobicContact CB-CD1 4.38Å; P246-A289 HydrophobicContact CB-CB 4.06Å; P246-S290 WeakPolarHBondContact CA-O 3.35Å
247	I	97.1	Very high	95.5	Very high	111 Å²	111	57.6 Å²	57.6	57%	0.569	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.2	124.7	167.3	-60.3	169.3	0	0	0	107.8	E245 K249 A289 S290	E245-I247 PolarHBondContact O-N 2.89Å; I247-K249 HydrophobicContact CG2-CG 4.39Å; I247-A289 WeakPolarHBondContact O-CA 3.37Å; I247-S290 PolarHBondContact N-O 3.43Å; I247-S290 PolarHBondContact O-N 2.91Å; I247-S290 PolarHBondContact O-OG 2.69Å
248	I	97.5	Very high	95.3	Very high	30 Å²	30	58.3 Å²	58.3	15%	0.154	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.9	177.8	-52.9	-57.4	0	0	0	110.3	A240 P246 G270 C287 K288 A289	A240-I248 HydrophobicContact CB-CD1 3.76Å; P246-I248 HydrophobicContact CB-CD1 4.38Å; I248-G270 WeakPolarHBondContact CG2-O 3.42Å; I248-C287 WeakPolarHBondContact CG2-SG 3.42Å; I248-K288 WeakPolarHBondContact CA-O 3.22Å; I248-A289 HydrophobicContact CD1-CB 3.34Å
249	K	97.8	Very high	94.7	Very high	70 Å²	70	62.3 Å²	62.3	30%	0.304	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.1	173.7	-68.4	-175.8	168.4	-138.2	0	110.6	I247 Y251 E257 K288	I247-K249 HydrophobicContact CG2-CG 4.39Å; K249-Y251 HydrophobicContact CB-CE2 3.66Å; K249-Y251 WeakPolarHBondContact CD-OH 3.4Å; K249-E257 WeakPolarHBondContact CD-OE1 3.43Å; K249-E257 WeakPolarHBondContact CE-OE1 3.4Å; K249-E257 VanDerWaalsContact NZ-CD 3.28Å; K249-E257 IonicContact NZ-OE1 2.68Å; K249-E257 PolarHBondContact NZ-OE1 2.87Å; K249-E257 IonicContact NZ-OE2 2.75Å; K249-E257 PolarHBondContact NZ-OE2 2.88Å; K249-K288 PolarHBondContact N-O 3.29Å; K249-K288 PolarHBondContact O-N 2.87Å
250	W	98.4	Very high	93.9	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	146.4	177.5	-76.2	85.8	0	0	0	111.3	L236 C238 I258 G270 L272 F286 C287	L236-W250 HydrophobicContact CB-CH2 3.87Å; L236-W250 HydrophobicContact CB-CZ2 4.33Å; C238-W250 HydrophobicContact CB-CH2 3.96Å; C238-W250 HydrophobicContact CB-CZ2 3.28Å; W250-I258 HydrophobicContact CB-CB 4.17Å; W250-I258 HydrophobicContact CB-CD1 4.14Å; W250-I258 PolarHBondContact O-N 2.75Å; W250-G270 PolarHBondContact NE1-O 2.94Å; W250-L272 HydrophobicContact CB-CD2 4.2Å; W250-L272 HydrophobicContact CD2-CB 3.71Å; W250-L272 HydrophobicContact CD2-CD2 3.94Å; W250-L272 HydrophobicContact CD2-CG 4.38Å; W250-L272 VanDerWaalsContact CE2-CB 3.48Å; W250-L272 HydrophobicContact CE3-CB 4.31Å; W250-L272 HydrophobicContact CE3-CD2 3.98Å; W250-L272 HydrophobicContact CG-CB 3.96Å; W250-L272 HydrophobicContact CG-CD1 4.43Å; W250-L272 HydrophobicContact CG-CD2 4.07Å; W250-L272 HydrophobicContact CG-CG 4.39Å; W250-L272 HydrophobicContact CH2-CB 4.41Å; W250-L272 HydrophobicContact CZ2-CB 3.83Å; W250-F286 CarbonylContact C-O 3.56Å; W250-F286 WeakPolarHBondContact CA-O 3.4Å; W250-C287 HydrophobicContact CD2-CB 3.96Å; W250-C287 HydrophobicContact CE3-CB 3.98Å; W250-C287 HydrophobicContact CH2-CB 3.94Å; W250-C287 HydrophobicContact CZ2-CB 3.91Å; W250-C287 HydrophobicContact CZ3-CB 3.96Å
251	Y	97.5	Very high	93.1	Very high	48 Å²	48	70.2 Å²	70.2	19%	0.188	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146.7	-178.3	-59.3	-94	0	0	0	110.7	K249 G255 K256 E257 Y285 F286 K288	K249-Y251 HydrophobicContact CB-CE2 3.66Å; K249-Y251 WeakPolarHBondContact CD-OH 3.4Å; Y251-G255 WeakPolarHBondContact CD1-O 3.46Å; Y251-K256 VanDerWaalsContact CA-O 3.32Å; Y251-K256 WeakPolarHBondContact CA-O 3.5Å; Y251-E257 HydrophobicContact CD1-CB 3.99Å; Y251-E257 HydrophobicContact CE1-CB 3.65Å; Y251-E257 HydrophobicContact CE1-CG 4Å; Y251-Y285 CarbonylContact O-C 3.46Å; Y251-Y285 WeakPolarHBondContact O-CA 3.41Å; Y251-F286 PolarHBondContact N-O 2.88Å; Y251-F286 PolarHBondContact O-N 3.45Å; Y251-K288 HydrophobicContact CD2-CB 4.29Å; Y251-K288 HydrophobicContact CE2-CB 3.84Å; Y251-K288 HydrophobicContact CE2-CD 4.06Å
252	R	95	Very high	92.5	Very high	77 Å²	77	76.4 Å²	76.4	29%	0.291	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	170.1	165.4	-73.5	-170.5	168.4	-168.1	-4.9	110.4	D254 G255 K256 I258 D281 Y285	R252-D254 WeakPolarHBondContact CB-OD1 3.46Å; R252-D254 PolarHBondContact O-N 2.94Å; R252-D254 VanDerWaalsContact O-N 3.17Å; R252-G255 PolarHBondContact O-N 2.68Å; R252-K256 PolarHBondContact N-O 2.85Å; R252-K256 VanDerWaalsContact N-O 3.07Å; R252-I258 HydrophobicContact CG-CD1 3.93Å; R252-I258 HydrophobicContact CG-CG1 4.05Å; R252-D281 IonicContact CZ-OD1 3.43Å; R252-D281 IonicContact NH2-OD1 3.93Å; R252-D281 PolarHBondContact NH2-OD1 3.26Å; R252-Y285 HydrophobicContact CG-CE1 4.33Å; R252-Y285 PolarHBondContact NH2-OH 2.79Å
253	R	93	Very high	92.3	Very high	174 Å²	174	76.9 Å²	76.9	66%	0.657	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.5	176.8	-172	-171.3	-67.2	-163	-0.7	114.1	G255 L284 F286	R253-G255 PolarHBondContact O-N 3.13Å; R253-L284 PolarHBondContact N-O 3.04Å; R253-F286 HydrophobicContact CB-CE2 4.33Å
254	D	91.3	Very high	92.4	Very high	97 Å²	97	71.4 Å²	71.4	52%	0.519	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	0.6	176.4	68.1	-11.9	0	0	0	113.3	R252 K256	R252-D254 WeakPolarHBondContact CB-OD1 3.46Å; R252-D254 PolarHBondContact O-N 2.94Å; R252-D254 VanDerWaalsContact O-N 3.17Å; D254-K256 VanDerWaalsContact C-N 3.26Å; D254-K256 PolarHBondContact O-N 3Å; D254-K256 WeakPolarHBondContact OD1-CB 3.18Å; D254-K256 PolarHBondContact OD1-N 2.93Å; D254-K256 VanDerWaalsContact OD1-N 3.1Å; D254-K256 WeakPolarHBondContact OD2-CD 3.33Å; D254-K256 VanDerWaalsContact OD2-CE 3.3Å; D254-K256 WeakPolarHBondContact OD2-CE 3.4Å; D254-K256 WeakPolarHBondContact OD2-CG 3.46Å; D254-K256 IonicContact OD2-NZ 3.95Å
255	G	92	Very high	92.4	Very high	53 Å²	53	71.5 Å²	71.5	55%	0.546	36%	0.363	S	S	.	.			trans	79.3	3.6	-179.9	0	0	0	0	0	113.8	Y251 R252 R253	Y251-G255 WeakPolarHBondContact CD1-O 3.46Å; R252-G255 PolarHBondContact O-N 2.68Å; R253-G255 PolarHBondContact O-N 3.13Å
