A0A096NPW2_PAPAN Loading...

C-type lectin domain family 3 member B

AlphaFold DB (A0A2K6BMB1), UniProt , Accession A0A096NPW2, Species PAPAN (Papio anubis, Olive baboon), Gene CLEC3B, Length 202 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	40.7	Very low	44.8	Very low	245 Å²	245	171.8 Å²	171.8	100%	1.207	90%	0.897	S	S	*	*				0	86.2	0	-75.7	-176.3	-78.9	0	0	106.1
2	E	43.8	Very low	44.6	Very low	188 Å²	188	170.8 Å²	170.8	88%	0.879	89%	0.891	S	S	*	*			trans	-115.2	105.6	-176.6	-78.5	-95.6	158.6	0	0	105.1
3	L	39.9	Very low	44.4	Very low	166 Å²	166	172.6 Å²	172.6	87%	0.869	89%	0.889	S	S	*	*			trans	-157.6	92.9	176.5	-95.3	163.2	0	0	0	106.8
4	W	41.7	Very low	43.9	Very low	272 Å²	272	167.9 Å²	167.9	100%	1.03	88%	0.879	S	S	*	*			trans	-161.1	76	153.6	-102.1	26.1	0	0	0	107.2
5	G	47.9	Very low	43.6	Very low	77 Å²	77	167.8 Å²	167.8	79%	0.794	88%	0.878	S	S	*	*			trans	-170.1	67.6	-177.7	0	0	0	0	0	111.4
6	A	50.5	Low	43.3	Very low	91 Å²	91	167.2 Å²	167.2	75%	0.752	88%	0.875	S	S	*	*			trans	-168.4	38.2	170	0	0	0	0	0	114
7	Y	46.5	Very low	42.9	Very low	237 Å²	237	165.1 Å²	165.1	93%	0.929	87%	0.871	S	S	*	*			trans	-130.1	43.8	173.4	-109.3	-84.1	0	0	0	112.3
8	L	49.2	Very low	42.6	Very low	157 Å²	157	166.4 Å²	166.4	82%	0.822	87%	0.871	S	S	*	*	S	Bend	trans	-137.9	119.2	165.5	-127	131.7	0	0	0	106.1
9	L	48.1	Very low	42.4	Very low	160 Å²	160	164.6 Å²	164.6	84%	0.838	87%	0.868	S	S	*	*	S	Bend	trans	82.9	94.7	-178.9	-56	152.9	0	0	0	115.1
10	L	44.9	Very low	41.9	Very low	173 Å²	173	162.6 Å²	162.6	91%	0.906	86%	0.862	S	S	*	*				-178.2	145	127.3	-92.8	158	0	0	0	110
11	C	39.5	Very low	41.4	Very low	124 Å²	124	161.1 Å²	161.1	84%	0.838	86%	0.86	S	S	*	*			trans	87.9	53	173	-56.9	0	0	0	0	117.8
12	L	42	Very low	41.1	Very low	159 Å²	159	158.3 Å²	158.3	83%	0.832	84%	0.844	S	S	*	*				-64.6	145.3	129.3	-88.7	159.8	0	0	0	109
13	F	42.2	Very low	41	Very low	195 Å²	195	154.9 Å²	154.9	86%	0.855	84%	0.838	S	S	*	*			trans	82.2	89.8	168.1	-73.3	-81.5	0	0	0	119.6
14	S	37.9	Very low	41.3	Very low	107 Å²	107	151.8 Å²	151.8	75%	0.748	83%	0.828	S	S	*	*			trans	-177.5	126.5	137.4	63.1	0	0	0	0	106.4
15	L	38.7	Very low	40.9	Very low	166 Å²	166	144.9 Å²	144.9	87%	0.869	82%	0.816	S	S	*	*			cis	-153.2	150.5	18.7	-98.8	105.2	0	0	0	108.9
16	L	40.1	Very low	40.1	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	82%	0.818	S	S	*	*			trans	-66	148.3	160.9	-82.2	137.7	0	0	0	112.3
17	T	35.3	Very low	39.7	Very low	131 Å²	131	154.6 Å²	154.6	80%	0.804	82%	0.822	S	S	*	*			trans	146.3	125.9	142.4	53.6	0	0	0	0	106.5
18	Q	38.5	Very low	39.2	Very low	189 Å²	189	149.1 Å²	149.1	88%	0.883	82%	0.815	S	S	*	*			cis	-149.9	149.3	46.5	-70.2	175.9	-28.8	0	0	112.7
19	V	38.4	Very low	38.7	Very low	132 Å²	132	150.4 Å²	150.4	80%	0.8	81%	0.814	S	S	*	*			trans	-79.8	138.2	169.1	165.9	0	0	0	0	109.5
20	T	32	Very low	38.2	Very low	124 Å²	124	152.4 Å²	152.4	76%	0.761	82%	0.816	S	S	*	*			trans	-168	117	137.5	42.5	0	0	0	0	112.6
21	T	31.8	Very low	38.2	Very low	132 Å²	132	150.3 Å²	150.3	81%	0.81	81%	0.81	S	S	*	*			trans	57.9	120.7	136.6	61.5	0	0	0	0	123.2
22	E	34.4	Very low	38.8	Very low	187 Å²	187	150.2 Å²	150.2	87%	0.874	81%	0.806	S	S	*	*			trans	-74.6	-179	160.9	-68	-173.1	143.9	0	0	113
23	P	41.4	Very low	39.1	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	79%	0.793	S	S	*	*			cis	-143	-156.9	9.6	37.2	-12.3	0	0	0	115
24	P	46.6	Very low	39.6	Very low	102 Å²	102	141.3 Å²	141.3	66%	0.662	78%	0.776	S	S	*	*				-127.7	179.2	-52.7	33.8	-15.3	0	0	0	114.6
25	T	32.9	Very low	40.1	Very low	127 Å²	127	144.6 Å²	144.6	78%	0.779	78%	0.777	S	S	*	*			trans	76.6	134.4	164.2	72.5	0	0	0	0	115.9
26	Q	31.7	Very low	40.6	Very low	180 Å²	180	144.1 Å²	144.1	84%	0.841	77%	0.768	S	S	*	*			cis	-152.5	148.2	34.2	-73.3	175.4	-9	0	0	111.8
27	K	41.6	Very low	41.4	Very low	192 Å²	192	141.8 Å²	141.8	84%	0.835	76%	0.756	S	S	*	*			trans	-76	139.9	165.7	-66.3	176.2	178	177.4	0	110.3
28	P	36.3	Very low	42.5	Very low	122 Å²	122	139.2 Å²	139.2	79%	0.792	74%	0.74	S	S	*	*			trans	-100.9	112.9	142.1	30.3	-19.7	0	0	0	108.4	K30	P28-K30 PolarHBondContact O-N 3.15Å; P28-K30 VanDerWaalsContact O-N 3.12Å
29	K	38.9	Very low	43.6	Very low	184 Å²	184	134.9 Å²	134.9	80%	0.8	73%	0.726	S	S	*	*			trans	-58.8	111.6	163.9	-72.7	177	176.2	177.1	0	107.8	V31	K29-V31 PolarHBondContact O-N 3.12Å; K29-V31 VanDerWaalsContact O-N 3.15Å
30	K	37	Very low	45.2	Very low	202 Å²	202	132.4 Å²	132.4	88%	0.878	72%	0.715	S	S	*	*			trans	-69.2	105.2	161	-104	-178.3	176.8	178.2	0	107.5	P28 V32	P28-K30 PolarHBondContact O-N 3.15Å; P28-K30 VanDerWaalsContact O-N 3.12Å; K30-V32 PolarHBondContact O-N 3.28Å
31	V	44.7	Very low	47.6	Very low	129 Å²	129	130.1 Å²	130.1	78%	0.782	70%	0.701	S	S	*	*			trans	-68.4	113.1	165.8	176.6	0	0	0	0	107.1	K29 N33	K29-V31 PolarHBondContact O-N 3.12Å; K29-V31 VanDerWaalsContact O-N 3.15Å; V31-N33 PolarHBondContact O-N 3.28Å
32	V	52.2	Low	50.3	Low	122 Å²	122	130.5 Å²	130.5	74%	0.739	69%	0.691	S	S	*	*			trans	-65.7	114.4	173	175.5	0	0	0	0	108	K30 A34	K30-V32 PolarHBondContact O-N 3.28Å; V32-A34 VanDerWaalsContact C-N 3.35Å; V32-A34 HydrophobicContact CG1-CB 4.25Å; V32-A34 PolarHBondContact O-N 2.97Å
33	N	47.7	Very low	52.9	Low	107 Å²	107	128 Å²	128	57%	0.572	68%	0.681	S	S	*	*			trans	-93.4	68.3	176.8	-156.8	11.2	0	0	0	110.1	V31 K35 K36	V31-N33 PolarHBondContact O-N 3.28Å; N33-K35 PolarHBondContact O-N 3.27Å; N33-K36 PolarHBondContact O-N 3.18Å
34	A	53.7	Low	55.1	Low	60 Å²	60	129.3 Å²	129.3	50%	0.496	68%	0.675	S	S	.	*	H	α-helix	trans	-59.2	-12.4	-173.9	0	0	0	0	0	115.2	V32 V38	V32-A34 VanDerWaalsContact C-N 3.35Å; V32-A34 HydrophobicContact CG1-CB 4.25Å; V32-A34 PolarHBondContact O-N 2.97Å; A34-V38 WeakPolarHBondContact O-CG2 3.47Å
35	K	48.5	Very low	57.4	Low	175 Å²	175	130.7 Å²	130.7	76%	0.761	67%	0.673	S	S	*	*	H	α-helix	trans	-82.3	-21.5	179.4	-71.1	-175.5	177.2	-179.2	0	113.8	N33	N33-K35 PolarHBondContact O-N 3.27Å
36	K	48.7	Very low	60.3	Low	156 Å²	156	129.1 Å²	129.1	68%	0.678	66%	0.657	S	S	*	*	H	α-helix	trans	-79	-32.2	-178.9	-151.8	174.7	-176.1	-179	0	111.9	N33 S40	N33-K36 PolarHBondContact O-N 3.18Å; K36-S40 PolarHBondContact O-N 3.03Å
37	D	56.3	Low	63.2	Low	109 Å²	109	125.9 Å²	125.9	58%	0.583	65%	0.645	S	S	*	*	H	α-helix	trans	-75.4	-31.4	-178.8	-59.9	-41.4	0	0	0	112.8	T41	D37-T41 WeakPolarHBondContact O-CG2 3.19Å; D37-T41 PolarHBondContact O-N 2.75Å; D37-T41 PolarHBondContact O-OG1 3.06Å
38	V	58.7	Low	65.8	Low	78 Å²	78	122.4 Å²	122.4	47%	0.473	63%	0.63	S	S	.	*	H	α-helix	trans	-72.1	-33.7	177.8	178.1	0	0	0	0	112.4	A34 T41 K42	A34-V38 WeakPolarHBondContact O-CG2 3.47Å; V38-T41 VanDerWaalsContact CA-OG1 3.25Å; V38-T41 WeakPolarHBondContact CA-OG1 3.25Å; V38-T41 PolarHBondContact O-OG1 3.37Å; V38-K42 WeakPolarHBondContact O-CG 3.47Å; V38-K42 PolarHBondContact O-N 3.18Å
39	V	62.4	Low	68.7	Low	97 Å²	97	119.6 Å²	119.6	59%	0.588	61%	0.613	S	S	*	*	H	α-helix	trans	-73.3	-37.7	177	176.9	0	0	0	0	110.7	M43	V39-M43 WeakPolarHBondContact O-CB 3.4Å; V39-M43 WeakPolarHBondContact O-CG 3.44Å; V39-M43 PolarHBondContact O-N 3.22Å
40	S	72	Confident	71.5	Confident	81 Å²	81	118.1 Å²	118.1	57%	0.566	60%	0.602	S	S	*	*	H	α-helix	trans	-69.9	-34.7	176.9	-166.3	0	0	0	0	113	K36 F44	K36-S40 PolarHBondContact O-N 3.03Å; S40-F44 WeakPolarHBondContact O-CB 3.27Å; S40-F44 PolarHBondContact O-N 2.97Å; S40-F44 VanDerWaalsContact O-N 3.1Å
41	T	81.5	Confident	74.3	Confident	75 Å²	75	113.9 Å²	113.9	46%	0.46	59%	0.589	S	S	.	*	H	α-helix	trans	-71.8	-43.6	177.6	38.8	0	0	0	0	112	D37 V38 M43 F44 E45	D37-T41 WeakPolarHBondContact O-CG2 3.19Å; D37-T41 PolarHBondContact O-N 2.75Å; D37-T41 PolarHBondContact O-OG1 3.06Å; V38-T41 VanDerWaalsContact CA-OG1 3.25Å; V38-T41 WeakPolarHBondContact CA-OG1 3.25Å; V38-T41 PolarHBondContact O-OG1 3.37Å; T41-M43 VanDerWaalsContact C-N 3.35Å; T41-M43 PolarHBondContact O-N 2.84Å; T41-F44 PolarHBondContact O-N 3.41Å; T41-F44 VanDerWaalsContact O-N 3.15Å; T41-E45 WeakPolarHBondContact O-CG 3.44Å; T41-E45 PolarHBondContact O-N 3.49Å
42	K	88.7	Confident	76.8	Confident	141 Å²	141	111.7 Å²	111.7	61%	0.613	57%	0.572	S	S	*	*	H	α-helix	trans	-60.6	-41.4	173.4	-75.1	-175	177.2	-171	0	113.2	V38 F44 E45 E46	V38-K42 WeakPolarHBondContact O-CG 3.47Å; V38-K42 PolarHBondContact O-N 3.18Å; K42-F44 VanDerWaalsContact C-N 3.31Å; K42-F44 PolarHBondContact O-N 2.9Å; K42-E45 PolarHBondContact O-N 3.15Å; K42-E46 WeakPolarHBondContact O-CB 3.48Å; K42-E46 PolarHBondContact O-N 3.43Å
43	M	88.4	Confident	79	Confident	135 Å²	135	108.8 Å²	108.8	67%	0.665	56%	0.555	S	S	*	*	H	α-helix	trans	-63.6	-37.5	175.1	-74	-84.4	-67	0	0	112	V39 T41 L47	V39-M43 WeakPolarHBondContact O-CB 3.4Å; V39-M43 WeakPolarHBondContact O-CG 3.44Å; V39-M43 PolarHBondContact O-N 3.22Å; T41-M43 VanDerWaalsContact C-N 3.35Å; T41-M43 PolarHBondContact O-N 2.84Å; M43-L47 VanDerWaalsContact O-CB 3.28Å; M43-L47 WeakPolarHBondContact O-CB 3.49Å; M43-L47 PolarHBondContact O-N 3.33Å
44	F	89.3	Confident	81.3	Confident	141 Å²	141	108.4 Å²	108.4	62%	0.618	55%	0.553	S	S	*	*	H	α-helix	trans	-71.3	-37.8	177.5	-169.4	-96.2	0	0	0	112.2	S40 T41 K42 L47 K48	S40-F44 WeakPolarHBondContact O-CB 3.27Å; S40-F44 PolarHBondContact O-N 2.97Å; S40-F44 VanDerWaalsContact O-N 3.1Å; T41-F44 PolarHBondContact O-N 3.41Å; T41-F44 VanDerWaalsContact O-N 3.15Å; K42-F44 VanDerWaalsContact C-N 3.31Å; K42-F44 PolarHBondContact O-N 2.9Å; F44-L47 PolarHBondContact O-N 2.85Å; F44-K48 VanDerWaalsContact O-CB 3.27Å; F44-K48 WeakPolarHBondContact O-CB 3.4Å; F44-K48 PolarHBondContact O-N 3.45Å
45	E	93.8	Very high	83.3	Confident	132 Å²	132	108.3 Å²	108.3	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-64.3	-44.5	172.8	-75.5	173.1	179.5	0	0	111.9	T41 K42 K48 S49	T41-E45 WeakPolarHBondContact O-CG 3.44Å; T41-E45 PolarHBondContact O-N 3.49Å; K42-E45 PolarHBondContact O-N 3.15Å; E45-K48 PolarHBondContact O-N 3.1Å; E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 2.93Å