256	K	92.4	Very high	92.4	Very high	143 Å²	143	67.9 Å²	67.9	62%	0.622	35%	0.349	S	S	*	.			trans	-74.8	132.1	175.7	-67.4	-176.6	-169.2	162.6	0	110.6	Y251 R252 D254 I258	Y251-K256 VanDerWaalsContact CA-O 3.32Å; Y251-K256 WeakPolarHBondContact CA-O 3.5Å; R252-K256 PolarHBondContact N-O 2.85Å; R252-K256 VanDerWaalsContact N-O 3.07Å; D254-K256 VanDerWaalsContact C-N 3.26Å; D254-K256 PolarHBondContact O-N 3Å; D254-K256 WeakPolarHBondContact OD1-CB 3.18Å; D254-K256 PolarHBondContact OD1-N 2.93Å; D254-K256 VanDerWaalsContact OD1-N 3.1Å; D254-K256 WeakPolarHBondContact OD2-CD 3.33Å; D254-K256 VanDerWaalsContact OD2-CE 3.3Å; D254-K256 WeakPolarHBondContact OD2-CE 3.4Å; D254-K256 WeakPolarHBondContact OD2-CG 3.46Å; D254-K256 IonicContact OD2-NZ 3.95Å; K256-I258 PolarHBondContact O-N 3.27Å
257	E	95.1	Very high	92.2	Very high	82 Å²	82	69.4 Å²	69.4	38%	0.383	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-64.9	131.2	173.5	-170.7	169.4	157.5	0	0	109.7	K249 Y251 V259	K249-E257 WeakPolarHBondContact CD-OE1 3.43Å; K249-E257 WeakPolarHBondContact CE-OE1 3.4Å; K249-E257 VanDerWaalsContact NZ-CD 3.28Å; K249-E257 IonicContact NZ-OE1 2.68Å; K249-E257 PolarHBondContact NZ-OE1 2.87Å; K249-E257 IonicContact NZ-OE2 2.75Å; K249-E257 PolarHBondContact NZ-OE2 2.88Å; Y251-E257 HydrophobicContact CD1-CB 3.99Å; Y251-E257 HydrophobicContact CE1-CB 3.65Å; Y251-E257 HydrophobicContact CE1-CG 4Å; E257-V259 PolarHBondContact O-N 2.95Å
258	I	93.3	Very high	91.9	Very high	15 Å²	15	72.1 Å²	72.1	8%	0.077	37%	0.371	C	S	.	.			trans	-81.3	105	171.3	-61.6	175.5	0	0	0	106.7	W250 R252 K256 F264 L272 Y285	W250-I258 HydrophobicContact CB-CB 4.17Å; W250-I258 HydrophobicContact CB-CD1 4.14Å; W250-I258 PolarHBondContact O-N 2.75Å; R252-I258 HydrophobicContact CG-CD1 3.93Å; R252-I258 HydrophobicContact CG-CG1 4.05Å; K256-I258 PolarHBondContact O-N 3.27Å; I258-F264 HydrophobicContact CD1-CD1 4.43Å; I258-F264 HydrophobicContact CG2-CB 3.41Å; I258-F264 VanDerWaalsContact CG2-CB 3.41Å; I258-F264 HydrophobicContact CG2-CD1 3.69Å; I258-F264 HydrophobicContact CG2-CD2 4.5Å; I258-F264 HydrophobicContact CG2-CG 3.59Å; I258-L272 HydrophobicContact CD1-CD2 3.88Å; I258-L272 HydrophobicContact CG2-CD1 4.09Å; I258-Y285 HydrophobicContact CD1-CD1 3.4Å; I258-Y285 VanDerWaalsContact CD1-CD1 3.4Å; I258-Y285 HydrophobicContact CD1-CE1 3.49Å; I258-Y285 VanDerWaalsContact CD1-CE1 3.49Å
259	V	85.5	Confident	91.7	Very high	84 Å²	84	71.2 Å²	71.2	51%	0.509	37%	0.367	S	S	.	.			trans	-87.3	158.4	172.1	-66.8	0	0	0	0	110	E257 V261	E257-V259 PolarHBondContact O-N 2.95Å; V259-V261 HydrophobicContact CB-CG2 4.4Å; V259-V261 HydrophobicContact CG2-CB 4.19Å; V259-V261 HydrophobicContact CG2-CG2 3.8Å; V259-V261 PolarHBondContact O-N 3.49Å
260	N	81.3	Confident	91.6	Very high	95 Å²	95	68 Å²	68	51%	0.508	35%	0.354	S	S	.	.	S	Bend	trans	-69.5	65.2	-179.4	-72.6	-16.2	0	0	0	112.6	F264 N265 V266	N260-F264 CarbonylContact C-O 3.3Å; N260-F264 VanDerWaalsContact CA-O 3.31Å; N260-F264 WeakPolarHBondContact CA-O 3.45Å; N260-N265 WeakPolarHBondContact OD1-CA 3.16Å; N260-V266 PolarHBondContact OD1-N 3.12Å
261	V	80.5	Confident	91.5	Very high	77 Å²	77	68 Å²	68	47%	0.467	35%	0.354	S	S	.	.			trans	-144.3	158.5	-175.3	-168.2	0	0	0	0	108.5	V259 G263 F264	V259-V261 HydrophobicContact CB-CG2 4.4Å; V259-V261 HydrophobicContact CG2-CB 4.19Å; V259-V261 HydrophobicContact CG2-CG2 3.8Å; V259-V261 PolarHBondContact O-N 3.49Å; V261-G263 VanDerWaalsContact C-N 3.3Å; V261-G263 PolarHBondContact O-N 2.95Å; V261-G263 VanDerWaalsContact O-N 3.16Å; V261-F264 PolarHBondContact N-O 3.44Å; V261-F264 PolarHBondContact O-N 3.1Å; V261-F264 VanDerWaalsContact O-N 3.14Å
262	D	81.9	Confident	91.5	Very high	150 Å²	150	65.7 Å²	65.7	80%	0.802	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	31.7	171.8	-56.9	-35.5	0	0	0	116.3
263	G	89.9	Confident	91.5	Very high	13 Å²	13	62.1 Å²	62.1	13%	0.134	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	95	-6.4	177.5	0	0	0	0	0	114.3	V261 R275	V261-G263 VanDerWaalsContact C-N 3.3Å; V261-G263 PolarHBondContact O-N 2.95Å; V261-G263 VanDerWaalsContact O-N 3.16Å; G263-R275 WeakPolarHBondContact O-CB 3.34Å; G263-R275 PolarHBondContact O-N 3.3Å; G263-R275 PolarHBondContact O-NH1 3.4Å
264	F	95.1	Very high	91.7	Very high	16 Å²	16	53.9 Å²	53.9	7%	0.07	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132.4	172.4	-64	-90.9	0	0	0	110.5	I258 N260 V261 L272 L273 I274 D281 Y285	I258-F264 HydrophobicContact CD1-CD1 4.43Å; I258-F264 HydrophobicContact CG2-CB 3.41Å; I258-F264 VanDerWaalsContact CG2-CB 3.41Å; I258-F264 HydrophobicContact CG2-CD1 3.69Å; I258-F264 HydrophobicContact CG2-CD2 4.5Å; I258-F264 HydrophobicContact CG2-CG 3.59Å; N260-F264 CarbonylContact C-O 3.3Å; N260-F264 VanDerWaalsContact CA-O 3.31Å; N260-F264 WeakPolarHBondContact CA-O 3.45Å; V261-F264 PolarHBondContact N-O 3.44Å; V261-F264 PolarHBondContact O-N 3.1Å; V261-F264 VanDerWaalsContact O-N 3.14Å; F264-L272 HydrophobicContact CB-CD1 4.33Å; F264-L272 HydrophobicContact CD1-CD1 4.19Å; F264-L272 HydrophobicContact CD1-CD2 4.25Å; F264-L272 HydrophobicContact CD1-CG 4.49Å; F264-L273 CarbonylContact C-O 3.58Å; F264-L273 WeakPolarHBondContact CA-O 3.48Å; F264-I274 HydrophobicContact CD1-CB 4.44Å; F264-I274 HydrophobicContact CD1-CD1 4.42Å; F264-I274 HydrophobicContact CD1-CG1 3.82Å; F264-I274 HydrophobicContact CD1-CG2 4.29Å; F264-I274 HydrophobicContact CE1-CB 4.17Å; F264-I274 HydrophobicContact CE1-CD1 3.78Å; F264-I274 HydrophobicContact CE1-CG1 3.6Å; F264-I274 HydrophobicContact CE1-CG2 3.7Å; F264-I274 HydrophobicContact CZ-CG2 3.85Å; F264-D281 HydrophobicContact CZ-CB 4.39Å; F264-D281 WeakPolarHBondContact CZ-OD1 3.49Å; F264-Y285 AromaticContact CE1-CE1 3.86Å; F264-Y285 HydrophobicContact CE1-CE1 3.86Å
265	N	94.3	Very high	91.9	Very high	48 Å²	48	52.9 Å²	52.9	26%	0.257	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	122.7	169.4	-76.2	8.3	0	0	0	109.7	N260 L273 R275	N260-N265 WeakPolarHBondContact OD1-CA 3.16Å; N265-L273 HydrophobicContact CB-CB 4.31Å; N265-L273 PolarHBondContact N-O 3.5Å; N265-L273 PolarHBondContact O-N 2.92Å; N265-R275 PolarHBondContact ND2-NH1 2.87Å; N265-R275 PolarHBondContact OD1-NH1 3.3Å; N265-R275 PolarHBondContact OD1-NH2 3.02Å
266	V	94.5	Very high	91.9	Very high	32 Å²	32	55.5 Å²	55.5	19%	0.194	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	121.3	162.3	-173.8	0	0	0	0	107.8	N260 L272	N260-V266 PolarHBondContact OD1-N 3.12Å; V266-L272 HydrophobicContact CG2-CD1 4.14Å
267	L	93.1	Very high	92	Very high	43 Å²	43	48.7 Å²	48.7	23%	0.225	26%	0.257	C	S	.	.			trans	-81.6	162.6	178.8	-57.1	-177.9	0	0	0	110.7	A130 Q235 N269 G270 D271 L273	A130-L267 HydrophobicContact CB-CD1 4.32Å; Q235-L267 HydrophobicContact CG-CD1 4.39Å; L267-N269 WeakPolarHBondContact CB-OD1 3.22Å; L267-N269 PolarHBondContact O-N 3.25Å; L267-N269 VanDerWaalsContact O-N 3.13Å; L267-G270 PolarHBondContact O-N 2.87Å; L267-D271 HydrophobicContact CD1-CB 4.28Å; L267-D271 PolarHBondContact N-O 3.17Å; L267-L273 HydrophobicContact CD1-CB 4.44Å; L267-L273 HydrophobicContact CD2-CB 4.26Å; L267-L273 HydrophobicContact CD2-CD2 4.3Å; L267-L273 HydrophobicContact CG-CB 4.31Å
268	D	91.1	Very high	91.9	Very high	167 Å²	167	47.3 Å²	47.3	89%	0.893	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.5	-178.7	-63.4	-20	0	0	0	112.8	G270	D268-G270 PolarHBondContact O-N 2.91Å
269	N	92.8	Very high	92	Very high	12 Å²	12	52.5 Å²	52.5	6%	0.064	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1.9	177.6	69.9	2.1	0	0	0	114.6	H123 E126 L267 D271	H123-N269 HydrophobicContact CB-CB 3.8Å; E126-N269 VanDerWaalsContact OE2-CB 3.25Å; E126-N269 WeakPolarHBondContact OE2-CB 3.34Å; E126-N269 PolarHBondContact OE2-ND2 2.96Å; L267-N269 WeakPolarHBondContact CB-OD1 3.22Å; L267-N269 PolarHBondContact O-N 3.25Å; L267-N269 VanDerWaalsContact O-N 3.13Å; N269-D271 PolarHBondContact ND2-OD2 2.86Å; N269-D271 VanDerWaalsContact ND2-OD2 3.08Å; N269-D271 WeakPolarHBondContact OD1-CB 3.41Å; N269-D271 PolarHBondContact OD1-N 2.86Å; N269-D271 PolarHBondContact OD1-OD2 2.82Å
270	G	95.4	Very high	92.4	Very high	2 Å²	2	56.6 Å²	56.6	2%	0.021	29%	0.287	C	S	.	.	S	Bend	trans	90.7	-10.4	-178.6	0	0	0	0	0	115.4	C238 I248 W250 L267 D268	C238-G270 CarbonylContact O-C 3.52Å; I248-G270 WeakPolarHBondContact CG2-O 3.42Å; W250-G270 PolarHBondContact NE1-O 2.94Å; L267-G270 PolarHBondContact O-N 2.87Å; D268-G270 PolarHBondContact O-N 2.91Å
271	D	96.3	Very high	93	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-69.9	143.2	-178.5	-61.6	-19.3	0	0	0	111.2	Q235 L236 F237 C238 R239 L267 N269	Q235-D271 HydrophobicContact CG-CB 3.85Å; Q235-D271 PolarHBondContact NE2-OD2 2.81Å; L236-D271 CarbonylContact O-C 3.59Å; L236-D271 VanDerWaalsContact O-CA 3.27Å; L236-D271 WeakPolarHBondContact O-CA 3.46Å; L236-D271 WeakPolarHBondContact O-CB 3.49Å; F237-D271 VanDerWaalsContact CA-OD1 3.29Å; F237-D271 WeakPolarHBondContact CA-OD1 3.36Å; F237-D271 VanDerWaalsContact CD1-OD2 3.32Å; F237-D271 WeakPolarHBondContact CD1-OD2 3.47Å; C238-D271 PolarHBondContact N-OD1 2.79Å; C238-D271 VanDerWaalsContact N-OD1 3.08Å; R239-D271 WeakPolarHBondContact CG-OD1 3.47Å; R239-D271 IonicContact CZ-OD2 3.07Å; R239-D271 IonicContact NE-OD1 2.72Å; R239-D271 PolarHBondContact NE-OD1 2.87Å; R239-D271 IonicContact NE-OD2 2.76Å; R239-D271 PolarHBondContact NE-OD2 2.8Å; R239-D271 IonicContact NH2-OD2 2.66Å; R239-D271 PolarHBondContact NH2-OD2 2Å; R239-D271 VanDerWaalsContact NH2-OD2 3.14Å; L267-D271 HydrophobicContact CD1-CB 4.28Å; L267-D271 PolarHBondContact N-O 3.17Å; N269-D271 PolarHBondContact ND2-OD2 2.86Å; N269-D271 VanDerWaalsContact ND2-OD2 3.08Å; N269-D271 WeakPolarHBondContact OD1-CB 3.41Å; N269-D271 PolarHBondContact OD1-N 2.86Å; N269-D271 PolarHBondContact OD1-OD2 2.82Å
272	L	97.2	Very high	93.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.5	175.1	179.4	64.6	0	0	0	110.7	Q235 L236 W250 I258 F264 V266 I274 Y285	Q235-L272 CarbonylContact C-O 3.37Å; Q235-L272 WeakPolarHBondContact CA-O 3.09Å; L236-L272 HydrophobicContact CB-CB 4.36Å; L236-L272 HydrophobicContact CD1-CD2 4.36Å; L236-L272 PolarHBondContact N-O 2.9Å; L236-L272 PolarHBondContact O-N 3.16Å; W250-L272 HydrophobicContact CB-CD2 4.2Å; W250-L272 HydrophobicContact CD2-CB 3.71Å; W250-L272 HydrophobicContact CD2-CD2 3.94Å; W250-L272 HydrophobicContact CD2-CG 4.38Å; W250-L272 VanDerWaalsContact CE2-CB 3.48Å; W250-L272 HydrophobicContact CE3-CB 4.31Å; W250-L272 HydrophobicContact CE3-CD2 3.98Å; W250-L272 HydrophobicContact CG-CB 3.96Å; W250-L272 HydrophobicContact CG-CD1 4.43Å; W250-L272 HydrophobicContact CG-CD2 4.07Å; W250-L272 HydrophobicContact CG-CG 4.39Å; W250-L272 HydrophobicContact CH2-CB 4.41Å; W250-L272 HydrophobicContact CZ2-CB 3.83Å; I258-L272 HydrophobicContact CD1-CD2 3.88Å; I258-L272 HydrophobicContact CG2-CD1 4.09Å; F264-L272 HydrophobicContact CB-CD1 4.33Å; F264-L272 HydrophobicContact CD1-CD1 4.19Å; F264-L272 HydrophobicContact CD1-CD2 4.25Å; F264-L272 HydrophobicContact CD1-CG 4.49Å; V266-L272 HydrophobicContact CG2-CD1 4.14Å; L272-I274 HydrophobicContact CD2-CD1 4.41Å; L272-I274 HydrophobicContact CD2-CG1 4.26Å; L272-I274 HydrophobicContact CG-CG1 4.15Å; L272-Y285 HydrophobicContact CD2-CD1 3.7Å; L272-Y285 HydrophobicContact CD2-CE1 4.04Å