46	E	93.8	Very high	85.5	Confident	94 Å²	94	106.9 Å²	106.9	44%	0.439	55%	0.548	S	S	.	.	H	α-helix	trans	-61.8	-45	174.1	175	64.6	-163	0	0	111.4	K42 K48 S49 R50	K42-E46 WeakPolarHBondContact O-CB 3.48Å; K42-E46 PolarHBondContact O-N 3.43Å; E46-K48 VanDerWaalsContact C-N 3.34Å; E46-K48 PolarHBondContact O-N 3.11Å; E46-S49 WeakPolarHBondContact O-CB 3.5Å; E46-S49 PolarHBondContact O-N 3.36Å; E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 3.5Å; E46-R50 IonicContact OE1-CZ 2.91Å; E46-R50 IonicContact OE1-NE 2.87Å; E46-R50 PolarHBondContact OE1-NE 3.02Å; E46-R50 IonicContact OE1-NH2 3.34Å; E46-R50 PolarHBondContact OE1-NH2 2.85Å
47	L	93.9	Very high	87.8	Confident	111 Å²	111	104.4 Å²	104.4	58%	0.581	54%	0.539	S	S	*	.	H	α-helix	trans	-63.4	-40.8	177.1	-178.2	62.5	0	0	0	111.7	M43 F44 R50 L51	M43-L47 VanDerWaalsContact O-CB 3.28Å; M43-L47 WeakPolarHBondContact O-CB 3.49Å; M43-L47 PolarHBondContact O-N 3.33Å; F44-L47 PolarHBondContact O-N 2.85Å; L47-R50 PolarHBondContact O-N 3.29Å; L47-L51 WeakPolarHBondContact O-CB 3.48Å; L47-L51 PolarHBondContact O-N 2.89Å
48	K	95.8	Very high	89.6	Confident	119 Å²	119	102.4 Å²	102.4	52%	0.517	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-45.3	174.5	179.8	176	177.1	173.9	0	111.1	F44 E45 E46 R50 L51 D52	F44-K48 VanDerWaalsContact O-CB 3.27Å; F44-K48 WeakPolarHBondContact O-CB 3.4Å; F44-K48 PolarHBondContact O-N 3.45Å; E45-K48 PolarHBondContact O-N 3.1Å; E46-K48 VanDerWaalsContact C-N 3.34Å; E46-K48 PolarHBondContact O-N 3.11Å; K48-R50 VanDerWaalsContact C-N 3.3Å; K48-R50 PolarHBondContact O-N 3.39Å; K48-L51 WeakPolarHBondContact O-CB 3.43Å; K48-L51 PolarHBondContact O-N 3.48Å; K48-L51 VanDerWaalsContact O-N 3.11Å; K48-D52 PolarHBondContact O-N 2.93Å
49	S	97.2	Very high	91	Very high	63 Å²	63	101.1 Å²	101.1	44%	0.441	53%	0.528	S	S	.	.	H	α-helix	trans	-57.6	-44.9	176	-172.7	0	0	0	0	111.3	E45 E46 L51 D52 T53	E45-S49 WeakPolarHBondContact O-CB 3.28Å; E45-S49 PolarHBondContact O-N 2.93Å; E46-S49 WeakPolarHBondContact O-CB 3.5Å; E46-S49 PolarHBondContact O-N 3.36Å; S49-L51 VanDerWaalsContact C-N 3.35Å; S49-L51 PolarHBondContact O-N 3.09Å; S49-D52 PolarHBondContact O-N 3.06Å; S49-T53 PolarHBondContact O-N 2.96Å; S49-T53 PolarHBondContact O-OG1 3.36Å; S49-T53 VanDerWaalsContact O-OG1 3.09Å
50	R	96.8	Very high	92.3	Very high	153 Å²	153	101.5 Å²	101.5	58%	0.577	53%	0.526	S	S	*	.	H	α-helix	trans	-64.4	-38.5	176	-70.2	-179.3	-172.6	-143.7	-0.9	112.4	E46 L47 K48 D52 T53 L54	E46-R50 WeakPolarHBondContact O-CG 3.43Å; E46-R50 PolarHBondContact O-N 3.5Å; E46-R50 IonicContact OE1-CZ 2.91Å; E46-R50 IonicContact OE1-NE 2.87Å; E46-R50 PolarHBondContact OE1-NE 3.02Å; E46-R50 IonicContact OE1-NH2 3.34Å; E46-R50 PolarHBondContact OE1-NH2 2.85Å; L47-R50 PolarHBondContact O-N 3.29Å; K48-R50 VanDerWaalsContact C-N 3.3Å; K48-R50 PolarHBondContact O-N 3.39Å; R50-D52 VanDerWaalsContact C-N 3.35Å; R50-T53 PolarHBondContact O-N 3.5Å; R50-L54 WeakPolarHBondContact O-CB 3.42Å; R50-L54 VanDerWaalsContact O-CG 3.3Å; R50-L54 WeakPolarHBondContact O-CG 3.34Å; R50-L54 PolarHBondContact O-N 3.37Å
51	L	96.6	Very high	93	Very high	113 Å²	113	102.4 Å²	102.4	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-63	-43	175.8	-176.1	65.3	0	0	0	111.3	L47 K48 S49 L54 A55	L47-L51 WeakPolarHBondContact O-CB 3.48Å; L47-L51 PolarHBondContact O-N 2.89Å; K48-L51 WeakPolarHBondContact O-CB 3.43Å; K48-L51 PolarHBondContact O-N 3.48Å; K48-L51 VanDerWaalsContact O-N 3.11Å; S49-L51 VanDerWaalsContact C-N 3.35Å; S49-L51 PolarHBondContact O-N 3.09Å; L51-L54 PolarHBondContact O-N 2.97Å; L51-A55 WeakPolarHBondContact O-CB 3.46Å; L51-A55 PolarHBondContact O-N 2.88Å
52	D	97.1	Very high	93.1	Very high	83 Å²	83	105.3 Å²	105.3	44%	0.444	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-42.3	177.8	-68.3	-24.4	0	0	0	111.1	K48 S49 R50 A55 Q56	K48-D52 PolarHBondContact O-N 2.93Å; S49-D52 PolarHBondContact O-N 3.06Å; R50-D52 VanDerWaalsContact C-N 3.35Å; D52-A55 PolarHBondContact O-N 3.33Å; D52-Q56 WeakPolarHBondContact O-CG 3.39Å; D52-Q56 PolarHBondContact O-N 2.91Å
53	T	97.4	Very high	92.6	Very high	62 Å²	62	105.2 Å²	105.2	38%	0.38	53%	0.532	S	S	.	.	H	α-helix	trans	-62.1	-47.9	173.5	-57.8	0	0	0	0	111.9	S49 R50 A55 Q56 E57	S49-T53 PolarHBondContact O-N 2.96Å; S49-T53 PolarHBondContact O-OG1 3.36Å; S49-T53 VanDerWaalsContact O-OG1 3.09Å; R50-T53 PolarHBondContact O-N 3.5Å; T53-A55 VanDerWaalsContact C-N 3.28Å; T53-A55 PolarHBondContact O-N 3.42Å; T53-Q56 WeakPolarHBondContact O-CB 3.3Å; T53-Q56 PolarHBondContact O-N 3.45Å; T53-Q56 VanDerWaalsContact O-N 3.15Å; T53-E57 PolarHBondContact O-N 3.15Å
54	L	96.4	Very high	92.2	Very high	98 Å²	98	103.6 Å²	103.6	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-37.4	177.4	-75.1	172.5	0	0	0	111.7	R50 L51 Q56 E57 V58	R50-L54 WeakPolarHBondContact O-CB 3.42Å; R50-L54 VanDerWaalsContact O-CG 3.3Å; R50-L54 WeakPolarHBondContact O-CG 3.34Å; R50-L54 PolarHBondContact O-N 3.37Å; L51-L54 PolarHBondContact O-N 2.97Å; L54-Q56 VanDerWaalsContact C-N 3.33Å; L54-Q56 PolarHBondContact O-N 3.03Å; L54-E57 PolarHBondContact O-N 3.23Å; L54-V58 WeakPolarHBondContact O-CB 3.23Å; L54-V58 VanDerWaalsContact O-CG2 3.23Å; L54-V58 WeakPolarHBondContact O-CG2 3.36Å; L54-V58 PolarHBondContact O-N 3.43Å
55	A	95.9	Very high	91.8	Very high	59 Å²	59	102.8 Å²	102.8	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-63.2	-40.4	175.7	0	0	0	0	0	111.7	L51 D52 T53 A59	L51-A55 WeakPolarHBondContact O-CB 3.46Å; L51-A55 PolarHBondContact O-N 2.88Å; D52-A55 PolarHBondContact O-N 3.33Å; T53-A55 VanDerWaalsContact C-N 3.28Å; T53-A55 PolarHBondContact O-N 3.42Å; A55-A59 WeakPolarHBondContact O-CB 3.46Å; A55-A59 PolarHBondContact O-N 2.89Å
56	Q	96	Very high	90.8	Very high	144 Å²	144	98.8 Å²	98.8	67%	0.673	51%	0.511	S	S	*	.	H	α-helix	trans	-65.9	-45.7	174.4	-72.8	175.8	-13.8	0	0	112.2	D52 T53 L54 V58 A59 L60	D52-Q56 WeakPolarHBondContact O-CG 3.39Å; D52-Q56 PolarHBondContact O-N 2.91Å; T53-Q56 WeakPolarHBondContact O-CB 3.3Å; T53-Q56 PolarHBondContact O-N 3.45Å; T53-Q56 VanDerWaalsContact O-N 3.15Å; L54-Q56 VanDerWaalsContact C-N 3.33Å; L54-Q56 PolarHBondContact O-N 3.03Å; Q56-V58 PolarHBondContact O-N 3.03Å; Q56-A59 WeakPolarHBondContact O-CB 3.3Å; Q56-A59 PolarHBondContact O-N 3.22Å; Q56-L60 PolarHBondContact O-N 2.86Å
57	E	95.2	Very high	89.9	Confident	104 Å²	104	96 Å²	96	49%	0.486	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-42.9	176.9	-72.6	179.5	179.4	0	0	111.8	T53 L54 A59 L60 L61	T53-E57 PolarHBondContact O-N 3.15Å; L54-E57 PolarHBondContact O-N 3.23Å; E57-A59 VanDerWaalsContact C-N 3.31Å; E57-A59 PolarHBondContact O-N 2.87Å; E57-L60 PolarHBondContact O-N 3.41Å; E57-L61 WeakPolarHBondContact O-CB 3.46Å; E57-L61 VanDerWaalsContact O-CG 3.3Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 3.49Å
58	V	94.8	Very high	89.1	Confident	68 Å²	68	96.5 Å²	96.5	41%	0.412	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-37.4	176	168.7	0	0	0	0	111.4	L54 Q56 K62	L54-V58 WeakPolarHBondContact O-CB 3.23Å; L54-V58 VanDerWaalsContact O-CG2 3.23Å; L54-V58 WeakPolarHBondContact O-CG2 3.36Å; L54-V58 PolarHBondContact O-N 3.43Å; Q56-V58 PolarHBondContact O-N 3.03Å; V58-K62 HydrophobicContact CG1-CD 4.09Å; V58-K62 HydrophobicContact CG1-CG 4.41Å; V58-K62 WeakPolarHBondContact O-CB 3.39Å; V58-K62 VanDerWaalsContact O-CG 3.22Å; V58-K62 WeakPolarHBondContact O-CG 3.3Å; V58-K62 PolarHBondContact O-N 3.02Å
59	A	89.1	Confident	88.3	Confident	51 Å²	51	93.4 Å²	93.4	42%	0.421	49%	0.489	S	S	.	.	H	α-helix	trans	-61.8	-46.4	174.1	0	0	0	0	0	111	A55 Q56 E57 K62 E63	A55-A59 WeakPolarHBondContact O-CB 3.46Å; A55-A59 PolarHBondContact O-N 2.89Å; Q56-A59 WeakPolarHBondContact O-CB 3.3Å; Q56-A59 PolarHBondContact O-N 3.22Å; E57-A59 VanDerWaalsContact C-N 3.31Å; E57-A59 PolarHBondContact O-N 2.87Å; A59-K62 PolarHBondContact O-N 3.22Å; A59-E63 PolarHBondContact O-N 3.41Å
60	L	88.1	Confident	87.4	Confident	105 Å²	105	91.8 Å²	91.8	55%	0.55	48%	0.476	S	S	.	.	H	α-helix	trans	-62.3	-45.4	176.9	-178.7	64.6	0	0	0	112.5	Q56 E57 K62 E63 Q64	Q56-L60 PolarHBondContact O-N 2.86Å; E57-L60 PolarHBondContact O-N 3.41Å; L60-K62 VanDerWaalsContact C-N 3.29Å; L60-K62 PolarHBondContact O-N 3.2Å; L60-E63 PolarHBondContact O-N 3.32Å; L60-Q64 PolarHBondContact O-N 3.44Å
61	L	86.7	Confident	86.8	Confident	100 Å²	100	85.8 Å²	85.8	52%	0.524	46%	0.458	S	S	.	.	H	α-helix	trans	-64	-35.2	179	-71.5	172.2	0	0	0	111.9	E57 Q64 Q65	E57-L61 WeakPolarHBondContact O-CB 3.46Å; E57-L61 VanDerWaalsContact O-CG 3.3Å; E57-L61 WeakPolarHBondContact O-CG 3.48Å; E57-L61 PolarHBondContact O-N 3.49Å; L61-Q64 PolarHBondContact O-N 3.38Å; L61-Q65 VanDerWaalsContact O-CB 3.3Å; L61-Q65 WeakPolarHBondContact O-CB 3.22Å; L61-Q65 PolarHBondContact O-N 3.39Å
62	K	84.4	Confident	86	Confident	135 Å²	135	87.2 Å²	87.2	59%	0.587	47%	0.465	S	S	*	.	H	α-helix	trans	-63.4	-41.9	174.4	-79.2	173.7	176.3	-178.4	0	111.9	V58 A59 L60 Q65 A66	V58-K62 HydrophobicContact CG1-CD 4.09Å; V58-K62 HydrophobicContact CG1-CG 4.41Å; V58-K62 WeakPolarHBondContact O-CB 3.39Å; V58-K62 VanDerWaalsContact O-CG 3.22Å; V58-K62 WeakPolarHBondContact O-CG 3.3Å; V58-K62 PolarHBondContact O-N 3.02Å; A59-K62 PolarHBondContact O-N 3.22Å; L60-K62 VanDerWaalsContact C-N 3.29Å; L60-K62 PolarHBondContact O-N 3.2Å; K62-Q65 PolarHBondContact O-N 2.93Å; K62-A66 WeakPolarHBondContact O-CB 3.28Å; K62-A66 PolarHBondContact O-N 2.91Å
63	E	78.1	Confident	85.5	Confident	139 Å²	139	90.8 Å²	90.8	65%	0.65	48%	0.477	S	S	*	.	H	α-helix	trans	-64.3	-44.3	175	-65	-56.4	142.5	0	0	111.5	A59 L60 Q65 A66 L67	A59-E63 PolarHBondContact O-N 3.41Å; L60-E63 PolarHBondContact O-N 3.32Å; E63-Q65 VanDerWaalsContact C-N 3.34Å; E63-Q65 PolarHBondContact O-N 2.97Å; E63-A66 WeakPolarHBondContact O-CB 3.38Å; E63-A66 PolarHBondContact O-N 2.86Å; E63-L67 PolarHBondContact O-N 3.07Å
64	Q	79.7	Confident	85.1	Confident	102 Å²	102	88.6 Å²	88.6	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-61.5	-41.1	175.5	-71.3	-178.8	-14.6	0	0	112.3	L60 L61 A66 L67 Q68	L60-Q64 PolarHBondContact O-N 3.44Å; L61-Q64 PolarHBondContact O-N 3.38Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; Q64-L67 PolarHBondContact O-N 2.93Å; Q64-Q68 PolarHBondContact O-N 2.86Å; Q64-Q68 VanDerWaalsContact O-N 3.14Å