273	L	96.2	Very high	94.4	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.7	171.7	179.8	67.8	0	0	0	110.4	A130 M134 V234 Q235 F264 N265 L267	A130-L273 HydrophobicContact CB-CD2 4.23Å; M134-L273 HydrophobicContact CE-CD2 3.48Å; M134-L273 VanDerWaalsContact CE-CD2 3.48Å; M134-L273 HydrophobicContact SD-CD1 4.31Å; M134-L273 HydrophobicContact SD-CD2 3.76Å; M134-L273 HydrophobicContact SD-CG 4.34Å; V234-L273 WeakPolarHBondContact O-CA 3.35Å; Q235-L273 HydrophobicContact CB-CD1 4.44Å; F264-L273 CarbonylContact C-O 3.58Å; F264-L273 WeakPolarHBondContact CA-O 3.48Å; N265-L273 HydrophobicContact CB-CB 4.31Å; N265-L273 PolarHBondContact N-O 3.5Å; N265-L273 PolarHBondContact O-N 2.92Å; L267-L273 HydrophobicContact CD1-CB 4.44Å; L267-L273 HydrophobicContact CD2-CB 4.26Å; L267-L273 HydrophobicContact CD2-CD2 4.3Å; L267-L273 HydrophobicContact CG-CB 4.31Å
274	I	96.4	Very high	94.8	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	115.3	173.5	-47.8	175.9	0	0	0	107.7	S233 V234 L236 F264 L272 Y285 Y302	S233-I274 CarbonylContact C-O 3.52Å; S233-I274 WeakPolarHBondContact CA-O 3.28Å; V234-I274 HydrophobicContact CG1-CB 3.68Å; V234-I274 HydrophobicContact CG1-CD1 4.05Å; V234-I274 HydrophobicContact CG1-CG1 4.11Å; V234-I274 PolarHBondContact N-O 3.2Å; V234-I274 PolarHBondContact O-N 2.89Å; L236-I274 HydrophobicContact CD1-CD1 4Å; F264-I274 HydrophobicContact CD1-CB 4.44Å; F264-I274 HydrophobicContact CD1-CD1 4.42Å; F264-I274 HydrophobicContact CD1-CG1 3.82Å; F264-I274 HydrophobicContact CD1-CG2 4.29Å; F264-I274 HydrophobicContact CE1-CB 4.17Å; F264-I274 HydrophobicContact CE1-CD1 3.78Å; F264-I274 HydrophobicContact CE1-CG1 3.6Å; F264-I274 HydrophobicContact CE1-CG2 3.7Å; F264-I274 HydrophobicContact CZ-CG2 3.85Å; L272-I274 HydrophobicContact CD2-CD1 4.41Å; L272-I274 HydrophobicContact CD2-CG1 4.26Å; L272-I274 HydrophobicContact CG-CG1 4.15Å; I274-Y285 HydrophobicContact CD1-CE1 4.08Å; I274-Y285 HydrophobicContact CD1-CE2 4.43Å; I274-Y302 HydrophobicContact CD1-CD1 3.87Å; I274-Y302 HydrophobicContact CD1-CE1 4.15Å; I274-Y302 HydrophobicContact CD1-CG 4.47Å
275	R	94.9	Very high	94.9	Very high	76 Å²	76	45.2 Å²	45.2	29%	0.287	23%	0.229	S	C	.	.	S	Bend	trans	-87.4	132.3	178	-64.8	-169.3	-65.6	-74.5	8.2	110.4	M134 G263 N265 G277	M134-R275 HydrophobicContact CE-CG 4.36Å; M134-R275 HydrophobicContact SD-CG 3.66Å; G263-R275 WeakPolarHBondContact O-CB 3.34Å; G263-R275 PolarHBondContact O-N 3.3Å; G263-R275 PolarHBondContact O-NH1 3.4Å; N265-R275 PolarHBondContact ND2-NH1 2.87Å; N265-R275 PolarHBondContact OD1-NH1 3.3Å; N265-R275 PolarHBondContact OD1-NH2 3.02Å; R275-G277 PolarHBondContact O-N 3.08Å
276	H	92.4	Very high	95.1	Very high	108 Å²	108	46.1 Å²	46.1	50%	0.5	23%	0.231	S	C	.	.	S	Bend	trans	54.1	50.3	176.6	-55.1	97	0	0	0	113.4	K138 G231 T278	K138-H276 PolarHBondContact NZ-CD2 2.86Å; K138-H276 VanDerWaalsContact NZ-CD2 3.28Å; K138-H276 PolarHBondContact NZ-NE2 3.46Å; G231-H276 PolarHBondContact O-CD2 2.87Å; G231-H276 VanDerWaalsContact O-CD2 3.31Å; H276-T278 WeakPolarHBondContact O-CG2 3.37Å; H276-T278 PolarHBondContact O-N 3.16Å
277	G	94.3	Very high	95.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.			trans	-55.4	136.6	-174	0	0	0	0	0	112.9	I230 G231 A232 R275	I230-G277 WeakPolarHBondContact CG1-O 3.21Å; G231-G277 PolarHBondContact N-O 2.9Å; A232-G277 PolarHBondContact O-N 3.05Å; R275-G277 PolarHBondContact O-N 3.08Å
278	T	94.2	Very high	95.6	Very high	52 Å²	52	45.7 Å²	45.7	32%	0.319	23%	0.225	S	C	.	.			trans	-119.6	169	-176.1	72.7	0	0	0	0	111.4	H276 E280 D281 P304	H276-T278 WeakPolarHBondContact O-CG2 3.37Å; H276-T278 PolarHBondContact O-N 3.16Å; T278-E280 PolarHBondContact O-N 2.99Å; T278-E280 VanDerWaalsContact O-N 3.14Å; T278-E280 PolarHBondContact OG1-N 2.84Å; T278-D281 PolarHBondContact N-OD2 3.07Å; T278-D281 WeakPolarHBondContact O-CB 3.49Å; T278-D281 PolarHBondContact O-N 2.97Å; T278-D281 PolarHBondContact OG1-OD2 2.03Å; T278-P304 WeakPolarHBondContact O-CG 3.46Å
279	W	95.1	Very high	95.9	Very high	124 Å²	124	37.7 Å²	37.7	47%	0.47	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-56.6	-28	175.8	-60.7	115.9	0	0	0	113.8	I230 D281 A282 Y303 P304 A306	I230-W279 VanDerWaalsContact CD1-CD1 3.41Å; I230-W279 HydrophobicContact CD1-CD2 4.37Å; I230-W279 HydrophobicContact CD1-CG 4.08Å; I230-W279 VanDerWaalsContact CD1-NE1 3.28Å; W279-D281 PolarHBondContact O-N 2.96Å; W279-A282 VanDerWaalsContact O-CB 3.31Å; W279-A282 WeakPolarHBondContact O-CB 3.28Å; W279-A282 PolarHBondContact O-N 3.35Å; W279-Y303 AromaticContact CZ3-CE1 3.88Å; W279-Y303 HydrophobicContact CZ3-CE1 3.88Å; W279-Y303 AromaticContact CZ3-CZ 3.99Å; W279-P304 HydrophobicContact CE3-CB 4.21Å; W279-P304 WeakPolarHBondContact CH2-O 3.36Å; W279-P304 HydrophobicContact CZ3-CB 4.36Å; W279-P304 WeakPolarHBondContact CZ3-O 3.4Å; W279-A306 HydrophobicContact CH2-CB 4.45Å; W279-A306 HydrophobicContact CZ2-CB 4.25Å
280	E	93.2	Very high	96.2	Very high	171 Å²	171	38.7 Å²	38.7	80%	0.799	19%	0.19	S	C	*	.	G	3₁₀ helix	trans	-73.4	-18.7	177.7	-61.7	178.8	-172.3	0	0	112.5	T278 A282	T278-E280 PolarHBondContact O-N 2.99Å; T278-E280 VanDerWaalsContact O-N 3.14Å; T278-E280 PolarHBondContact OG1-N 2.84Å; E280-A282 VanDerWaalsContact C-N 3.34Å
281	D	94.2	Very high	96.2	Very high	21 Å²	21	39.8 Å²	39.8	11%	0.112	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-88.9	-3	177	-54	-52.3	0	0	0	112.6	R252 F264 T278 W279 Y285 Y302	R252-D281 IonicContact CZ-OD1 3.43Å; R252-D281 IonicContact NH2-OD1 3.93Å; R252-D281 PolarHBondContact NH2-OD1 3.26Å; F264-D281 HydrophobicContact CZ-CB 4.39Å; F264-D281 WeakPolarHBondContact CZ-OD1 3.49Å; T278-D281 PolarHBondContact N-OD2 3.07Å; T278-D281 WeakPolarHBondContact O-CB 3.49Å; T278-D281 PolarHBondContact O-N 2.97Å; T278-D281 PolarHBondContact OG1-OD2 2.03Å; W279-D281 PolarHBondContact O-N 2.96Å; D281-Y285 VanDerWaalsContact O-CE2 3.28Å; D281-Y285 WeakPolarHBondContact O-CE2 3.48Å; D281-Y285 PolarHBondContact O-OH 3.38Å; D281-Y302 HydrophobicContact CB-CE1 4.16Å; D281-Y302 WeakPolarHBondContact O-CD1 3.47Å
282	A	95.8	Very high	96.1	Very high	37 Å²	37	46.2 Å²	46.2	31%	0.306	23%	0.23	S	C	.	.			trans	-66.8	138.1	177.7	0	0	0	0	0	111.3	W279 E280 Y302 Y303 P304	W279-A282 VanDerWaalsContact O-CB 3.31Å; W279-A282 WeakPolarHBondContact O-CB 3.28Å; W279-A282 PolarHBondContact O-N 3.35Å; E280-A282 VanDerWaalsContact C-N 3.34Å; A282-Y302 WeakPolarHBondContact CA-O 3.23Å; A282-Y303 HydrophobicContact CB-CD2 4.05Å; A282-Y303 HydrophobicContact CB-CE2 4.39Å; A282-P304 HydrophobicContact CB-CG 4.43Å
283	G	96.3	Very high	95.9	Very high	15 Å²	15	50.2 Å²	50.2	16%	0.155	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.3	-156.9	172.2	0	0	0	0	0	114.8	Y302	G283-Y302 PolarHBondContact N-O 3.44Å; G283-Y302 PolarHBondContact O-N 3.38Å
284	L	98	Very high	95.8	Very high	35 Å²	35	51.1 Å²	51.1	18%	0.183	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.8	-179.7	-66.1	170.1	0	0	0	110.3	R253 F286 Q299 T300 F301	R253-L284 PolarHBondContact N-O 3.04Å; L284-F286 HydrophobicContact CB-CE2 3.96Å; L284-F286 HydrophobicContact CB-CZ 4.33Å; L284-Q299 HydrophobicContact CD2-CG 3.98Å; L284-T300 WeakPolarHBondContact CA-O 3.48Å; L284-F301 HydrophobicContact CD2-CB 3.99Å; L284-F301 HydrophobicContact CD2-CD2 3.89Å; L284-F301 HydrophobicContact CD2-CG 4.42Å; L284-F301 HydrophobicContact CG-CD2 4.39Å
285	Y	98.1	Very high	95.8	Very high	3 Å²	3	54.9 Å²	54.9	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.3	173.3	-69.1	-100.2	0	0	0	108.5	L236 Y251 R252 I258 F264 L272 I274 D281 Q299 T300 Y302	L236-Y285 HydrophobicContact CD1-CD2 4.31Å; L236-Y285 HydrophobicContact CD1-CG 4.18Å; Y251-Y285 CarbonylContact O-C 3.46Å; Y251-Y285 WeakPolarHBondContact O-CA 3.41Å; R252-Y285 HydrophobicContact CG-CE1 4.33Å; R252-Y285 PolarHBondContact NH2-OH 2.79Å; I258-Y285 HydrophobicContact CD1-CD1 3.4Å; I258-Y285 VanDerWaalsContact CD1-CD1 3.4Å; I258-Y285 HydrophobicContact CD1-CE1 3.49Å; I258-Y285 VanDerWaalsContact CD1-CE1 3.49Å; F264-Y285 AromaticContact CE1-CE1 3.86Å; F264-Y285 HydrophobicContact CE1-CE1 3.86Å; L272-Y285 HydrophobicContact CD2-CD1 3.7Å; L272-Y285 HydrophobicContact CD2-CE1 4.04Å; I274-Y285 HydrophobicContact CD1-CE1 4.08Å; I274-Y285 HydrophobicContact CD1-CE2 4.43Å; D281-Y285 VanDerWaalsContact O-CE2 3.28Å; D281-Y285 WeakPolarHBondContact O-CE2 3.48Å; D281-Y285 PolarHBondContact O-OH 3.38Å; Y285-Q299 WeakPolarHBondContact O-CA 3.16Å; Y285-T300 PolarHBondContact N-O 2.98Å; Y285-T300 PolarHBondContact O-N 3.17Å; Y285-Y302 HydrophobicContact CE2-CD1 4.13Å
286	F	98.4	Very high	95.9	Very high	67 Å²	67	52.7 Å²	52.7	29%	0.294	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.8	179.9	-62.8	-95.8	0	0	0	108.5	W250 Y251 R253 L284 S298 Q299	W250-F286 CarbonylContact C-O 3.56Å; W250-F286 WeakPolarHBondContact CA-O 3.4Å; Y251-F286 PolarHBondContact N-O 2.88Å; Y251-F286 PolarHBondContact O-N 3.45Å; R253-F286 HydrophobicContact CB-CE2 4.33Å; L284-F286 HydrophobicContact CB-CE2 3.96Å; L284-F286 HydrophobicContact CB-CZ 4.33Å; F286-S298 WeakPolarHBondContact CA-O 3.38Å; F286-Q299 HydrophobicContact CD1-CB 4.33Å; F286-Q299 HydrophobicContact CD1-CG 4.48Å; F286-Q299 HydrophobicContact CE1-CB 4.36Å; F286-Q299 HydrophobicContact CE1-CG 4.19Å
287	C	98.5	Very high	96.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.3	171.2	178	0	0	0	0	109.3	C238 I248 W250 E297 S298	C238-C287 HydrophobicContact CB-CB 3.49Å; C238-C287 VanDerWaalsContact CB-CB 3.49Å; C238-C287 WeakPolarHBondContact CB-SG 3.39Å; C238-C287 WeakPolarHBondContact SG-CB 3.41Å; C238-C287 CovalentContact SG-SG 2Å; C238-C287 PolarHBondContact SG-SG 2.96Å; I248-C287 WeakPolarHBondContact CG2-SG 3.42Å; W250-C287 HydrophobicContact CD2-CB 3.96Å; W250-C287 HydrophobicContact CE3-CB 3.98Å; W250-C287 HydrophobicContact CH2-CB 3.94Å; W250-C287 HydrophobicContact CZ2-CB 3.91Å; W250-C287 HydrophobicContact CZ3-CB 3.96Å; C287-E297 CarbonylContact O-C 3.49Å; C287-E297 WeakPolarHBondContact O-CA 3.33Å; C287-S298 WeakPolarHBondContact CB-OG 3.33Å; C287-S298 PolarHBondContact N-O 2.85Å; C287-S298 PolarHBondContact O-N 2.88Å
288	K	98.4	Very high	96.4	Very high	66 Å²	66	54.3 Å²	54.3	29%	0.287	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	116.4	176.9	-174.5	175	-173.3	165.3	0	109.5	I248 K249 Y251 V295 E297	I248-K288 WeakPolarHBondContact CA-O 3.22Å; K249-K288 PolarHBondContact N-O 3.29Å; K249-K288 PolarHBondContact O-N 2.87Å; Y251-K288 HydrophobicContact CD2-CB 4.29Å; Y251-K288 HydrophobicContact CE2-CB 3.84Å; Y251-K288 HydrophobicContact CE2-CD 4.06Å; K288-V295 HydrophobicContact CD-CG1 4.27Å; K288-V295 VanDerWaalsContact CE-CG1 3.48Å; K288-V295 HydrophobicContact CG-CG1 3.79Å; K288-E297 HydrophobicContact CB-CG 4.21Å; K288-E297 HydrophobicContact CG-CG 3.97Å; K288-E297 IonicContact NZ-OE1 3.39Å
289	A	98.2	Very high	96.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.9	170.5	0	0	0	0	0	109.4	P217 I219 A240 P246 I247 I248 V295 S296	P217-A289 HydrophobicContact CB-CB 3.98Å; I219-A289 HydrophobicContact CD1-CB 4.24Å; I219-A289 HydrophobicContact CG1-CB 3.89Å; A240-A289 HydrophobicContact CB-CB 3.56Å; P246-A289 HydrophobicContact CB-CB 4.06Å; I247-A289 WeakPolarHBondContact O-CA 3.37Å; I248-A289 HydrophobicContact CD1-CB 3.34Å; A289-V295 CarbonylContact O-C 3.5Å; A289-V295 VanDerWaalsContact O-CA 3.28Å; A289-V295 WeakPolarHBondContact O-CA 3.26Å; A289-S296 PolarHBondContact N-O 3.35Å; A289-S296 PolarHBondContact O-N 3.13Å
290	S	97.9	Very high	96.8	Very high	32 Å²	32	50.1 Å²	50.1	22%	0.224	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	139.7	-177.2	56.4	0	0	0	0	112.9	P246 I247 G294	P246-S290 WeakPolarHBondContact CA-O 3.35Å; I247-S290 PolarHBondContact N-O 3.43Å; I247-S290 PolarHBondContact O-N 2.91Å; I247-S290 PolarHBondContact O-OG 2.69Å; S290-G294 WeakPolarHBondContact CA-O 3.44Å
291	N	95.9	Very high	97	Very high	25 Å²	25	45.6 Å²	45.6	13%	0.134	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	-174.8	164.2	71.7	13.3	0	0	0	109.4	R215 P217 P244 Y293 G294	R215-N291 PolarHBondContact O-ND2 2.78Å; P217-N291 VanDerWaalsContact CD-OD1 3.26Å; P217-N291 WeakPolarHBondContact CD-OD1 2.88Å; P217-N291 HydrophobicContact CG-CB 4.07Å; P244-N291 PolarHBondContact O-ND2 3.47Å; N291-Y293 PolarHBondContact O-N 3.15Å; N291-Y293 PolarHBondContact OD1-N 3.17Å; N291-G294 PolarHBondContact N-O 3.16Å; N291-G294 VanDerWaalsContact N-O 3.12Å; N291-G294 PolarHBondContact O-N 3.31Å; N291-G294 PolarHBondContact OD1-N 3.46Å