65	Q	80.9	Confident	84.8	Confident	123 Å²	123	85.8 Å²	85.8	58%	0.575	45%	0.454	S	S	*	.	H	α-helix	trans	-68.9	-32.2	177.2	-171.7	175.8	4.6	0	0	112.3	L61 K62 E63 Q68 T69	L61-Q65 VanDerWaalsContact O-CB 3.3Å; L61-Q65 WeakPolarHBondContact O-CB 3.22Å; L61-Q65 PolarHBondContact O-N 3.39Å; K62-Q65 PolarHBondContact O-N 2.93Å; E63-Q65 VanDerWaalsContact C-N 3.34Å; E63-Q65 PolarHBondContact O-N 2.97Å; Q65-Q68 PolarHBondContact O-N 3.07Å; Q65-T69 WeakPolarHBondContact O-CB 3.32Å; Q65-T69 PolarHBondContact O-N 3.33Å; Q65-T69 PolarHBondContact O-OG1 3.18Å
66	A	73.2	Confident	84.5	Confident	48 Å²	48	89.1 Å²	89.1	40%	0.397	46%	0.457	S	S	.	.	H	α-helix	trans	-62.7	-46.2	175.6	0	0	0	0	0	111.1	K62 E63 Q64 Q68 T69 V70	K62-A66 WeakPolarHBondContact O-CB 3.28Å; K62-A66 PolarHBondContact O-N 2.91Å; E63-A66 WeakPolarHBondContact O-CB 3.38Å; E63-A66 PolarHBondContact O-N 2.86Å; Q64-A66 VanDerWaalsContact C-N 3.34Å; A66-Q68 PolarHBondContact O-N 3.21Å; A66-T69 WeakPolarHBondContact O-CB 3.34Å; A66-T69 PolarHBondContact O-N 2.83Å; A66-T69 VanDerWaalsContact O-N 3.16Å; A66-V70 WeakPolarHBondContact O-CG2 3.47Å; A66-V70 PolarHBondContact O-N 3.06Å
67	L	75	Confident	84.2	Confident	37 Å²	37	83 Å²	83	19%	0.194	43%	0.43	C	S	.	.	H	α-helix	trans	-61.2	-44.5	174.7	179.8	65.3	0	0	0	111.8	E63 Q64 T69 V70 C71 F199 V202	E63-L67 PolarHBondContact O-N 3.07Å; Q64-L67 PolarHBondContact O-N 2.93Å; L67-T69 VanDerWaalsContact C-N 3.29Å; L67-T69 PolarHBondContact O-N 3.49Å; L67-V70 WeakPolarHBondContact O-CB 3.35Å; L67-V70 PolarHBondContact O-N 2.6Å; L67-C71 PolarHBondContact O-N 2.93Å; L67-C71 PolarHBondContact O-SG 2.88Å; L67-F199 HydrophobicContact CD1-CB 3.99Å; L67-V202 HydrophobicContact CD2-CG2 4.37Å
68	Q	77.3	Confident	83.5	Confident	121 Å²	121	85.5 Å²	85.5	57%	0.565	44%	0.441	S	S	*	.	H	α-helix	trans	-57.4	-44.2	173.9	-74.2	-179.6	-9.7	0	0	111.3	Q64 Q65 A66 V70 C71 L72	Q64-Q68 PolarHBondContact O-N 2.86Å; Q64-Q68 VanDerWaalsContact O-N 3.14Å; Q65-Q68 PolarHBondContact O-N 3.07Å; A66-Q68 PolarHBondContact O-N 3.21Å; Q68-V70 VanDerWaalsContact C-N 3.34Å; Q68-V70 PolarHBondContact O-N 3.23Å; Q68-C71 PolarHBondContact O-N 2.78Å; Q68-L72 HydrophobicContact CB-CD1 4.31Å; Q68-L72 WeakPolarHBondContact O-CB 3.42Å; Q68-L72 WeakPolarHBondContact O-CD1 3.15Å; Q68-L72 PolarHBondContact O-N 3.47Å
69	T	79.3	Confident	83.1	Confident	54 Å²	54	87 Å²	87	33%	0.331	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-38.6	179.4	-55.9	0	0	0	0	112.2	Q65 A66 L67 L72 K73	Q65-T69 WeakPolarHBondContact O-CB 3.32Å; Q65-T69 PolarHBondContact O-N 3.33Å; Q65-T69 PolarHBondContact O-OG1 3.18Å; A66-T69 WeakPolarHBondContact O-CB 3.34Å; A66-T69 PolarHBondContact O-N 2.83Å; A66-T69 VanDerWaalsContact O-N 3.16Å; L67-T69 VanDerWaalsContact C-N 3.29Å; L67-T69 PolarHBondContact O-N 3.49Å; T69-L72 PolarHBondContact O-N 2.88Å; T69-K73 HydrophobicContact CG2-CD 4.24Å; T69-K73 WeakPolarHBondContact O-CG 3.41Å; T69-K73 PolarHBondContact O-N 3.5Å
70	V	78.3	Confident	83.2	Confident	28 Å²	28	85.8 Å²	85.8	17%	0.17	43%	0.43	C	S	.	.	H	α-helix	trans	-61.3	-49.1	173.6	169.9	0	0	0	0	110.6	A66 L67 Q68 L72 K73 G74 C81 L83 F199	A66-V70 WeakPolarHBondContact O-CG2 3.47Å; A66-V70 PolarHBondContact O-N 3.06Å; L67-V70 WeakPolarHBondContact O-CB 3.35Å; L67-V70 PolarHBondContact O-N 2.6Å; Q68-V70 VanDerWaalsContact C-N 3.34Å; Q68-V70 PolarHBondContact O-N 3.23Å; V70-L72 VanDerWaalsContact C-N 3.28Å; V70-L72 PolarHBondContact O-N 3.47Å; V70-K73 PolarHBondContact O-N 3.21Å; V70-G74 WeakPolarHBondContact O-CA 3.45Å; V70-G74 PolarHBondContact O-N 3.42Å; V70-C81 HydrophobicContact CG1-CB 4.42Å; V70-L83 HydrophobicContact CG1-CB 4.04Å; V70-L83 HydrophobicContact CG1-CD2 4.21Å; V70-L83 HydrophobicContact CG2-CD2 4.34Å; V70-F199 HydrophobicContact CG1-CD2 3.39Å; V70-F199 HydrophobicContact CG1-CE2 3.64Å; V70-F199 HydrophobicContact CG1-CG 3.95Å; V70-F199 HydrophobicContact CG1-CZ 4.39Å
71	C	82.8	Confident	83.4	Confident	27 Å²	27	80.8 Å²	80.8	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-64.1	-31.8	177	-57.2	0	0	0	0	113.2	L67 Q68 C81	L67-C71 PolarHBondContact O-N 2.93Å; L67-C71 PolarHBondContact O-SG 2.88Å; Q68-C71 PolarHBondContact O-N 2.78Å; C71-C81 HydrophobicContact CB-CB 3.89Å; C71-C81 WeakPolarHBondContact CB-SG 3.48Å; C71-C81 WeakPolarHBondContact SG-CB 3.38Å; C71-C81 CovalentContact SG-SG 2.01Å; C71-C81 PolarHBondContact SG-SG 3.5Å
72	L	79.6	Confident	83.8	Confident	143 Å²	143	76 Å²	76	75%	0.749	38%	0.379	S	S	*	.	H	α-helix	trans	-73.1	-38.4	178.3	-97.1	129.8	0	0	0	112.8	Q68 T69 V70	Q68-L72 HydrophobicContact CB-CD1 4.31Å; Q68-L72 WeakPolarHBondContact O-CB 3.42Å; Q68-L72 WeakPolarHBondContact O-CD1 3.15Å; Q68-L72 PolarHBondContact O-N 3.47Å; T69-L72 PolarHBondContact O-N 2.88Å; V70-L72 VanDerWaalsContact C-N 3.28Å; V70-L72 PolarHBondContact O-N 3.47Å
73	K	86.8	Confident	84.4	Confident	158 Å²	158	71 Å²	71	69%	0.687	36%	0.358	S	S	*	.	H	α-helix	trans	-83.4	-25.8	176.4	-70.6	-178.8	178.1	-178.4	0	112.8	T69 V70 L83	T69-K73 HydrophobicContact CG2-CD 4.24Å; T69-K73 WeakPolarHBondContact O-CG 3.41Å; T69-K73 PolarHBondContact O-N 3.5Å; V70-K73 PolarHBondContact O-N 3.21Å; K73-L83 HydrophobicContact CB-CD1 3.98Å
74	G	88.6	Confident	85.4	Confident	17 Å²	17	65.3 Å²	65.3	18%	0.175	34%	0.335	C	S	.	.	S	Bend	trans	-92	-148.7	-178.2	0	0	0	0	0	113.3	V70 F82 Y120	V70-G74 WeakPolarHBondContact O-CA 3.45Å; V70-G74 PolarHBondContact O-N 3.42Å; G74-F82 CarbonylContact C-O 3.5Å; G74-F82 WeakPolarHBondContact CA-O 3.04Å; G74-Y120 WeakPolarHBondContact CA-OH 3.14Å
75	T	90.9	Very high	86.2	Confident	39 Å²	39	62.2 Å²	62.2	24%	0.239	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.1	162.7	-171.9	0	0	0	0	110	V77 C81 F82 Y120	T75-V77 HydrophobicContact CG2-CG2 4.37Å; T75-C81 CarbonylContact O-C 3.58Å; T75-C81 WeakPolarHBondContact O-CA 3.4Å; T75-F82 HydrophobicContact CG2-CB 3.87Å; T75-F82 HydrophobicContact CG2-CD2 4.08Å; T75-F82 HydrophobicContact CG2-CG 4.46Å; T75-F82 PolarHBondContact N-O 3.45Å; T75-F82 PolarHBondContact O-N 2.96Å; T75-Y120 HydrophobicContact CG2-CD1 3.77Å; T75-Y120 HydrophobicContact CG2-CD2 3.88Å; T75-Y120 HydrophobicContact CG2-CE1 4.48Å; T75-Y120 HydrophobicContact CG2-CG 3.45Å; T75-Y120 VanDerWaalsContact CG2-CG 3.45Å
76	K	90.8	Very high	87	Confident	128 Å²	128	61 Å²	61	56%	0.557	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.2	174.1	173.9	176	170.8	172.6	0	109.4	H78 K80 I201	K76-H78 WeakPolarHBondContact CE-O 3.44Å; K76-K80 WeakPolarHBondContact CA-O 3.25Å; K76-I201 HydrophobicContact CD-CD1 3.72Å; K76-I201 HydrophobicContact CG-CD1 3.98Å
77	V	88.1	Confident	88.2	Confident	17 Å²	17	65 Å²	65	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	111.3	174.3	-171.4	0	0	0	0	107.9	T75 M79 K80 F82 E113 A116	T75-V77 HydrophobicContact CG2-CG2 4.37Å; V77-M79 PolarHBondContact O-N 3.38Å; V77-M79 VanDerWaalsContact O-N 3.08Å; V77-K80 PolarHBondContact N-O 3.14Å; V77-K80 PolarHBondContact O-N 2.86Å; V77-K80 VanDerWaalsContact O-O 3.11Å; V77-F82 HydrophobicContact CB-CD2 4.42Å; V77-F82 HydrophobicContact CB-CE2 3.96Å; V77-F82 HydrophobicContact CG2-CD2 3.93Å; V77-F82 HydrophobicContact CG2-CE2 3.83Å; V77-E113 HydrophobicContact CG1-CG 4.2Å; V77-A116 HydrophobicContact CB-CB 4.41Å; V77-A116 HydrophobicContact CG1-CB 4.08Å; V77-A116 HydrophobicContact CG2-CB 3.41Å; V77-A116 VanDerWaalsContact CG2-CB 3.41Å
78	H	81.4	Confident	89.3	Confident	155 Å²	155	65.6 Å²	65.6	72%	0.718	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	-113.2	-176.3	-164.2	74.2	0	0	0	112.4	K76	K76-H78 WeakPolarHBondContact CE-O 3.44Å
79	M	85.4	Confident	90.4	Very high	99 Å²	99	61.9 Å²	61.9	49%	0.488	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	16.8	-179.5	-68.1	-60.2	-68.6	0	0	113	V77 I201	V77-M79 PolarHBondContact O-N 3.38Å; V77-M79 VanDerWaalsContact O-N 3.08Å; M79-I201 HydrophobicContact CE-CB 4.04Å; M79-I201 HydrophobicContact CE-CG2 4.17Å; M79-I201 VanDerWaalsContact CE-O 3.25Å; M79-I201 WeakPolarHBondContact CE-O 3.43Å; M79-I201 PolarHBondContact O-N 3.4Å
80	K	91	Very high	91.3	Very high	27 Å²	27	60.9 Å²	60.9	12%	0.117	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.2	178.2	-63.1	173.5	-174.6	164.5	0	110.5	K76 V77 F82 E113 F199	K76-K80 WeakPolarHBondContact CA-O 3.25Å; V77-K80 PolarHBondContact N-O 3.14Å; V77-K80 PolarHBondContact O-N 2.86Å; V77-K80 VanDerWaalsContact O-O 3.11Å; K80-F82 HydrophobicContact CB-CE2 4.3Å; K80-F82 HydrophobicContact CB-CZ 4.35Å; K80-F82 HydrophobicContact CD-CZ 4.3Å; K80-E113 IonicContact NZ-OE1 3.54Å; K80-E113 PolarHBondContact NZ-OE1 3.36Å; K80-E113 IonicContact NZ-OE2 3.63Å; K80-E113 PolarHBondContact NZ-OE2 2.96Å; K80-F199 CarbonylContact C-O 3.53Å; K80-F199 WeakPolarHBondContact CA-O 3.43Å
81	C	93.8	Very high	92.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.2	167.5	-64.2	0	0	0	0	109.7	V70 C71 T75 Q198 F199	V70-C81 HydrophobicContact CG1-CB 4.42Å; C71-C81 HydrophobicContact CB-CB 3.89Å; C71-C81 WeakPolarHBondContact CB-SG 3.48Å; C71-C81 WeakPolarHBondContact SG-CB 3.38Å; C71-C81 CovalentContact SG-SG 2.01Å; C71-C81 PolarHBondContact SG-SG 3.5Å; T75-C81 CarbonylContact O-C 3.58Å; T75-C81 WeakPolarHBondContact O-CA 3.4Å; C81-Q198 CarbonylContact O-C 3.43Å; C81-Q198 VanDerWaalsContact O-CA 3.29Å; C81-Q198 WeakPolarHBondContact O-CA 3.3Å; C81-F199 PolarHBondContact N-O 3.23Å; C81-F199 PolarHBondContact O-N 3.17Å