292	D	95	Very high	97.2	Very high	136 Å²	136	44.6 Å²	44.6	73%	0.727	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.9	-175.8	-57.8	-41.2	0	0	0	114.3
293	Y	92.2	Very high	97.2	Very high	83 Å²	83	47.7 Å²	47.7	33%	0.325	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-13.2	-172.6	-53.7	-61.6	0	0	0	114.3	L210 Q214 P244 N291	L210-Y293 HydrophobicContact CD2-CD1 3.84Å; L210-Y293 HydrophobicContact CD2-CG 3.78Å; Q214-Y293 HydrophobicContact CB-CD2 4.06Å; Q214-Y293 HydrophobicContact CB-CE2 3.67Å; Q214-Y293 HydrophobicContact CG-CD2 4.4Å; Q214-Y293 HydrophobicContact CG-CE1 4.24Å; Q214-Y293 HydrophobicContact CG-CE2 3.53Å; Q214-Y293 VanDerWaalsContact CG-CZ 3.48Å; Q214-Y293 WeakPolarHBondContact CG-OH 2.99Å; Q214-Y293 PolarHBondContact NE2-OH 2.85Å; P244-Y293 HydrophobicContact CG-CE2 4.5Å; N291-Y293 PolarHBondContact O-N 3.15Å; N291-Y293 PolarHBondContact OD1-N 3.17Å
294	G	94.6	Very high	97.2	Very high	21 Å²	21	47 Å²	47	22%	0.216	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176	-174.9	-177	0	0	0	0	0	115.2	P217 S290 N291	P217-G294 VanDerWaalsContact CD-C 3.47Å; P217-G294 WeakPolarHBondContact CD-O 3.3Å; P217-G294 WeakPolarHBondContact CG-O 3.26Å; S290-G294 WeakPolarHBondContact CA-O 3.44Å; N291-G294 PolarHBondContact N-O 3.16Å; N291-G294 VanDerWaalsContact N-O 3.12Å; N291-G294 PolarHBondContact O-N 3.31Å; N291-G294 PolarHBondContact OD1-N 3.46Å
295	V	96.9	Very high	96.9	Very high	81 Å²	81	46.9 Å²	46.9	49%	0.491	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	143	-175.6	177.3	0	0	0	0	109.1	K288 A289 E297	K288-V295 HydrophobicContact CD-CG1 4.27Å; K288-V295 VanDerWaalsContact CE-CG1 3.48Å; K288-V295 HydrophobicContact CG-CG1 3.79Å; A289-V295 CarbonylContact O-C 3.5Å; A289-V295 VanDerWaalsContact O-CA 3.28Å; A289-V295 WeakPolarHBondContact O-CA 3.26Å; V295-E297 HydrophobicContact CG1-CG 3.99Å
296	S	97.3	Very high	96.4	Very high	29 Å²	29	49.8 Å²	49.8	20%	0.203	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137.8	168.1	-179.4	0	0	0	0	108.9	P217 I219 A289	P217-S296 WeakPolarHBondContact O-CB 3.22Å; I219-S296 WeakPolarHBondContact CD1-O 3.25Å; I219-S296 PolarHBondContact N-OG 3.43Å; I219-S296 VanDerWaalsContact N-OG 3.16Å; A289-S296 PolarHBondContact N-O 3.35Å; A289-S296 PolarHBondContact O-N 3.13Å
297	E	98	Very high	95.2	Very high	129 Å²	129	49.5 Å²	49.5	60%	0.603	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	144.4	-176.5	-67.7	177.4	168.9	0	0	110.9	C287 K288 V295	C287-E297 CarbonylContact O-C 3.49Å; C287-E297 WeakPolarHBondContact O-CA 3.33Å; K288-E297 HydrophobicContact CB-CG 4.21Å; K288-E297 HydrophobicContact CG-CG 3.97Å; K288-E297 IonicContact NZ-OE1 3.39Å; V295-E297 HydrophobicContact CG1-CG 3.99Å
298	S	98.3	Very high	93.7	Very high	13 Å²	13	53.9 Å²	53.9	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	164.1	172.4	71.8	0	0	0	0	110.7	F286 C287	F286-S298 WeakPolarHBondContact CA-O 3.38Å; C287-S298 WeakPolarHBondContact CB-OG 3.33Å; C287-S298 PolarHBondContact N-O 2.85Å; C287-S298 PolarHBondContact O-N 2.88Å
299	Q	98.2	Very high	91.9	Very high	88 Å²	88	56.9 Å²	56.9	41%	0.411	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.4	-177.8	176.2	173.9	64.2	0	0	109.9	L284 Y285 F286	L284-Q299 HydrophobicContact CD2-CG 3.98Å; Y285-Q299 WeakPolarHBondContact O-CA 3.16Å; F286-Q299 HydrophobicContact CD1-CB 4.33Å; F286-Q299 HydrophobicContact CD1-CG 4.48Å; F286-Q299 HydrophobicContact CE1-CB 4.36Å; F286-Q299 HydrophobicContact CE1-CG 4.19Å
300	T	98.6	Very high	90	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	134	176.2	-56.4	0	0	0	0	110.1	T223 D224 L236 L284 Y285	T223-T300 HydrophobicContact CG2-CG2 3.77Å; T223-T300 WeakPolarHBondContact O-CA 3.32Å; T223-T300 VanDerWaalsContact O-CB 3.26Å; T223-T300 WeakPolarHBondContact O-CB 3.17Å; T223-T300 WeakPolarHBondContact O-CG2 3.35Å; T223-T300 PolarHBondContact O-OG1 2.76Å; D224-T300 WeakPolarHBondContact O-CA 3.09Å; L236-T300 HydrophobicContact CB-CG2 4.39Å; L236-T300 HydrophobicContact CD1-CG2 3.98Å; L236-T300 HydrophobicContact CD2-CG2 4.02Å; L236-T300 HydrophobicContact CG-CG2 4.36Å; L284-T300 WeakPolarHBondContact CA-O 3.48Å; Y285-T300 PolarHBondContact N-O 2.98Å; Y285-T300 PolarHBondContact O-N 3.17Å
301	F	98.3	Very high	88.2	Confident	76 Å²	76	64.3 Å²	64.3	33%	0.333	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.5	167.5	-177.1	-108.6	0	0	0	111.1	D224 F225 R226 F227 L284 Y303	D224-F301 PolarHBondContact O-N 3.15Å; F225-F301 CarbonylContact C-O 3.58Å; F225-F301 WeakPolarHBondContact CA-O 3.32Å; F225-F301 HydrophobicContact CB-CB 4.3Å; R226-F301 PolarHBondContact N-O 2.8Å; F227-F301 HydrophobicContact CE1-CE1 4.28Å; L284-F301 HydrophobicContact CD2-CB 3.99Å; L284-F301 HydrophobicContact CD2-CD2 3.89Å; L284-F301 HydrophobicContact CD2-CG 4.42Å; L284-F301 HydrophobicContact CG-CD2 4.39Å; F301-Y303 HydrophobicContact CE1-CD2 4.39Å; F301-Y303 HydrophobicContact CE1-CG 4.37Å; F301-Y303 AromaticContact CZ-CD2 3.95Å; F301-Y303 HydrophobicContact CZ-CD2 3.95Å; F301-Y303 HydrophobicContact CZ-CG 4.38Å