82	F	95.4	Very high	93	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.3	-179.6	-64.8	-76.2	0	0	0	110.1	G74 T75 V77 K80 L117 Y120 I196 C197 Q198	G74-F82 CarbonylContact C-O 3.5Å; G74-F82 WeakPolarHBondContact CA-O 3.04Å; T75-F82 HydrophobicContact CG2-CB 3.87Å; T75-F82 HydrophobicContact CG2-CD2 4.08Å; T75-F82 HydrophobicContact CG2-CG 4.46Å; T75-F82 PolarHBondContact N-O 3.45Å; T75-F82 PolarHBondContact O-N 2.96Å; V77-F82 HydrophobicContact CB-CD2 4.42Å; V77-F82 HydrophobicContact CB-CE2 3.96Å; V77-F82 HydrophobicContact CG2-CD2 3.93Å; V77-F82 HydrophobicContact CG2-CE2 3.83Å; K80-F82 HydrophobicContact CB-CE2 4.3Å; K80-F82 HydrophobicContact CB-CZ 4.35Å; K80-F82 HydrophobicContact CD-CZ 4.3Å; F82-L117 HydrophobicContact CB-CD1 4.37Å; F82-L117 HydrophobicContact CD1-CD1 3.82Å; F82-L117 HydrophobicContact CE1-CD1 4.21Å; F82-L117 HydrophobicContact CG-CD1 4.04Å; F82-Y120 HydrophobicContact CB-CD1 4.14Å; F82-Y120 HydrophobicContact CB-CE1 4.28Å; F82-Y120 WeakPolarHBondContact O-CE1 3.37Å; F82-I196 HydrophobicContact CB-CG2 3.76Å; F82-I196 HydrophobicContact CD1-CG2 4.2Å; F82-I196 HydrophobicContact CG-CG2 4.42Å; F82-C197 CarbonylContact C-O 3.1Å; F82-C197 VanDerWaalsContact CA-O 3.25Å; F82-C197 WeakPolarHBondContact CA-O 3.1Å; F82-Q198 HydrophobicContact CD1-CB 3.66Å; F82-Q198 HydrophobicContact CE1-CB 3.52Å; F82-Q198 HydrophobicContact CZ-CB 4.49Å
83	L	96.8	Very high	93.9	Very high	29 Å²	29	61.7 Å²	61.7	15%	0.152	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	125.1	178.1	-176	66	0	0	0	110.5	V70 K73 F85 I196 C197 F199	V70-L83 HydrophobicContact CG1-CB 4.04Å; V70-L83 HydrophobicContact CG1-CD2 4.21Å; V70-L83 HydrophobicContact CG2-CD2 4.34Å; K73-L83 HydrophobicContact CB-CD1 3.98Å; L83-F85 HydrophobicContact CB-CE2 4.32Å; L83-F85 HydrophobicContact CD2-CE2 4.17Å; L83-F85 HydrophobicContact CD2-CZ 3.76Å; L83-F85 HydrophobicContact CG-CE2 4.1Å; L83-F85 HydrophobicContact CG-CZ 4.13Å; L83-F85 WeakPolarHBondContact O-CD2 3.44Å; L83-F85 WeakPolarHBondContact O-CE2 3.34Å; L83-I196 WeakPolarHBondContact O-CA 3.33Å; L83-C197 PolarHBondContact N-O 3.34Å; L83-C197 PolarHBondContact O-N 3.47Å; L83-F199 HydrophobicContact CB-CE2 4Å
84	A	97.6	Very high	94.5	Very high	19 Å²	19	54.2 Å²	54.2	16%	0.157	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	145.3	-176.4	0	0	0	0	0	113.4	Y120 S124 V125 I196	A84-Y120 HydrophobicContact CB-CE1 3.82Å; A84-Y120 PolarHBondContact N-OH 2.91Å; A84-Y120 VanDerWaalsContact N-OH 3.12Å; A84-S124 VanDerWaalsContact CB-OG 3.24Å; A84-S124 WeakPolarHBondContact CB-OG 3.3Å; A84-V125 HydrophobicContact CB-CG2 3.86Å; A84-I196 HydrophobicContact CB-CD1 4.07Å; A84-I196 HydrophobicContact CB-CG1 3.86Å
85	F	97.9	Very high	95	Very high	38 Å²	38	53.7 Å²	53.7	17%	0.167	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	115.7	175.4	-63.5	-89	0	0	0	108.9	L83 P194 Y195 C197	L83-F85 HydrophobicContact CB-CE2 4.32Å; L83-F85 HydrophobicContact CD2-CE2 4.17Å; L83-F85 HydrophobicContact CD2-CZ 3.76Å; L83-F85 HydrophobicContact CG-CE2 4.1Å; L83-F85 HydrophobicContact CG-CZ 4.13Å; L83-F85 WeakPolarHBondContact O-CD2 3.44Å; L83-F85 WeakPolarHBondContact O-CE2 3.34Å; F85-P194 WeakPolarHBondContact O-CA 3.32Å; F85-P194 WeakPolarHBondContact O-CB 3.38Å; F85-Y195 HydrophobicContact CB-CD1 4.26Å; F85-Y195 HydrophobicContact CB-CD2 4.11Å; F85-Y195 HydrophobicContact CB-CE1 3.82Å; F85-Y195 HydrophobicContact CB-CE2 3.68Å; F85-Y195 HydrophobicContact CB-CG 4.38Å; F85-Y195 VanDerWaalsContact CB-CZ 3.5Å; F85-Y195 HydrophobicContact CD2-CD2 4.08Å; F85-Y195 AromaticContact CD2-CE2 3.68Å; F85-Y195 HydrophobicContact CD2-CE2 3.68Å; F85-Y195 HydrophobicContact CG-CD2 4.41Å; F85-Y195 AromaticContact CG-CE2 3.77Å; F85-Y195 HydrophobicContact CG-CE2 3.77Å; F85-Y195 AromaticContact CG-CZ 3.92Å; F85-Y195 PolarHBondContact N-O 3.48Å; F85-Y195 PolarHBondContact O-N 2.91Å; F85-Y195 VanDerWaalsContact O-N 3.08Å; F85-C197 HydrophobicContact CE2-CB 4.04Å; F85-C197 WeakPolarHBondContact CE2-SG 3.38Å
86	T	97.8	Very high	95.4	Very high	98 Å²	98	57.6 Å²	57.6	60%	0.601	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	-12.1	-174.6	55.3	0	0	0	0	113.7	A88 V125	T86-A88 PolarHBondContact O-N 2.97Å; T86-A88 VanDerWaalsContact O-N 3.13Å; T86-V125 HydrophobicContact CG2-CG1 4.41Å
87	Q	98.1	Very high	95.7	Very high	131 Å²	131	52.8 Å²	52.8	61%	0.612	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	108.5	172.8	-178.9	179.8	67	0	0	108.9	Y195	Q87-Y195 WeakPolarHBondContact O-CE1 3.09Å
88	A	98.4	Very high	96.2	Very high	50 Å²	50	52 Å²	52	41%	0.413	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	137.2	-178.3	0	0	0	0	0	112.4	T86 P192 L193	T86-A88 PolarHBondContact O-N 2.97Å; T86-A88 VanDerWaalsContact O-N 3.13Å; A88-P192 HydrophobicContact CB-CB 4.02Å; A88-L193 VanDerWaalsContact CA-O 3.31Å; A88-L193 WeakPolarHBondContact CA-O 3.35Å
89	K	98.8	Very high	97	Very high	42 Å²	42	48.4 Å²	48.4	18%	0.183	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	158	179.9	-71.2	-174	-166.6	-63.4	0	110.2	E93 A94 D97 W132 L193 Y195	K89-E93 HydrophobicContact CB-CB 3.94Å; K89-E93 HydrophobicContact CD-CB 4.14Å; K89-E93 HydrophobicContact CG-CB 4.35Å; K89-A94 HydrophobicContact CB-CB 4.11Å; K89-D97 HydrophobicContact CD-CB 4.43Å; K89-W132 PolarHBondContact O-NE1 3.47Å; K89-L193 PolarHBondContact N-O 3.03Å; K89-L193 PolarHBondContact O-N 3.48Å; K89-Y195 HydrophobicContact CB-CD1 4.38Å; K89-Y195 HydrophobicContact CB-CE1 4.1Å; K89-Y195 HydrophobicContact CD-CE1 3.62Å; K89-Y195 WeakPolarHBondContact CE-OH 3.48Å; K89-Y195 HydrophobicContact CG-CE1 3.89Å
90	T	98.9	Very high	97.5	Very high	34 Å²	34	48 Å²	48	21%	0.209	26%	0.258	C	S	.	.			trans	-64.2	160.5	166.2	64.5	0	0	0	0	110.3	H92 E93 A94 R190 D191	T90-H92 VanDerWaalsContact C-N 3.28Å; T90-H92 PolarHBondContact O-N 3.47Å; T90-E93 WeakPolarHBondContact CB-OE2 3.25Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.05Å; T90-E93 PolarHBondContact N-OE2 3.39Å; T90-E93 PolarHBondContact O-N 3.41Å; T90-E93 WeakPolarHBondContact OG1-CB 3.16Å; T90-E93 WeakPolarHBondContact OG1-CG 3.42Å; T90-E93 PolarHBondContact OG1-N 3.4Å; T90-E93 PolarHBondContact OG1-OE2 2.9Å; T90-A94 WeakPolarHBondContact O-CB 3.47Å; T90-A94 PolarHBondContact O-N 3.33Å; T90-R190 WeakPolarHBondContact CG2-O 3.45Å; T90-D191 WeakPolarHBondContact CA-O 3.37Å
91	F	98.9	Very high	97.6	Very high	5 Å²	5	52.7 Å²	52.7	2%	0.022	28%	0.275	C	S	.	.	H	α-helix	trans	-52.9	-46.1	-179.2	176.7	-88.1	0	0	0	112.4	A94 S95 L105 W132 L133 N136 M138 M147 C173 C189	F91-A94 PolarHBondContact O-N 3.36Å; F91-S95 WeakPolarHBondContact O-CB 3.36Å; F91-S95 PolarHBondContact O-N 2.85Å; F91-L105 HydrophobicContact CD2-CD1 4.22Å; F91-L105 HydrophobicContact CE2-CD1 3.98Å; F91-L105 HydrophobicContact CZ-CD1 4.2Å; F91-W132 HydrophobicContact CB-CD2 4.12Å; F91-W132 HydrophobicContact CB-CE3 4.34Å; F91-W132 HydrophobicContact CB-CH2 4.47Å; F91-W132 HydrophobicContact CB-CZ2 4.18Å; F91-W132 AromaticContact CD2-CD2 3.98Å; F91-W132 HydrophobicContact CD2-CD2 3.98Å; F91-W132 AromaticContact CD2-CE3 3.75Å; F91-W132 HydrophobicContact CD2-CE3 3.75Å; F91-W132 HydrophobicContact CD2-CG 4.33Å; F91-W132 HydrophobicContact CD2-CZ3 4.34Å; F91-L133 WeakPolarHBondContact CE2-O 3.43Å; F91-N136 HydrophobicContact CZ-CB 4.21Å; F91-M138 HydrophobicContact CD1-CE 3.76Å; F91-M138 HydrophobicContact CE1-CE 3.86Å; F91-M147 HydrophobicContact CE1-SD 4.5Å; F91-M147 HydrophobicContact CZ-SD 4.04Å; F91-C173 HydrophobicContact CB-CB 4.38Å; F91-C173 HydrophobicContact CD2-CB 3.7Å; F91-C173 WeakPolarHBondContact CD2-SG 3.33Å; F91-C173 HydrophobicContact CE2-CB 4.13Å; F91-C173 HydrophobicContact CG-CB 4.12Å; F91-C173 WeakPolarHBondContact CG-SG 3.47Å; F91-C189 HydrophobicContact CB-CB 4.11Å; F91-C189 WeakPolarHBondContact CB-O 3.49Å; F91-C189 PolarHBondContact N-O 2.97Å
92	H	98.7	Very high	97.5	Very high	102 Å²	102	55.9 Å²	55.9	47%	0.472	31%	0.308	S	S	.	.	H	α-helix	trans	-67.4	-42.7	-178.8	-63.3	-69.1	0	0	0	112	T90 A94 S95 E96 M138	T90-H92 VanDerWaalsContact C-N 3.28Å; T90-H92 PolarHBondContact O-N 3.47Å; H92-A94 VanDerWaalsContact C-N 3.35Å; H92-A94 PolarHBondContact O-N 3.22Å; H92-S95 WeakPolarHBondContact O-CB 3.34Å; H92-S95 PolarHBondContact O-N 3.01Å; H92-E96 WeakPolarHBondContact O-CG 3.26Å; H92-E96 PolarHBondContact O-N 2.75Å; H92-M138 WeakPolarHBondContact CE1-CE 3.41Å
93	E	98.8	Very high	97.5	Very high	108 Å²	108	56.3 Å²	56.3	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-65.2	-38.6	176.8	-70.5	167.6	145.8	0	0	112.2	K89 T90 D97	K89-E93 HydrophobicContact CB-CB 3.94Å; K89-E93 HydrophobicContact CD-CB 4.14Å; K89-E93 HydrophobicContact CG-CB 4.35Å; T90-E93 WeakPolarHBondContact CB-OE2 3.25Å; T90-E93 WeakPolarHBondContact CG2-OE2 3.05Å; T90-E93 PolarHBondContact N-OE2 3.39Å; T90-E93 PolarHBondContact O-N 3.41Å; T90-E93 WeakPolarHBondContact OG1-CB 3.16Å; T90-E93 WeakPolarHBondContact OG1-CG 3.42Å; T90-E93 PolarHBondContact OG1-N 3.4Å; T90-E93 PolarHBondContact OG1-OE2 2.9Å; E93-D97 WeakPolarHBondContact O-CB 3.48Å; E93-D97 PolarHBondContact O-N 2.8Å
94	A	98.8	Very high	97.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-65.9	-42.5	175.6	0	0	0	0	0	111.6	K89 T90 F91 H92 D97 C98 L105 Y195	K89-A94 HydrophobicContact CB-CB 4.11Å; T90-A94 WeakPolarHBondContact O-CB 3.47Å; T90-A94 PolarHBondContact O-N 3.33Å; F91-A94 PolarHBondContact O-N 3.36Å; H92-A94 VanDerWaalsContact C-N 3.35Å; H92-A94 PolarHBondContact O-N 3.22Å; A94-D97 PolarHBondContact O-N 3.29Å; A94-C98 PolarHBondContact O-N 3.16Å; A94-C98 PolarHBondContact O-SG 3.07Å; A94-C98 VanDerWaalsContact O-SG 3.38Å; A94-L105 HydrophobicContact CB-CD2 4.04Å; A94-Y195 HydrophobicContact CB-CD1 3.68Å; A94-Y195 HydrophobicContact CB-CD2 4Å; A94-Y195 HydrophobicContact CB-CE1 4.19Å; A94-Y195 HydrophobicContact CB-CE2 4.45Å; A94-Y195 HydrophobicContact CB-CG 3.59Å
95	S	98.6	Very high	97.6	Very high	6 Å²	6	56.2 Å²	56.2	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-53.1	173.3	174	0	0	0	0	111.9	F91 H92 D97 C98 I99 M147	F91-S95 WeakPolarHBondContact O-CB 3.36Å; F91-S95 PolarHBondContact O-N 2.85Å; H92-S95 WeakPolarHBondContact O-CB 3.34Å; H92-S95 PolarHBondContact O-N 3.01Å; S95-D97 VanDerWaalsContact C-N 3.31Å; S95-D97 PolarHBondContact O-N 2.75Å; S95-C98 PolarHBondContact O-N 2.92Å; S95-I99 WeakPolarHBondContact O-CG1 3.34Å; S95-I99 PolarHBondContact O-N 3.43Å; S95-M147 WeakPolarHBondContact OG-CE 3.01Å
96	E	98.6	Very high	97.5	Very high	122 Å²	122	54.5 Å²	54.5	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-62.1	-38.4	179.5	-70.4	-57.7	119.4	0	0	112	H92 I99 S100	H92-E96 WeakPolarHBondContact O-CG 3.26Å; H92-E96 PolarHBondContact O-N 2.75Å; E96-I99 PolarHBondContact O-N 3.13Å; E96-S100 WeakPolarHBondContact O-CB 3.49Å; E96-S100 PolarHBondContact O-N 3.23Å
97	D	98.6	Very high	97.5	Very high	27 Å²	27	50.2 Å²	50.2	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-44	175.6	-175.8	78.8	0	0	0	111.4	K89 E93 A94 S95 I99 S100 R101 Y195	K89-D97 HydrophobicContact CD-CB 4.43Å; E93-D97 WeakPolarHBondContact O-CB 3.48Å; E93-D97 PolarHBondContact O-N 2.8Å; A94-D97 PolarHBondContact O-N 3.29Å; S95-D97 VanDerWaalsContact C-N 3.31Å; S95-D97 PolarHBondContact O-N 2.75Å; D97-I99 PolarHBondContact O-N 3.17Å; D97-S100 PolarHBondContact O-N 3.49Å; D97-S100 PolarHBondContact O-OG 2.95Å; D97-R101 VanDerWaalsContact O-CG 3.3Å; D97-R101 WeakPolarHBondContact O-CG 3.29Å; D97-R101 PolarHBondContact O-N 3.16Å; D97-R101 IonicContact OD1-CZ 3.02Å; D97-R101 IonicContact OD1-NE 3.51Å; D97-R101 PolarHBondContact OD1-NE 2.81Å; D97-R101 IonicContact OD1-NH2 3.39Å; D97-R101 PolarHBondContact OD1-NH2 2.91Å; D97-R101 IonicContact OD2-CZ 3.4Å; D97-R101 IonicContact OD2-NE 2.85Å; D97-R101 PolarHBondContact OD2-NE 3.31Å; D97-R101 IonicContact OD2-NH2 2.8Å; D97-R101 PolarHBondContact OD2-NH2 2.86Å; D97-Y195 HydrophobicContact CB-CE2 4.24Å; D97-Y195 WeakPolarHBondContact OD2-CE2 3.22Å; D97-Y195 PolarHBondContact OD2-OH 3.26Å
98	C	98.1	Very high	97.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-42.7	174.8	-67	0	0	0	0	112.5	A94 S95 R101 G102 G103 T104 C197	A94-C98 PolarHBondContact O-N 3.16Å; A94-C98 PolarHBondContact O-SG 3.07Å; A94-C98 VanDerWaalsContact O-SG 3.38Å; S95-C98 PolarHBondContact O-N 2.92Å; C98-R101 PolarHBondContact O-N 2.79Å; C98-G102 PolarHBondContact O-N 2.85Å; C98-G103 CarbonylContact C-O 3.46Å; C98-G103 CarbonylContact O-C 3.56Å; C98-G103 WeakPolarHBondContact O-CA 3.04Å; C98-G103 PolarHBondContact O-N 2.01Å; C98-T104 VanDerWaalsContact CB-C 3.49Å; C98-C197 WeakPolarHBondContact CA-SG 3.42Å; C98-C197 HydrophobicContact CB-CB 3.75Å; C98-C197 WeakPolarHBondContact CB-SG 3.49Å; C98-C197 WeakPolarHBondContact SG-CA 3.45Å; C98-C197 WeakPolarHBondContact SG-CB 3.43Å; C98-C197 CovalentContact SG-SG 2.03Å; C98-C197 PolarHBondContact SG-SG 3.05Å
99	I	97.2	Very high	97.3	Very high	80 Å²	80	47.1 Å²	47.1	41%	0.41	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-44.7	177.6	-68.8	166.2	0	0	0	110.8	S95 E96 D97 R101 G102 G103	S95-I99 WeakPolarHBondContact O-CG1 3.34Å; S95-I99 PolarHBondContact O-N 3.43Å; E96-I99 PolarHBondContact O-N 3.13Å; D97-I99 PolarHBondContact O-N 3.17Å; I99-R101 PolarHBondContact O-N 2.97Å; I99-G102 PolarHBondContact O-N 3.42Å; I99-G103 VanDerWaalsContact CA-O 3.28Å; I99-G103 WeakPolarHBondContact CA-O 3.44Å; I99-G103 PolarHBondContact N-O 2.8Å
100	S	96.4	Very high	97.2	Very high	91 Å²	91	48.1 Å²	48.1	64%	0.636	26%	0.264	S	S	*	.	H	α-helix	trans	-61.1	-19.8	178.6	78.8	0	0	0	0	113.7	E96 D97	E96-S100 WeakPolarHBondContact O-CB 3.49Å; E96-S100 PolarHBondContact O-N 3.23Å; D97-S100 PolarHBondContact O-N 3.49Å; D97-S100 PolarHBondContact O-OG 2.95Å
101	R	93.4	Very high	97.1	Very high	125 Å²	125	47.8 Å²	47.8	47%	0.472	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	1.3	177.4	-63.8	169.8	-170.4	-68.8	-10.7	113.2	D97 C98 I99 F199	D97-R101 VanDerWaalsContact O-CG 3.3Å; D97-R101 WeakPolarHBondContact O-CG 3.29Å; D97-R101 PolarHBondContact O-N 3.16Å; D97-R101 IonicContact OD1-CZ 3.02Å; D97-R101 IonicContact OD1-NE 3.51Å; D97-R101 PolarHBondContact OD1-NE 2.81Å; D97-R101 IonicContact OD1-NH2 3.39Å; D97-R101 PolarHBondContact OD1-NH2 2.91Å; D97-R101 IonicContact OD2-CZ 3.4Å; D97-R101 IonicContact OD2-NE 2.85Å; D97-R101 PolarHBondContact OD2-NE 3.31Å; D97-R101 IonicContact OD2-NH2 2.8Å; D97-R101 PolarHBondContact OD2-NH2 2.86Å; C98-R101 PolarHBondContact O-N 2.79Å; I99-R101 PolarHBondContact O-N 2.97Å; R101-F199 HydrophobicContact CB-CE1 3.93Å; R101-F199 HydrophobicContact CB-CZ 4.15Å; R101-F199 WeakPolarHBondContact O-CE1 3.02Å
102	G	92.1	Very high	97	Very high	67 Å²	67	51.6 Å²	51.6	69%	0.691	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	20.6	-176.2	0	0	0	0	0	114.1	C98 I99	C98-G102 PolarHBondContact O-N 2.85Å; I99-G102 PolarHBondContact O-N 3.42Å
103	G	94.6	Very high	96.9	Very high	9 Å²	9	47.7 Å²	47.7	9%	0.093	28%	0.277	C	S	.	.			trans	-126.5	-163.8	178.1	0	0	0	0	0	112.7	C98 I99 Q198	C98-G103 CarbonylContact C-O 3.46Å; C98-G103 CarbonylContact O-C 3.56Å; C98-G103 WeakPolarHBondContact O-CA 3.04Å; C98-G103 PolarHBondContact O-N 2.01Å; I99-G103 VanDerWaalsContact CA-O 3.28Å; I99-G103 WeakPolarHBondContact CA-O 3.44Å; I99-G103 PolarHBondContact N-O 2.8Å; G103-Q198 CarbonylContact C-O 3.54Å; G103-Q198 WeakPolarHBondContact CA-O 3.33Å
104	T	97.5	Very high	96.8	Very high	46 Å²	46	42.6 Å²	42.6	28%	0.282	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	171.5	172	46.7	0	0	0	0	109	C98 C197 Q198	C98-T104 VanDerWaalsContact CB-C 3.49Å; T104-C197 CarbonylContact O-C 3.36Å; T104-C197 VanDerWaalsContact O-CA 3.25Å; T104-C197 WeakPolarHBondContact O-CA 3.35Å; T104-Q198 PolarHBondContact N-O 3.19Å; T104-Q198 PolarHBondContact O-N 3.22Å; T104-Q198 VanDerWaalsContact OG1-CG 3.26Å; T104-Q198 WeakPolarHBondContact OG1-CG 3.38Å; T104-Q198 PolarHBondContact OG1-NE2 2.81Å; T104-Q198 VanDerWaalsContact OG1-NE2 3.13Å
105	L	98.4	Very high	96.8	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	143.5	169.9	-79.2	169.1	0	0	0	111.1	F91 A94 T107 W132 G134 Y195	F91-L105 HydrophobicContact CD2-CD1 4.22Å; F91-L105 HydrophobicContact CE2-CD1 3.98Å; F91-L105 HydrophobicContact CZ-CD1 4.2Å; A94-L105 HydrophobicContact CB-CD2 4.04Å; L105-T107 PolarHBondContact O-N 3.03Å; L105-T107 VanDerWaalsContact O-N 3.17Å; L105-T107 PolarHBondContact O-OG1 3.37Å; L105-W132 HydrophobicContact CD1-CB 4.4Å; L105-W132 HydrophobicContact CD2-CB 4.05Å; L105-G134 VanDerWaalsContact CB-CA 3.46Å; L105-Y195 HydrophobicContact CD2-CD2 4.28Å; L105-Y195 HydrophobicContact CD2-CG 4.41Å
106	G	97.6	Very high	96.6	Very high	1 Å²	1	48 Å²	48	1%	0.01	29%	0.285	C	S	.	.			trans	-53.7	119.9	177.8	0	0	0	0	0	111	L133 G134 I196	G106-L133 WeakPolarHBondContact O-CA 3.31Å; G106-L133 WeakPolarHBondContact O-CD2 3.19Å; G106-G134 PolarHBondContact O-N 2.83Å; G106-I196 WeakPolarHBondContact CA-O 3.31Å; G106-I196 PolarHBondContact N-O 3.26Å
107	T	97.3	Very high	96.6	Very high	9 Å²	9	42.2 Å²	42.2	6%	0.055	26%	0.258	C	S	.	.			trans	-133	89	-175.3	-55.7	0	0	0	0	108.8	L105 Q109 G134 L135 D146 Q198	L105-T107 PolarHBondContact O-N 3.03Å; L105-T107 VanDerWaalsContact O-N 3.17Å; L105-T107 PolarHBondContact O-OG1 3.37Å; T107-Q109 PolarHBondContact O-N 2.85Å; T107-G134 VanDerWaalsContact OG1-CA 3.3Å; T107-G134 WeakPolarHBondContact OG1-CA 3.2Å; T107-L135 HydrophobicContact CG2-CD2 3.48Å; T107-L135 VanDerWaalsContact CG2-CD2 3.48Å; T107-L135 HydrophobicContact CG2-CG 4.26Å; T107-D146 HydrophobicContact CG2-CB 4.24Å; T107-Q198 PolarHBondContact O-OE1 3.2Å
108	P	96.7	Very high	96.6	Very high	4 Å²	4	42 Å²	42	3%	0.026	26%	0.255	C	S	.	.			trans	-66.4	123.6	179	27.4	-33.7	0	0	0	110.2	E113 N114 L117 L133 W184	P108-E113 HydrophobicContact CB-CB 4Å; P108-N114 HydrophobicContact CB-CB 3.93Å; P108-N114 HydrophobicContact CG-CB 4.33Å; P108-L117 HydrophobicContact CG-CD2 4.18Å; P108-L133 HydrophobicContact CG-CD2 4.23Å; P108-W184 HydrophobicContact CG-CH2 4.49Å; P108-W184 HydrophobicContact CG-CZ2 3.71Å
109	Q	95.8	Very high	96.5	Very high	111 Å²	111	46.1 Å²	46.1	52%	0.519	27%	0.274	S	S	.	.			trans	-99.4	-7.3	-179.4	-67.8	177.4	-45.4	0	0	112.7	T107 E113 Y154	T107-Q109 PolarHBondContact O-N 2.85Å; Q109-E113 PolarHBondContact N-OE2 2.89Å; Q109-Y154 WeakPolarHBondContact O-CB 3.47Å
110	T	96.8	Very high	96.5	Very high	64 Å²	64	43.3 Å²	43.3	39%	0.393	26%	0.259	S	S	.	.	S	Bend	trans	-143.4	163.5	178.6	71.2	0	0	0	0	110.5	S112 E113 N114	T110-S112 VanDerWaalsContact C-N 3.33Å; T110-S112 PolarHBondContact O-N 3.46Å; T110-E113 PolarHBondContact O-N 2.93Å; T110-E113 WeakPolarHBondContact OG1-CG 3.13Å; T110-E113 PolarHBondContact OG1-N 2.91Å; T110-N114 PolarHBondContact O-N 3.08Å
111	G	97	Very high	96.6	Very high	26 Å²	26	39 Å²	39	27%	0.268	23%	0.229	S	C	.	.	H	α-helix	trans	-58.4	-42.9	174	0	0	0	0	0	112.9	E113 N114 D115 Y154	G111-E113 VanDerWaalsContact C-N 3.3Å; G111-E113 PolarHBondContact O-N 3.2Å; G111-N114 WeakPolarHBondContact O-CB 3.4Å; G111-N114 PolarHBondContact O-N 2.77Å; G111-N114 VanDerWaalsContact O-N 3.1Å; G111-D115 PolarHBondContact O-N 2.94Å; G111-Y154 WeakPolarHBondContact CA-OH 3.21Å
112	S	95.6	Very high	96.8	Very high	86 Å²	86	37.1 Å²	37.1	60%	0.601	22%	0.222	S	C	*	.	H	α-helix	trans	-63.7	-34.7	177.6	-178.7	0	0	0	0	112.9	T110 A116	T110-S112 VanDerWaalsContact C-N 3.33Å; T110-S112 PolarHBondContact O-N 3.46Å; S112-A116 WeakPolarHBondContact O-CB 3.21Å; S112-A116 PolarHBondContact O-N 3.27Å
113	E	96.3	Very high	97	Very high	20 Å²	20	41.2 Å²	41.2	9%	0.093	22%	0.223	C	C	.	.	H	α-helix	trans	-69.4	-39.8	173.4	-73.3	-175.5	-178.7	0	0	111.5	V77 K80 P108 Q109 T110 G111 L117	V77-E113 HydrophobicContact CG1-CG 4.2Å; K80-E113 IonicContact NZ-OE1 3.54Å; K80-E113 PolarHBondContact NZ-OE1 3.36Å; K80-E113 IonicContact NZ-OE2 3.63Å; K80-E113 PolarHBondContact NZ-OE2 2.96Å; P108-E113 HydrophobicContact CB-CB 4Å; Q109-E113 PolarHBondContact N-OE2 2.89Å; T110-E113 PolarHBondContact O-N 2.93Å; T110-E113 WeakPolarHBondContact OG1-CG 3.13Å; T110-E113 PolarHBondContact OG1-N 2.91Å; G111-E113 VanDerWaalsContact C-N 3.3Å; G111-E113 PolarHBondContact O-N 3.2Å; E113-L117 VanDerWaalsContact O-CB 3.28Å; E113-L117 WeakPolarHBondContact O-CB 2.95Å; E113-L117 PolarHBondContact O-N 3.25Å