302	Y	97.8	Very high	86.9	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132.7	174.5	170.4	-122.4	0	0	0	110.7	R226 E228 V234 I274 D281 A282 G283 Y285 P304	R226-Y302 HydrophobicContact CB-CD2 4.26Å; R226-Y302 HydrophobicContact CG-CD2 4.35Å; R226-Y302 WeakPolarHBondContact O-CD2 3.3Å; E228-Y302 HydrophobicContact CB-CE2 4.16Å; V234-Y302 HydrophobicContact CB-CE2 4.24Å; V234-Y302 HydrophobicContact CG1-CD2 4.18Å; V234-Y302 HydrophobicContact CG1-CE1 4.22Å; V234-Y302 HydrophobicContact CG1-CE2 3.69Å; V234-Y302 HydrophobicContact CG2-CD2 4.4Å; V234-Y302 HydrophobicContact CG2-CE2 4.21Å; I274-Y302 HydrophobicContact CD1-CD1 3.87Å; I274-Y302 HydrophobicContact CD1-CE1 4.15Å; I274-Y302 HydrophobicContact CD1-CG 4.47Å; D281-Y302 HydrophobicContact CB-CE1 4.16Å; D281-Y302 WeakPolarHBondContact O-CD1 3.47Å; A282-Y302 WeakPolarHBondContact CA-O 3.23Å; G283-Y302 PolarHBondContact N-O 3.44Å; G283-Y302 PolarHBondContact O-N 3.38Å; Y285-Y302 HydrophobicContact CE2-CD1 4.13Å; Y302-P304 HydrophobicContact CE1-CG 3.98Å
303	Y	96.8	Very high	85.6	Confident	102 Å²	102	66 Å²	66	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	114.9	176.5	-165.4	-94.3	0	0	0	111.7	R226 F227 E228 W279 A282 F301	R226-Y303 PolarHBondContact O-N 3.22Å; F227-Y303 WeakPolarHBondContact CA-O 3.38Å; F227-Y303 HydrophobicContact CD1-CD1 4.27Å; F227-Y303 HydrophobicContact CD1-CG 4.45Å; F227-Y303 HydrophobicContact CE1-CD1 4.42Å; F227-Y303 HydrophobicContact CE1-CG 4.39Å; E228-Y303 PolarHBondContact N-O 3.01Å; W279-Y303 AromaticContact CZ3-CE1 3.88Å; W279-Y303 HydrophobicContact CZ3-CE1 3.88Å; W279-Y303 AromaticContact CZ3-CZ 3.99Å; A282-Y303 HydrophobicContact CB-CD2 4.05Å; A282-Y303 HydrophobicContact CB-CE2 4.39Å; F301-Y303 HydrophobicContact CE1-CD2 4.39Å; F301-Y303 HydrophobicContact CE1-CG 4.37Å; F301-Y303 AromaticContact CZ-CD2 3.95Å; F301-Y303 HydrophobicContact CZ-CD2 3.95Å; F301-Y303 HydrophobicContact CZ-CG 4.38Å
304	P	96.4	Very high	84.6	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	147.9	169.3	-11.7	21.8	0	0	0	111.4	E228 I230 T278 W279 A282 Y302	E228-P304 CarbonylContact O-C 3.54Å; E228-P304 VanDerWaalsContact O-C 3.3Å; E228-P304 WeakPolarHBondContact O-CA 3.45Å; I230-P304 HydrophobicContact CB-CB 4.47Å; T278-P304 WeakPolarHBondContact O-CG 3.46Å; W279-P304 HydrophobicContact CE3-CB 4.21Å; W279-P304 WeakPolarHBondContact CH2-O 3.36Å; W279-P304 HydrophobicContact CZ3-CB 4.36Å; W279-P304 WeakPolarHBondContact CZ3-O 3.4Å; A282-P304 HydrophobicContact CB-CG 4.43Å; Y302-P304 HydrophobicContact CE1-CG 3.98Å
305	T	92	Very high	83.8	Confident	33 Å²	33	74.7 Å²	74.7	20%	0.202	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	155	176.7	67.1	0	0	0	0	110	F227 E228 V229 I230	F227-T305 HydrophobicContact CB-CG2 4.12Å; E228-T305 PolarHBondContact O-N 2.78Å; E228-T305 PolarHBondContact O-OG1 3.2Å; V229-T305 WeakPolarHBondContact CA-O 3.42Å; I230-T305 PolarHBondContact N-O 2.84Å
306	A	86.8	Confident	82.9	Confident	65 Å²	65	74.3 Å²	74.3	54%	0.537	38%	0.382	S	S	.	.			trans	-74	146.4	170.9	0	0	0	0	0	109.7	W279 S308	W279-A306 HydrophobicContact CH2-CB 4.45Å; W279-A306 HydrophobicContact CZ2-CB 4.25Å; A306-S308 PolarHBondContact O-N 3.2Å
307	V	73.7	Confident	82.2	Confident	61 Å²	61	79.8 Å²	79.8	37%	0.37	42%	0.416	S	S	.	.			trans	-55.4	125.5	164.9	-86.7	0	0	0	0	109.3	V229 K309	V229-V307 HydrophobicContact CG1-CB 4.46Å; V229-V307 HydrophobicContact CG1-CG1 3.41Å; V229-V307 VanDerWaalsContact CG1-CG1 3.41Å; V307-K309 PolarHBondContact O-N 2.71Å
308	S	66	Low	81.5	Confident	91 Å²	91	79 Å²	79	64%	0.636	42%	0.416	S	S	*	.			trans	-61.9	100.1	173.1	-176.2	0	0	0	0	108.7	A306 L310	A306-S308 PolarHBondContact O-N 3.2Å; S308-L310 PolarHBondContact O-N 3.37Å
309	K	61	Low	80.6	Confident	129 Å²	129	80.2 Å²	80.2	56%	0.561	43%	0.431	S	S	*	.			trans	-75.9	110.7	166.2	-74.4	180	-176.2	170.1	0	106.1	V307 V311	V307-K309 PolarHBondContact O-N 2.71Å; K309-V311 WeakPolarHBondContact O-CG2 3.35Å; K309-V311 PolarHBondContact O-N 3.25Å
310	L	58.8	Low	79.6	Confident	112 Å²	112	81.9 Å²	81.9	59%	0.586	44%	0.438	S	S	*	.			trans	-55.3	107.5	165.5	-175.7	72.9	0	0	0	107.8	S308 I312 S325 R326	S308-L310 PolarHBondContact O-N 3.37Å; L310-I312 HydrophobicContact CD2-CG1 4.33Å; L310-I312 HydrophobicContact CG-CG1 4.4Å; L310-S325 WeakPolarHBondContact O-CA 3.27Å; L310-R326 PolarHBondContact O-N 3.42Å
311	V	59.6	Low	78	Confident	77 Å²	77	87.5 Å²	87.5	47%	0.467	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	105.5	173.2	-179.5	0	0	0	0	107.3	K309 L313 F324	K309-V311 WeakPolarHBondContact O-CG2 3.35Å; K309-V311 PolarHBondContact O-N 3.25Å; V311-L313 HydrophobicContact CG1-CD2 4.21Å; V311-L313 HydrophobicContact CG1-CG 4.41Å; V311-L313 PolarHBondContact O-N 3.05Å; V311-F324 CarbonylContact C-O 3.55Å; V311-F324 WeakPolarHBondContact CA-O 3.42Å
312	I	68.7	Low	77	Confident	87 Å²	87	86.2 Å²	86.2	45%	0.446	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	117.9	170.1	-58.1	174.2	0	0	0	107	L310 L314 S323 F324	L310-I312 HydrophobicContact CD2-CG1 4.33Å; L310-I312 HydrophobicContact CG-CG1 4.4Å; I312-L314 HydrophobicContact CG2-CD2 4.22Å; I312-L314 HydrophobicContact CG2-CG 4.18Å; I312-S323 CarbonylContact O-C 3.54Å; I312-S323 WeakPolarHBondContact O-CA 3.26Å; I312-F324 HydrophobicContact CB-CB 4.35Å; I312-F324 PolarHBondContact N-O 3.32Å; I312-F324 PolarHBondContact O-N 2.98Å
313	L	67.8	Low	75.3	Confident	109 Å²	109	90.1 Å²	90.1	57%	0.571	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	108	170.5	-67.7	171.7	0	0	0	108.7	V311 L321 V322	V311-L313 HydrophobicContact CG1-CD2 4.21Å; V311-L313 HydrophobicContact CG1-CG 4.41Å; V311-L313 PolarHBondContact O-N 3.05Å; L313-L321 HydrophobicContact CB-CD2 4.39Å; L313-V322 CarbonylContact C-O 3.56Å; L313-V322 WeakPolarHBondContact CA-O 3.45Å
314	L	71.1	Confident	73.7	Confident	90 Å²	90	90.1 Å²	90.1	47%	0.471	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.2	169.4	-70.8	-179	0	0	0	109.2	I312 L321 V322 F324	I312-L314 HydrophobicContact CG2-CD2 4.22Å; I312-L314 HydrophobicContact CG2-CG 4.18Å; L314-L321 WeakPolarHBondContact O-CA 3.47Å; L314-V322 PolarHBondContact N-O 3.41Å; L314-V322 PolarHBondContact O-N 3.22Å; L314-F324 HydrophobicContact CB-CE2 4.32Å; L314-F324 HydrophobicContact CD1-CD2 4.08Å; L314-F324 HydrophobicContact CD1-CE2 3.66Å; L314-F324 HydrophobicContact CD1-CZ 4.45Å; L314-F324 HydrophobicContact CG-CD2 4.29Å; L314-F324 HydrophobicContact CG-CE2 4.19Å