114	N	98.1	Very high	97.1	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-47.2	176.5	-174.8	84.6	0	0	0	111.9	P108 T110 G111 A116 L117 Y118 Y154 N156 L176 G182 W184	P108-N114 HydrophobicContact CB-CB 3.93Å; P108-N114 HydrophobicContact CG-CB 4.33Å; T110-N114 PolarHBondContact O-N 3.08Å; G111-N114 WeakPolarHBondContact O-CB 3.4Å; G111-N114 PolarHBondContact O-N 2.77Å; G111-N114 VanDerWaalsContact O-N 3.1Å; N114-A116 VanDerWaalsContact C-N 3.34Å; N114-A116 PolarHBondContact O-N 2.95Å; N114-L117 PolarHBondContact O-N 2.91Å; N114-Y118 WeakPolarHBondContact O-CB 3.43Å; N114-Y118 PolarHBondContact O-N 3.38Å; N114-Y154 HydrophobicContact CB-CE1 3.75Å; N114-N156 PolarHBondContact ND2-ND2 3.01Å; N114-N156 VanDerWaalsContact ND2-ND2 3.18Å; N114-L176 WeakPolarHBondContact OD1-CD1 3.39Å; N114-G182 PolarHBondContact ND2-O 2.03Å; N114-W184 PolarHBondContact OD1-NE1 2.88Å
115	D	97.4	Very high	97.1	Very high	93 Å²	93	42.3 Å²	42.3	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-63.3	-42.6	-179.1	-63.2	-17.4	0	0	0	110.8	G111 Y118 E119	G111-D115 PolarHBondContact O-N 2.94Å; D115-Y118 PolarHBondContact O-N 3.34Å; D115-E119 WeakPolarHBondContact O-CG 3.22Å; D115-E119 PolarHBondContact O-N 3.34Å
116	A	95.9	Very high	97	Very high	27 Å²	27	43.4 Å²	43.4	22%	0.223	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-37.9	176.3	0	0	0	0	0	112.6	V77 S112 N114 Y120	V77-A116 HydrophobicContact CB-CB 4.41Å; V77-A116 HydrophobicContact CG1-CB 4.08Å; V77-A116 HydrophobicContact CG2-CB 3.41Å; V77-A116 VanDerWaalsContact CG2-CB 3.41Å; S112-A116 WeakPolarHBondContact O-CB 3.21Å; S112-A116 PolarHBondContact O-N 3.27Å; N114-A116 VanDerWaalsContact C-N 3.34Å; N114-A116 PolarHBondContact O-N 2.95Å; A116-Y120 WeakPolarHBondContact O-CB 3.1Å; A116-Y120 PolarHBondContact O-N 3.2Å
117	L	97.1	Very high	97	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.6	-40.2	174.7	-175.8	61.2	0	0	0	111.4	F82 P108 E113 N114 Y120 L121 I131 L133 L176 I196	F82-L117 HydrophobicContact CB-CD1 4.37Å; F82-L117 HydrophobicContact CD1-CD1 3.82Å; F82-L117 HydrophobicContact CE1-CD1 4.21Å; F82-L117 HydrophobicContact CG-CD1 4.04Å; P108-L117 HydrophobicContact CG-CD2 4.18Å; E113-L117 VanDerWaalsContact O-CB 3.28Å; E113-L117 WeakPolarHBondContact O-CB 2.95Å; E113-L117 PolarHBondContact O-N 3.25Å; N114-L117 PolarHBondContact O-N 2.91Å; L117-Y120 PolarHBondContact O-N 3.43Å; L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 PolarHBondContact O-N 2.59Å; L117-I131 HydrophobicContact CD1-CD1 4.41Å; L117-I131 HydrophobicContact CG-CD1 4.34Å; L117-L133 HydrophobicContact CD2-CD2 3.84Å; L117-L176 HydrophobicContact CD2-CD1 4.19Å; L117-L176 HydrophobicContact CG-CD1 4.35Å; L117-I196 HydrophobicContact CD1-CB 4.12Å; L117-I196 HydrophobicContact CD1-CD1 3.88Å; L117-I196 HydrophobicContact CD1-CG2 3.75Å
118	Y	98.3	Very high	96.9	Very high	22 Å²	22	53.3 Å²	53.3	9%	0.086	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-48.4	174.9	162	-113.9	0	0	0	112.1	N114 D115 Y120 L121 R122 L176	N114-Y118 WeakPolarHBondContact O-CB 3.43Å; N114-Y118 PolarHBondContact O-N 3.38Å; D115-Y118 PolarHBondContact O-N 3.34Å; Y118-Y120 VanDerWaalsContact C-N 3.29Å; Y118-Y120 PolarHBondContact O-N 3.07Å; Y118-L121 WeakPolarHBondContact O-CB 3.08Å; Y118-L121 PolarHBondContact O-N 2.77Å; Y118-R122 HydrophobicContact CD2-CG 4.25Å; Y118-R122 VanDerWaalsContact CE2-CD 3.47Å; Y118-R122 HydrophobicContact CE2-CG 3.85Å; Y118-R122 VanDerWaalsContact CZ-CD 3.43Å; Y118-R122 WeakPolarHBondContact O-CG 3.49Å; Y118-R122 PolarHBondContact O-N 3.37Å; Y118-R122 VanDerWaalsContact O-N 3.09Å; Y118-R122 WeakPolarHBondContact OH-CD 3.38Å; Y118-R122 PolarHBondContact OH-NH1 2.87Å; Y118-L176 HydrophobicContact CD2-CD2 4.38Å
119	E	97.3	Very high	97	Very high	87 Å²	87	54.1 Å²	54.1	41%	0.407	30%	0.295	S	S	.	.	H	α-helix	trans	-61.2	-41	176.5	-73.9	-59	143	0	0	111.6	D115 R122 Q123	D115-E119 WeakPolarHBondContact O-CG 3.22Å; D115-E119 PolarHBondContact O-N 3.34Å; E119-R122 PolarHBondContact O-N 2.97Å; E119-Q123 VanDerWaalsContact O-CG 3.31Å; E119-Q123 WeakPolarHBondContact O-CG 3.37Å; E119-Q123 PolarHBondContact O-N 2.82Å
120	Y	97.1	Very high	97.1	Very high	22 Å²	22	51 Å²	51	9%	0.086	28%	0.281	C	S	.	.	H	α-helix	trans	-67.4	-40.1	176.8	-178.6	-119.9	0	0	0	112.7	G74 T75 F82 A84 A116 L117 Y118 R122 Q123 S124 I196	G74-Y120 WeakPolarHBondContact CA-OH 3.14Å; T75-Y120 HydrophobicContact CG2-CD1 3.77Å; T75-Y120 HydrophobicContact CG2-CD2 3.88Å; T75-Y120 HydrophobicContact CG2-CE1 4.48Å; T75-Y120 HydrophobicContact CG2-CG 3.45Å; T75-Y120 VanDerWaalsContact CG2-CG 3.45Å; F82-Y120 HydrophobicContact CB-CD1 4.14Å; F82-Y120 HydrophobicContact CB-CE1 4.28Å; F82-Y120 WeakPolarHBondContact O-CE1 3.37Å; A84-Y120 HydrophobicContact CB-CE1 3.82Å; A84-Y120 PolarHBondContact N-OH 2.91Å; A84-Y120 VanDerWaalsContact N-OH 3.12Å; A116-Y120 WeakPolarHBondContact O-CB 3.1Å; A116-Y120 PolarHBondContact O-N 3.2Å; L117-Y120 PolarHBondContact O-N 3.43Å; Y118-Y120 VanDerWaalsContact C-N 3.29Å; Y118-Y120 PolarHBondContact O-N 3.07Å; Y120-R122 VanDerWaalsContact C-N 3.31Å; Y120-R122 PolarHBondContact O-N 3.35Å; Y120-Q123 PolarHBondContact O-N 2.84Å; Y120-S124 WeakPolarHBondContact O-CB 3.43Å; Y120-S124 PolarHBondContact O-N 3Å; Y120-S124 PolarHBondContact O-OG 2.03Å; Y120-I196 HydrophobicContact CD1-CD1 3.78Å; Y120-I196 HydrophobicContact CD1-CG2 4.27Å; Y120-I196 HydrophobicContact CE1-CD1 4.08Å; Y120-I196 HydrophobicContact CE1-CG2 4.11Å
121	L	97.9	Very high	97.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-52.4	-50.5	172.3	163.1	69.8	0	0	0	111	L117 Y118 Q123 S124 V125 G126 A129 I131 L176 I196	L117-L121 WeakPolarHBondContact O-CB 3.36Å; L117-L121 PolarHBondContact O-N 2.59Å; Y118-L121 WeakPolarHBondContact O-CB 3.08Å; Y118-L121 PolarHBondContact O-N 2.77Å; L121-Q123 VanDerWaalsContact C-N 3.29Å; L121-Q123 PolarHBondContact O-N 2.91Å; L121-S124 PolarHBondContact O-N 2.94Å; L121-V125 HydrophobicContact CD1-CB 3.77Å; L121-V125 HydrophobicContact CD1-CG1 4.32Å; L121-V125 HydrophobicContact CD1-CG2 3.9Å; L121-V125 WeakPolarHBondContact O-CB 3.18Å; L121-V125 PolarHBondContact O-N 2.82Å; L121-G126 PolarHBondContact O-N 3.39Å; L121-G126 VanDerWaalsContact O-N 3.11Å; L121-A129 HydrophobicContact CD1-CB 4.11Å; L121-I131 HydrophobicContact CB-CD1 4.28Å; L121-I131 HydrophobicContact CD1-CB 4.21Å; L121-I131 HydrophobicContact CD1-CD1 4.07Å; L121-I131 HydrophobicContact CD1-CG1 3.95Å; L121-I131 HydrophobicContact CD1-CG2 3.36Å; L121-I131 HydrophobicContact CD2-CD1 4.46Å; L121-I131 HydrophobicContact CD2-CG1 4.24Å; L121-L176 HydrophobicContact CD2-CD2 3.37Å; L121-I196 HydrophobicContact CB-CD1 4.26Å
122	R	97.8	Very high	97.3	Very high	86 Å²	86	46.7 Å²	46.7	33%	0.325	25%	0.249	S	C	.	.	H	α-helix	trans	-60.8	-39.6	-177.6	-71.2	-170.6	63	176.7	7.4	112.8	Y118 E119 Y120 G126 N127	Y118-R122 HydrophobicContact CD2-CG 4.25Å; Y118-R122 VanDerWaalsContact CE2-CD 3.47Å; Y118-R122 HydrophobicContact CE2-CG 3.85Å; Y118-R122 VanDerWaalsContact CZ-CD 3.43Å; Y118-R122 WeakPolarHBondContact O-CG 3.49Å; Y118-R122 PolarHBondContact O-N 3.37Å; Y118-R122 VanDerWaalsContact O-N 3.09Å; Y118-R122 WeakPolarHBondContact OH-CD 3.38Å; Y118-R122 PolarHBondContact OH-NH1 2.87Å; E119-R122 PolarHBondContact O-N 2.97Å; Y120-R122 VanDerWaalsContact C-N 3.31Å; Y120-R122 PolarHBondContact O-N 3.35Å; R122-G126 CarbonylContact O-C 3.59Å; R122-N127 PolarHBondContact NE-OD1 2.93Å; R122-N127 PolarHBondContact NH2-OD1 2.81Å
123	Q	96.2	Very high	97.5	Very high	153 Å²	153	42.6 Å²	42.6	72%	0.715	22%	0.221	S	C	*	.	H	α-helix	trans	-77.6	-34.5	-178.1	-66.4	170.6	25.5	0	0	113.2	E119 Y120 L121	E119-Q123 VanDerWaalsContact O-CG 3.31Å; E119-Q123 WeakPolarHBondContact O-CG 3.37Å; E119-Q123 PolarHBondContact O-N 2.82Å; Y120-Q123 PolarHBondContact O-N 2.84Å; L121-Q123 VanDerWaalsContact C-N 3.29Å; L121-Q123 PolarHBondContact O-N 2.91Å
124	S	96.4	Very high	97.6	Very high	40 Å²	40	41.7 Å²	41.7	28%	0.28	22%	0.216	S	C	.	.	H	α-helix	trans	-103	-27.2	-169.4	63.3	0	0	0	0	114.7	A84 Y120 L121	A84-S124 VanDerWaalsContact CB-OG 3.24Å; A84-S124 WeakPolarHBondContact CB-OG 3.3Å; Y120-S124 WeakPolarHBondContact O-CB 3.43Å; Y120-S124 PolarHBondContact O-N 3Å; Y120-S124 PolarHBondContact O-OG 2.03Å; L121-S124 PolarHBondContact O-N 2.94Å
125	V	97.4	Very high	97.6	Very high	37 Å²	37	41.8 Å²	41.8	22%	0.224	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-50.8	-178.6	-171.5	0	0	0	0	110.6	A84 T86 L121 A129 I131 P194	A84-V125 HydrophobicContact CB-CG2 3.86Å; T86-V125 HydrophobicContact CG2-CG1 4.41Å; L121-V125 HydrophobicContact CD1-CB 3.77Å; L121-V125 HydrophobicContact CD1-CG1 4.32Å; L121-V125 HydrophobicContact CD1-CG2 3.9Å; L121-V125 WeakPolarHBondContact O-CB 3.18Å; L121-V125 PolarHBondContact O-N 2.82Å; V125-A129 HydrophobicContact CB-CB 4.17Å; V125-A129 HydrophobicContact CG1-CB 3.61Å; V125-I131 HydrophobicContact CG2-CG2 4.3Å; V125-P194 HydrophobicContact CG1-CB 3.89Å; V125-P194 HydrophobicContact CG1-CG 3.67Å
126	G	97.6	Very high	97.7	Very high	23 Å²	23	38.5 Å²	38.5	24%	0.237	20%	0.199	C	C	.	.			trans	153.3	155.6	177.1	0	0	0	0	0	113.3	L121 R122 E128 A129	L121-G126 PolarHBondContact O-N 3.39Å; L121-G126 VanDerWaalsContact O-N 3.11Å; R122-G126 CarbonylContact O-C 3.59Å; G126-E128 VanDerWaalsContact C-N 3.33Å; G126-E128 PolarHBondContact O-N 3.43Å; G126-A129 WeakPolarHBondContact O-CB 3.16Å; G126-A129 PolarHBondContact O-N 3.19Å
127	N	96.4	Very high	97.8	Very high	79 Å²	79	37.3 Å²	37.3	42%	0.422	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-38.9	-174.9	-77.5	-22.7	0	0	0	114.1	R122 G178 A179	R122-N127 PolarHBondContact NE-OD1 2.93Å; R122-N127 PolarHBondContact NH2-OD1 2.81Å; N127-G178 CarbonylContact O-C 3.12Å; N127-G178 VanDerWaalsContact O-CA 3.3Å; N127-G178 WeakPolarHBondContact O-CA 3.14Å; N127-A179 PolarHBondContact O-N 2.85Å
128	E	96.7	Very high	97.9	Very high	139 Å²	139	40.8 Å²	40.8	65%	0.65	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	8.4	-176.5	-51.6	-55.5	132.6	0	0	112.2	G126 A179	G126-E128 VanDerWaalsContact C-N 3.33Å; G126-E128 PolarHBondContact O-N 3.43Å; E128-A179 HydrophobicContact CB-CB 4.45Å; E128-A179 WeakPolarHBondContact OE2-CA 3.39Å; E128-A179 WeakPolarHBondContact OE2-CB 3.44Å