315	R	77.5	Confident	71.8	Confident	197 Å²	197	92.7 Å²	92.7	74%	0.743	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	113.6	167.8	-162.1	174	-170.8	173.1	-0.2	108.4	H320 L321	R315-H320 CarbonylContact C-O 3.6Å; R315-H320 WeakPolarHBondContact CA-O 3.26Å; R315-L321 HydrophobicContact CB-CD2 4.1Å; R315-L321 HydrophobicContact CG-CD2 4.29Å
316	L	78.6	Confident	70	Confident	73 Å²	73	101.1 Å²	101.1	38%	0.382	54%	0.542	S	S	.	.			trans	-71.8	156.5	175.6	-65.9	-179.8	0	0	0	110.7	N318 G319 H320 V322	L316-N318 WeakPolarHBondContact CB-OD1 3.19Å; L316-N318 PolarHBondContact O-N 3.46Å; L316-N318 VanDerWaalsContact O-N 3.08Å; L316-G319 PolarHBondContact O-N 2.84Å; L316-H320 HydrophobicContact CB-CB 4.46Å; L316-H320 HydrophobicContact CD1-CB 4.27Å; L316-H320 PolarHBondContact N-O 3.07Å; L316-V322 HydrophobicContact CD1-CG2 3.56Å; L316-V322 HydrophobicContact CD2-CG2 4.5Å; L316-V322 HydrophobicContact CG-CG2 3.88Å
317	P	81.3	Confident	68	Low	143 Å²	143	108.2 Å²	108.2	93%	0.929	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	-26.1	179.8	-26.4	34.7	0	0	0	114.6	G319	P317-G319 PolarHBondContact O-N 3.21Å
318	N	84.8	Confident	66.3	Low	112 Å²	112	112.4 Å²	112.4	60%	0.599	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	8.5	175.7	62.7	-2.8	0	0	0	113.6	L316 H320	L316-N318 WeakPolarHBondContact CB-OD1 3.19Å; L316-N318 PolarHBondContact O-N 3.46Å; L316-N318 VanDerWaalsContact O-N 3.08Å; N318-H320 PolarHBondContact O-N 3.3Å; N318-H320 PolarHBondContact OD1-N 3.41Å
319	G	78.2	Confident	64.8	Low	39 Å²	39	117.1 Å²	117.1	40%	0.402	58%	0.582	S	S	.	*	S	Bend	trans	87.7	-8.3	176.1	0	0	0	0	0	115.4	L316 P317	L316-G319 PolarHBondContact O-N 2.84Å; P317-G319 PolarHBondContact O-N 3.21Å
320	H	77.3	Confident	63.6	Low	123 Å²	123	124.3 Å²	124.3	57%	0.569	61%	0.613	S	S	*	*			trans	-69.9	142	177.7	-80.4	-85.6	0	0	0	112.4	R315 L316 N318	R315-H320 CarbonylContact C-O 3.6Å; R315-H320 WeakPolarHBondContact CA-O 3.26Å; L316-H320 HydrophobicContact CB-CB 4.46Å; L316-H320 HydrophobicContact CD1-CB 4.27Å; L316-H320 PolarHBondContact N-O 3.07Å; N318-H320 PolarHBondContact O-N 3.3Å; N318-H320 PolarHBondContact OD1-N 3.41Å
321	L	66.3	Low	63.9	Low	118 Å²	118	124.9 Å²	124.9	62%	0.618	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.8	126.2	170.1	-72.7	163.4	0	0	0	109.5	L313 L314 R315	L313-L321 HydrophobicContact CB-CD2 4.39Å; L314-L321 WeakPolarHBondContact O-CA 3.47Å; R315-L321 HydrophobicContact CB-CD2 4.1Å; R315-L321 HydrophobicContact CG-CD2 4.29Å
322	V	75.5	Confident	64.1	Low	50 Å²	50	127.4 Å²	127.4	30%	0.303	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.6	128	171.9	-176.1	0	0	0	0	108.7	L313 L314 L316 F324	L313-V322 CarbonylContact C-O 3.56Å; L313-V322 WeakPolarHBondContact CA-O 3.45Å; L314-V322 PolarHBondContact N-O 3.41Å; L314-V322 PolarHBondContact O-N 3.22Å; L316-V322 HydrophobicContact CD1-CG2 3.56Å; L316-V322 HydrophobicContact CD2-CG2 4.5Å; L316-V322 HydrophobicContact CG-CG2 3.88Å; V322-F324 HydrophobicContact CB-CE2 3.95Å; V322-F324 HydrophobicContact CG1-CD2 4.11Å; V322-F324 HydrophobicContact CG1-CE2 3.42Å; V322-F324 VanDerWaalsContact CG1-CE2 3.42Å; V322-F324 HydrophobicContact CG1-CZ 3.74Å
323	S	64.2	Low	63.9	Low	81 Å²	81	129.7 Å²	129.7	57%	0.566	63%	0.632	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.6	129.3	177.9	65.9	0	0	0	0	111.1	I312	I312-S323 CarbonylContact O-C 3.54Å; I312-S323 WeakPolarHBondContact O-CA 3.26Å
324	F	61.9	Low	63.6	Low	103 Å²	103	130.9 Å²	130.9	45%	0.452	64%	0.636	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117	118	173	-66.3	-94.1	0	0	0	108.7	V311 I312 L314 V322	V311-F324 CarbonylContact C-O 3.55Å; V311-F324 WeakPolarHBondContact CA-O 3.42Å; I312-F324 HydrophobicContact CB-CB 4.35Å; I312-F324 PolarHBondContact N-O 3.32Å; I312-F324 PolarHBondContact O-N 2.98Å; L314-F324 HydrophobicContact CB-CE2 4.32Å; L314-F324 HydrophobicContact CD1-CD2 4.08Å; L314-F324 HydrophobicContact CD1-CE2 3.66Å; L314-F324 HydrophobicContact CD1-CZ 4.45Å; L314-F324 HydrophobicContact CG-CD2 4.29Å; L314-F324 HydrophobicContact CG-CE2 4.19Å; V322-F324 HydrophobicContact CB-CE2 3.95Å; V322-F324 HydrophobicContact CG1-CD2 4.11Å; V322-F324 HydrophobicContact CG1-CE2 3.42Å; V322-F324 VanDerWaalsContact CG1-CE2 3.42Å; V322-F324 HydrophobicContact CG1-CZ 3.74Å
325	S	56.2	Low	63.2	Low	53 Å²	53	133.4 Å²	133.4	37%	0.371	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.6	133.8	165.6	77.7	0	0	0	0	109.3	L310 R327	L310-S325 WeakPolarHBondContact O-CA 3.27Å; S325-R327 PolarHBondContact O-N 2.88Å
326	R	53.8	Low	62.2	Low	211 Å²	211	129.2 Å²	129.2	80%	0.796	64%	0.639	S	S	*	*			trans	-60.1	104.1	161.6	-111.3	-174.2	178.7	-168.9	0.6	108.3	L310	L310-R326 PolarHBondContact O-N 3.42Å
327	R	45	Very low	61	Low	214 Å²	214	133.2 Å²	133.2	81%	0.808	66%	0.658	S	S	*	*			trans	-76.7	130.9	156	-87.9	-177	177.5	179.4	-0.4	106.2	S325 M329	S325-R327 PolarHBondContact O-N 2.88Å; R327-M329 PolarHBondContact O-N 2.92Å
328	K	39.3	Very low	59.5	Low	149 Å²	149	132.5 Å²	132.5	65%	0.648	64%	0.637	S	S	*	*			trans	-51.5	115	162.1	-84.4	-179.5	178.1	166.1	0	106.4	E139 K330	E139-K328 VanDerWaalsContact OE1-CE 3.28Å; E139-K328 WeakPolarHBondContact OE1-CE 3.23Å; E139-K328 IonicContact OE1-NZ 3.29Å; E139-K328 PolarHBondContact OE1-NZ 3.25Å; K328-K330 PolarHBondContact O-N 3.03Å
329	M	33.4	Very low	57.4	Low	190 Å²	190	134.2 Å²	134.2	94%	0.936	64%	0.64	S	S	*	*			trans	-61.7	122.3	161.7	-73	-174.9	-168	0	0	105.2	R327	R327-M329 PolarHBondContact O-N 2.92Å
330	K	37.3	Very low	55.5	Low	279 Å²	279	142.8 Å²	142.8	100%	1.213	66%	0.662	S	S	*	*			trans	-67.7	0	163.9	-81.4	-173	174.9	-175.8	0	108.5	K328	K328-K330 PolarHBondContact O-N 3.03Å

Retrieved 330 of 330 residues in 423.8 ms (Link to these results)

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