129	A	98.1	Very high	97.8	Very high	21 Å²	21	44 Å²	44	17%	0.174	24%	0.237	C	C	.	.			trans	-73.8	154.1	-175.5	0	0	0	0	0	111.6	L121 V125 G126 G178	L121-A129 HydrophobicContact CD1-CB 4.11Å; V125-A129 HydrophobicContact CB-CB 4.17Å; V125-A129 HydrophobicContact CG1-CB 3.61Å; G126-A129 WeakPolarHBondContact O-CB 3.16Å; G126-A129 PolarHBondContact O-N 3.19Å; A129-G178 PolarHBondContact O-N 3Å
130	E	98.6	Very high	97.9	Very high	45 Å²	45	43.6 Å²	43.6	21%	0.21	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	141.2	168.5	-56.6	-171.9	129.9	0	0	108.7	L176 S177 K187 L193 P194	E130-L176 WeakPolarHBondContact CA-O 3.21Å; E130-S177 PolarHBondContact OE1-OG 2.99Å; E130-K187 VanDerWaalsContact OE2-CE 3.25Å; E130-K187 WeakPolarHBondContact OE2-CE 3.25Å; E130-K187 IonicContact OE2-NZ 2.79Å; E130-L193 HydrophobicContact CB-CD2 4.44Å; E130-P194 WeakPolarHBondContact O-CD 3.46Å; E130-P194 VanDerWaalsContact O-CG 3.24Å; E130-P194 WeakPolarHBondContact O-CG 3.46Å
131	I	98.8	Very high	97.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.9	176.1	53.5	168.2	0	0	0	111.4	L117 L121 V125 V175 L176 P194 I196	L117-I131 HydrophobicContact CD1-CD1 4.41Å; L117-I131 HydrophobicContact CG-CD1 4.34Å; L121-I131 HydrophobicContact CB-CD1 4.28Å; L121-I131 HydrophobicContact CD1-CB 4.21Å; L121-I131 HydrophobicContact CD1-CD1 4.07Å; L121-I131 HydrophobicContact CD1-CG1 3.95Å; L121-I131 HydrophobicContact CD1-CG2 3.36Å; L121-I131 HydrophobicContact CD2-CD1 4.46Å; L121-I131 HydrophobicContact CD2-CG1 4.24Å; V125-I131 HydrophobicContact CG2-CG2 4.3Å; I131-V175 CarbonylContact O-C 3.54Å; I131-V175 WeakPolarHBondContact O-CA 3.16Å; I131-V175 WeakPolarHBondContact O-CB 3.31Å; I131-L176 HydrophobicContact CG1-CB 4.11Å; I131-L176 PolarHBondContact N-O 3.2Å; I131-L176 PolarHBondContact O-N 3.34Å; I131-P194 VanDerWaalsContact CA-O 3.31Å; I131-P194 WeakPolarHBondContact CA-O 3.3Å; I131-P194 HydrophobicContact CG2-CB 4.31Å; I131-P194 HydrophobicContact CG2-CG 4.06Å; I131-I196 HydrophobicContact CD1-CB 4.11Å; I131-I196 HydrophobicContact CD1-CD1 3.46Å; I131-I196 VanDerWaalsContact CD1-CD1 3.46Å; I131-I196 HydrophobicContact CD1-CG1 3.58Å; I131-I196 HydrophobicContact CG2-CG1 4.2Å
132	W	98.9	Very high	97.9	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	135.7	168.9	-69.9	125.3	0	0	0	112.1	K89 F91 L105 C173 V175 K187 R188 D191 L193 P194	K89-W132 PolarHBondContact O-NE1 3.47Å; F91-W132 HydrophobicContact CB-CD2 4.12Å; F91-W132 HydrophobicContact CB-CE3 4.34Å; F91-W132 HydrophobicContact CB-CH2 4.47Å; F91-W132 HydrophobicContact CB-CZ2 4.18Å; F91-W132 AromaticContact CD2-CD2 3.98Å; F91-W132 HydrophobicContact CD2-CD2 3.98Å; F91-W132 AromaticContact CD2-CE3 3.75Å; F91-W132 HydrophobicContact CD2-CE3 3.75Å; F91-W132 HydrophobicContact CD2-CG 4.33Å; F91-W132 HydrophobicContact CD2-CZ3 4.34Å; L105-W132 HydrophobicContact CD1-CB 4.4Å; L105-W132 HydrophobicContact CD2-CB 4.05Å; W132-C173 HydrophobicContact CE3-CB 4.09Å; W132-C173 HydrophobicContact CH2-CB 4.14Å; W132-C173 HydrophobicContact CZ3-CB 3.48Å; W132-C173 VanDerWaalsContact CZ3-CB 3.48Å; W132-V175 HydrophobicContact CD2-CG1 4.31Å; W132-V175 HydrophobicContact CE3-CG1 3.45Å; W132-V175 VanDerWaalsContact CE3-CG1 3.45Å; W132-V175 HydrophobicContact CH2-CG1 4.19Å; W132-V175 HydrophobicContact CZ3-CG1 3.37Å; W132-K187 HydrophobicContact CH2-CB 3.95Å; W132-K187 HydrophobicContact CZ3-CB 3.98Å; W132-R188 WeakPolarHBondContact CH2-O 3.37Å; W132-D191 HydrophobicContact CZ2-CB 4.35Å; W132-D191 VanDerWaalsContact CZ2-O 3.26Å; W132-D191 WeakPolarHBondContact CZ2-O 3.36Å; W132-L193 HydrophobicContact CD2-CB 4.39Å; W132-L193 HydrophobicContact CD2-CD1 4.14Å; W132-L193 HydrophobicContact CE3-CD1 4.28Å; W132-L193 HydrophobicContact CG-CB 4.46Å; W132-L193 HydrophobicContact CH2-CD1 3.87Å; W132-L193 HydrophobicContact CZ2-CB 4.31Å; W132-L193 HydrophobicContact CZ2-CD1 3.76Å; W132-L193 HydrophobicContact CZ2-CG 4.09Å; W132-L193 HydrophobicContact CZ3-CD1 4.15Å; W132-P194 PolarHBondContact N-O 3.24Å
133	L	98.8	Very high	97.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	153.7	162.1	-66.6	-180	0	0	0	109.7	F91 G106 P108 L117 L135 A174 L176 W184	F91-L133 WeakPolarHBondContact CE2-O 3.43Å; G106-L133 WeakPolarHBondContact O-CA 3.31Å; G106-L133 WeakPolarHBondContact O-CD2 3.19Å; P108-L133 HydrophobicContact CG-CD2 4.23Å; L117-L133 HydrophobicContact CD2-CD2 3.84Å; L133-L135 HydrophobicContact CB-CD1 4.49Å; L133-L135 HydrophobicContact CB-CG 4.28Å; L133-L135 HydrophobicContact CD1-CD1 4.35Å; L133-L135 PolarHBondContact O-N 3.25Å; L133-A174 HydrophobicContact CB-CB 4.16Å; L133-A174 HydrophobicContact CD1-CB 4.35Å; L133-A174 PolarHBondContact N-O 2.94Å; L133-L176 HydrophobicContact CD1-CB 4.09Å; L133-L176 HydrophobicContact CD2-CB 3.91Å; L133-L176 HydrophobicContact CD2-CD1 4.39Å; L133-L176 HydrophobicContact CG-CB 3.99Å; L133-W184 HydrophobicContact CD1-CD2 3.71Å; L133-W184 HydrophobicContact CD1-CE3 4.32Å; L133-W184 HydrophobicContact CD1-CG 3.8Å; L133-W184 HydrophobicContact CD1-CZ2 4.28Å
134	G	98.6	Very high	98	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	43.6	176.4	0	0	0	0	0	114.3	L105 G106 T107 D146 M147	L105-G134 VanDerWaalsContact CB-CA 3.46Å; G106-G134 PolarHBondContact O-N 2.83Å; T107-G134 VanDerWaalsContact OG1-CA 3.3Å; T107-G134 WeakPolarHBondContact OG1-CA 3.2Å; G134-D146 WeakPolarHBondContact O-CA 3.37Å; G134-M147 WeakPolarHBondContact O-CG 3.5Å; G134-M147 PolarHBondContact O-N 2.97Å
135	L	98.8	Very high	98.1	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.3	-174.5	-52.3	178.7	0	0	0	111.4	T107 L133 W144 V145 D146 I152 A174 W184	T107-L135 HydrophobicContact CG2-CD2 3.48Å; T107-L135 VanDerWaalsContact CG2-CD2 3.48Å; T107-L135 HydrophobicContact CG2-CG 4.26Å; L133-L135 HydrophobicContact CB-CD1 4.49Å; L133-L135 HydrophobicContact CB-CG 4.28Å; L133-L135 HydrophobicContact CD1-CD1 4.35Å; L133-L135 PolarHBondContact O-N 3.25Å; L135-W144 HydrophobicContact CB-CE3 4.2Å; L135-V145 WeakPolarHBondContact CA-O 3.42Å; L135-D146 HydrophobicContact CD2-CB 4.06Å; L135-I152 HydrophobicContact CD1-CD1 4.26Å; L135-I152 HydrophobicContact CD1-CG2 4.3Å; L135-I152 HydrophobicContact CD2-CG2 3.37Å; L135-I152 HydrophobicContact CG-CG2 4.35Å; L135-A174 HydrophobicContact CB-CB 3.8Å; L135-A174 HydrophobicContact CD1-CB 4.42Å; L135-A174 PolarHBondContact O-N 3.26Å; L135-A174 VanDerWaalsContact O-N 3.07Å; L135-W184 HydrophobicContact CD1-CE3 4.08Å; L135-W184 HydrophobicContact CD1-CH2 3.95Å; L135-W184 HydrophobicContact CD1-CZ3 3.53Å
136	N	98.8	Very high	98.1	Very high	24 Å²	24	39.1 Å²	39.1	13%	0.128	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	162.9	178.2	72.4	97.2	0	0	0	111.4	F91 M138 W144 V145 N172	F91-N136 HydrophobicContact CZ-CB 4.21Å; N136-M138 HydrophobicContact CB-CE 4.08Å; N136-M138 HydrophobicContact CB-CG 4.17Å; N136-M138 PolarHBondContact OD1-N 2.9Å; N136-W144 WeakPolarHBondContact O-CA 3.43Å; N136-V145 PolarHBondContact N-O 2.85Å; N136-V145 WeakPolarHBondContact O-CG2 3.25Å; N136-V145 PolarHBondContact O-N 3.33Å; N136-N172 WeakPolarHBondContact CA-O 3.45Å; N136-N172 WeakPolarHBondContact CB-O 3.4Å
137	D	98.6	Very high	98	Very high	3 Å²	3	41 Å²	41	2%	0.016	24%	0.238	C	C	.	.			trans	-128	20.7	170.6	71.4	-28.1	0	0	0	112.5	A139 T140 E141 G142 I143 W144 N172	D137-A139 PolarHBondContact O-N 2.89Å; D137-T140 CarbonylContact O-C 3.54Å; D137-T140 PolarHBondContact O-N 3.45Å; D137-E141 PolarHBondContact O-N 2.92Å; D137-G142 PolarHBondContact OD2-N 3.27Å; D137-I143 WeakPolarHBondContact CA-O 3.44Å; D137-I143 WeakPolarHBondContact CB-O 3.47Å; D137-W144 HydrophobicContact CB-CD2 4.01Å; D137-W144 HydrophobicContact CB-CE3 4.45Å; D137-W144 HydrophobicContact CB-CG 4.14Å; D137-N172 PolarHBondContact N-O 2.89Å; D137-N172 WeakPolarHBondContact OD1-CA 3.38Å; D137-N172 WeakPolarHBondContact OD1-CB 3.3Å
138	M	98.2	Very high	98	Very high	72 Å²	72	43 Å²	43	36%	0.355	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-34.4	-177.2	-63.8	173.5	-163.4	0	0	114	F91 H92 N136 N172 C173 C189	F91-M138 HydrophobicContact CD1-CE 3.76Å; F91-M138 HydrophobicContact CE1-CE 3.86Å; H92-M138 WeakPolarHBondContact CE1-CE 3.41Å; N136-M138 HydrophobicContact CB-CE 4.08Å; N136-M138 HydrophobicContact CB-CG 4.17Å; N136-M138 PolarHBondContact OD1-N 2.9Å; M138-N172 HydrophobicContact CB-CB 4.35Å; M138-N172 HydrophobicContact CG-CB 3.63Å; M138-C173 WeakPolarHBondContact CE-SG 3.34Å; M138-C189 HydrophobicContact CE-CB 4.06Å; M138-C189 WeakPolarHBondContact CE-SG 3.41Å
139	A	97.7	Very high	98	Very high	90 Å²	90	38.8 Å²	38.8	74%	0.744	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-33.2	-178.4	0	0	0	0	0	112.4	D137	D137-A139 PolarHBondContact O-N 2.89Å
140	T	97.9	Very high	97.9	Very high	79 Å²	79	39.9 Å²	39.9	49%	0.485	26%	0.256	S	S	.	.	S	Bend	trans	-155	107.1	179.5	-54.7	0	0	0	0	109.6	D137 G142 I143	D137-T140 CarbonylContact O-C 3.54Å; D137-T140 PolarHBondContact O-N 3.45Å; T140-G142 PolarHBondContact O-N 2.99Å; T140-I143 HydrophobicContact CG2-CB 4.43Å; T140-I143 HydrophobicContact CG2-CD1 3.6Å; T140-I143 HydrophobicContact CG2-CG1 4.25Å; T140-I143 WeakPolarHBondContact O-CA 3.46Å; T140-I143 WeakPolarHBondContact O-CB 3.06Å; T140-I143 PolarHBondContact O-N 2.93Å
141	E	98.2	Very high	97.9	Very high	81 Å²	81	46 Å²	46	38%	0.379	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-39.2	126.1	176.2	-176.9	61.9	-147.2	0	0	113.3	D137 I143 G168 K169	D137-E141 PolarHBondContact O-N 2.92Å; E141-I143 PolarHBondContact O-N 2.81Å; E141-G168 VanDerWaalsContact CD-C 3.49Å; E141-G168 WeakPolarHBondContact OE1-CA 3.48Å; E141-K169 HydrophobicContact CG-CG 4.31Å; E141-K169 WeakPolarHBondContact OE2-CA 3.47Å; E141-K169 WeakPolarHBondContact OE2-CG 3.31Å; E141-K169 PolarHBondContact OE2-N 3.08Å
142	G	97.1	Very high	97.9	Very high	52 Å²	52	47.2 Å²	47.2	54%	0.536	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	-4.8	179.8	0	0	0	0	0	114.9	D137 T140	D137-G142 PolarHBondContact OD2-N 3.27Å; T140-G142 PolarHBondContact O-N 2.99Å
143	I	98.2	Very high	97.7	Very high	49 Å²	49	52.1 Å²	52.1	25%	0.251	32%	0.324	S	S	.	.			trans	-105.4	91.6	175.2	-63.1	170.8	0	0	0	109.4	D137 T140 E141 V145 R151	D137-I143 WeakPolarHBondContact CA-O 3.44Å; D137-I143 WeakPolarHBondContact CB-O 3.47Å; T140-I143 HydrophobicContact CG2-CB 4.43Å; T140-I143 HydrophobicContact CG2-CD1 3.6Å; T140-I143 HydrophobicContact CG2-CG1 4.25Å; T140-I143 WeakPolarHBondContact O-CA 3.46Å; T140-I143 WeakPolarHBondContact O-CB 3.06Å; T140-I143 PolarHBondContact O-N 2.93Å; E141-I143 PolarHBondContact O-N 2.81Å; I143-V145 HydrophobicContact CG2-CG1 4.33Å; I143-R151 HydrophobicContact CG2-CG 4.19Å
144	W	98.5	Very high	97.7	Very high	13 Å²	13	54.6 Å²	54.6	5%	0.049	33%	0.334	C	S	.	.			trans	-76.1	127.8	178.2	-67.8	80.7	0	0	0	112.2	L135 N136 D137 I152 W157 P165 A174 D186	L135-W144 HydrophobicContact CB-CE3 4.2Å; N136-W144 WeakPolarHBondContact O-CA 3.43Å; D137-W144 HydrophobicContact CB-CD2 4.01Å; D137-W144 HydrophobicContact CB-CE3 4.45Å; D137-W144 HydrophobicContact CB-CG 4.14Å; W144-I152 HydrophobicContact CB-CD1 3.5Å; W144-I152 HydrophobicContact CB-CG1 3.89Å; W144-I152 HydrophobicContact CG-CD1 4.33Å; W144-I152 PolarHBondContact O-N 3.13Å; W144-I152 VanDerWaalsContact O-N 3.16Å; W144-W157 AromaticContact CD2-CH2 3.75Å; W144-W157 HydrophobicContact CD2-CH2 3.75Å; W144-W157 AromaticContact CD2-CZ2 3.47Å; W144-W157 HydrophobicContact CD2-CZ2 3.47Å; W144-W157 VanDerWaalsContact CD2-CZ2 3.47Å; W144-W157 AromaticContact CE2-CH2 3.65Å; W144-W157 AromaticContact CE2-CZ2 3.56Å; W144-W157 AromaticContact CE3-CH2 3.75Å; W144-W157 HydrophobicContact CE3-CH2 3.75Å; W144-W157 AromaticContact CE3-CZ2 3.85Å; W144-W157 HydrophobicContact CE3-CZ2 3.85Å; W144-W157 AromaticContact CG-CZ2 3.86Å; W144-W157 HydrophobicContact CG-CZ2 3.86Å; W144-W157 AromaticContact CH2-CH2 3.59Å; W144-W157 HydrophobicContact CH2-CH2 3.59Å; W144-W157 HydrophobicContact CH2-CZ2 4.32Å; W144-W157 HydrophobicContact CH2-CZ3 4.4Å; W144-W157 AromaticContact CZ2-CH2 3.58Å; W144-W157 HydrophobicContact CZ2-CH2 3.58Å; W144-W157 AromaticContact CZ2-CZ2 4Å; W144-W157 HydrophobicContact CZ2-CZ2 4Å; W144-W157 HydrophobicContact CZ2-CZ3 4.39Å; W144-W157 AromaticContact CZ3-CH2 3.69Å; W144-W157 HydrophobicContact CZ3-CH2 3.69Å; W144-W157 HydrophobicContact CZ3-CZ2 4.26Å; W144-W157 AromaticContact NE1-CZ2 3.98Å; W144-P165 HydrophobicContact CZ2-CB 3.81Å; W144-P165 HydrophobicContact CZ2-CG 4.18Å; W144-A174 HydrophobicContact CE3-CB 4.23Å; W144-A174 HydrophobicContact CH2-CB 4.29Å; W144-A174 HydrophobicContact CZ3-CB 3.64Å; W144-D186 HydrophobicContact CH2-CB 3.75Å; W144-D186 HydrophobicContact CZ2-CB 3.79Å
145	V	98.6	Very high	97.7	Very high	23 Å²	23	60.2 Å²	60.2	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155.3	179.2	-61.9	0	0	0	0	111.2	L135 N136 I143 A150 R151	L135-V145 WeakPolarHBondContact CA-O 3.42Å; N136-V145 PolarHBondContact N-O 2.85Å; N136-V145 WeakPolarHBondContact O-CG2 3.25Å; N136-V145 PolarHBondContact O-N 3.33Å; I143-V145 HydrophobicContact CG2-CG1 4.33Å; V145-A150 CarbonylContact C-O 3.48Å; V145-A150 WeakPolarHBondContact CA-O 3.4Å; V145-A150 WeakPolarHBondContact CB-O 3.4Å; V145-R151 HydrophobicContact CG1-CG 4.4Å
146	D	97.9	Very high	97.6	Very high	26 Å²	26	61.3 Å²	61.3	14%	0.139	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	179.6	169.4	68.8	21.9	0	0	0	112.1	T107 G134 L135 T148 G149 A150	T107-D146 HydrophobicContact CG2-CB 4.24Å; G134-D146 WeakPolarHBondContact O-CA 3.37Å; L135-D146 HydrophobicContact CD2-CB 4.06Å; D146-T148 PolarHBondContact O-N 3.23Å; D146-T148 VanDerWaalsContact O-N 3.07Å; D146-T148 WeakPolarHBondContact OD1-CA 3.38Å; D146-T148 WeakPolarHBondContact OD1-CB 3.48Å; D146-T148 PolarHBondContact OD1-N 2.94Å; D146-T148 PolarHBondContact OD1-OG1 2.81Å; D146-G149 PolarHBondContact O-N 3.08Å; D146-G149 PolarHBondContact OD1-N 3.11Å; D146-A150 PolarHBondContact N-O 2.79Å; D146-A150 PolarHBondContact OD1-N 3.12Å
147	M	95.3	Very high	97.6	Very high	62 Å²	62	61.1 Å²	61.1	31%	0.305	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.8	178.7	-58.8	-54.2	-58.7	0	0	114.6	F91 S95 G134	F91-M147 HydrophobicContact CE1-SD 4.5Å; F91-M147 HydrophobicContact CZ-SD 4.04Å; S95-M147 WeakPolarHBondContact OG-CE 3.01Å; G134-M147 WeakPolarHBondContact O-CG 3.5Å; G134-M147 PolarHBondContact O-N 2.97Å
148	T	95.3	Very high	97.6	Very high	121 Å²	121	61.7 Å²	61.7	74%	0.742	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-7.4	174.4	76	0	0	0	0	112.7	D146 A150	D146-T148 PolarHBondContact O-N 3.23Å; D146-T148 VanDerWaalsContact O-N 3.07Å; D146-T148 WeakPolarHBondContact OD1-CA 3.38Å; D146-T148 WeakPolarHBondContact OD1-CB 3.48Å; D146-T148 PolarHBondContact OD1-N 2.94Å; D146-T148 PolarHBondContact OD1-OG1 2.81Å; T148-A150 PolarHBondContact OG1-N 2.88Å
149	G	96.6	Very high	97.6	Very high	50 Å²	50	62.1 Å²	62.1	52%	0.515	37%	0.371	S	S	.	.	S	Bend	trans	85	5.9	-173.2	0	0	0	0	0	113.8	D146	D146-G149 PolarHBondContact O-N 3.08Å; D146-G149 PolarHBondContact OD1-N 3.11Å
150	A	97.7	Very high	97.5	Very high	45 Å²	45	65.8 Å²	65.8	37%	0.372	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-78.6	139.4	176.8	0	0	0	0	0	110.6	V145 D146 T148 I152	V145-A150 CarbonylContact C-O 3.48Å; V145-A150 WeakPolarHBondContact CA-O 3.4Å; V145-A150 WeakPolarHBondContact CB-O 3.4Å; D146-A150 PolarHBondContact N-O 2.79Å; D146-A150 PolarHBondContact OD1-N 3.12Å; T148-A150 PolarHBondContact OG1-N 2.88Å; A150-I152 PolarHBondContact O-N 3.26Å
151	R	97.8	Very high	97.4	Very high	172 Å²	172	69.1 Å²	69.1	65%	0.649	39%	0.386	S	S	*	.	B	Isolated β-bridge	trans	-62.9	135.6	176.3	-72.8	-179	178.4	-109	0.5	110.7	I143 V145	I143-R151 HydrophobicContact CG2-CG 4.19Å; V145-R151 HydrophobicContact CG1-CG 4.4Å
152	I	97.6	Very high	97.2	Very high	26 Å²	26	68 Å²	68	13%	0.133	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-70.4	135.6	178.5	67.1	176.4	0	0	0	111.5	L135 W144 A150 K155 W184	L135-I152 HydrophobicContact CD1-CD1 4.26Å; L135-I152 HydrophobicContact CD1-CG2 4.3Å; L135-I152 HydrophobicContact CD2-CG2 3.37Å; L135-I152 HydrophobicContact CG-CG2 4.35Å; W144-I152 HydrophobicContact CB-CD1 3.5Å; W144-I152 HydrophobicContact CB-CG1 3.89Å; W144-I152 HydrophobicContact CG-CD1 4.33Å; W144-I152 PolarHBondContact O-N 3.13Å; W144-I152 VanDerWaalsContact O-N 3.16Å; A150-I152 PolarHBondContact O-N 3.26Å; I152-K155 HydrophobicContact CD1-CD 4.29Å; I152-K155 HydrophobicContact CD1-CG 3.63Å; I152-K155 HydrophobicContact CG1-CG 4.06Å; I152-W184 HydrophobicContact CD1-CZ3 4.28Å
153	A	96.6	Very high	97.2	Very high	104 Å²	104	68.6 Å²	68.6	86%	0.86	39%	0.385	S	S	*	.	S	Bend	trans	-92.8	-45.5	174	0	0	0	0	0	111.7
154	Y	97.9	Very high	97.1	Very high	53 Å²	53	67.1 Å²	67.1	21%	0.208	38%	0.377	C	S	.	.			trans	-88.2	139.8	176.7	178.2	-104.4	0	0	0	110.9	Q109 G111 N114 N156 W184	Q109-Y154 WeakPolarHBondContact O-CB 3.47Å; G111-Y154 WeakPolarHBondContact CA-OH 3.21Å; N114-Y154 HydrophobicContact CB-CE1 3.75Å; Y154-N156 HydrophobicContact CE1-CB 4.1Å; Y154-W184 AromaticContact CD1-CH2 3.65Å; Y154-W184 HydrophobicContact CD1-CH2 3.65Å; Y154-W184 AromaticContact CD1-CZ2 3.71Å; Y154-W184 HydrophobicContact CD1-CZ2 3.71Å; Y154-W184 AromaticContact CE1-CH2 3.92Å; Y154-W184 HydrophobicContact CE1-CH2 3.92Å; Y154-W184 AromaticContact CE1-CZ2 3.51Å; Y154-W184 HydrophobicContact CE1-CZ2 3.51Å; Y154-W184 WeakPolarHBondContact O-CH2 3.42Å
155	K	97.7	Very high	97.1	Very high	117 Å²	117	68.9 Å²	68.9	51%	0.509	39%	0.39	S	S	.	.			trans	-141.4	138.9	-179.8	-68	173.8	-172.9	168.5	0	109.1	I152 W184	I152-K155 HydrophobicContact CD1-CD 4.29Å; I152-K155 HydrophobicContact CD1-CG 3.63Å; I152-K155 HydrophobicContact CG1-CG 4.06Å; K155-W184 HydrophobicContact CB-CZ3 4.42Å
156	N	98.5	Very high	97.1	Very high	25 Å²	25	72.1 Å²	72.1	13%	0.134	41%	0.407	C	S	.	.			trans	-134.1	38.9	173.7	-160.4	35.7	0	0	0	112.6	N114 Y154 G182 K183 W184	N114-N156 PolarHBondContact ND2-ND2 3.01Å; N114-N156 VanDerWaalsContact ND2-ND2 3.18Å; Y154-N156 HydrophobicContact CE1-CB 4.1Å; N156-G182 PolarHBondContact ND2-O 2.84Å; N156-K183 CarbonylContact O-C 3.57Å; N156-K183 WeakPolarHBondContact O-CA 3.28Å; N156-K183 VanDerWaalsContact O-CD 3.3Å; N156-K183 WeakPolarHBondContact O-CD 3.34Å; N156-K183 PolarHBondContact OD1-NZ 3.18Å; N156-W184 HydrophobicContact CB-CD2 3.97Å; N156-W184 HydrophobicContact CB-CG 4.21Å; N156-W184 HydrophobicContact CB-CZ2 3.97Å; N156-W184 PolarHBondContact O-N 3.11Å
157	W	98.6	Very high	97	Very high	20 Å²	20	71.7 Å²	71.7	8%	0.076	41%	0.408	C	S	.	.	B	Isolated β-bridge	trans	-55.2	143.5	176.8	-58.5	116.6	0	0	0	112.6	W144 T159 Q164 P165 A174 W184	W144-W157 AromaticContact CD2-CH2 3.75Å; W144-W157 HydrophobicContact CD2-CH2 3.75Å; W144-W157 AromaticContact CD2-CZ2 3.47Å; W144-W157 HydrophobicContact CD2-CZ2 3.47Å; W144-W157 VanDerWaalsContact CD2-CZ2 3.47Å; W144-W157 AromaticContact CE2-CH2 3.65Å; W144-W157 AromaticContact CE2-CZ2 3.56Å; W144-W157 AromaticContact CE3-CH2 3.75Å; W144-W157 HydrophobicContact CE3-CH2 3.75Å; W144-W157 AromaticContact CE3-CZ2 3.85Å; W144-W157 HydrophobicContact CE3-CZ2 3.85Å; W144-W157 AromaticContact CG-CZ2 3.86Å; W144-W157 HydrophobicContact CG-CZ2 3.86Å; W144-W157 AromaticContact CH2-CH2 3.59Å; W144-W157 HydrophobicContact CH2-CH2 3.59Å; W144-W157 HydrophobicContact CH2-CZ2 4.32Å; W144-W157 HydrophobicContact CH2-CZ3 4.4Å; W144-W157 AromaticContact CZ2-CH2 3.58Å; W144-W157 HydrophobicContact CZ2-CH2 3.58Å; W144-W157 AromaticContact CZ2-CZ2 4Å; W144-W157 HydrophobicContact CZ2-CZ2 4Å; W144-W157 HydrophobicContact CZ2-CZ3 4.39Å; W144-W157 AromaticContact CZ3-CH2 3.69Å; W144-W157 HydrophobicContact CZ3-CH2 3.69Å; W144-W157 HydrophobicContact CZ3-CZ2 4.26Å; W144-W157 AromaticContact NE1-CZ2 3.98Å; W157-T159 HydrophobicContact CB-CG2 4.49Å; W157-T159 PolarHBondContact O-N 3.35Å; W157-Q164 HydrophobicContact CB-CB 4.21Å; W157-Q164 WeakPolarHBondContact CB-O 3.47Å; W157-Q164 HydrophobicContact CE3-CB 4.2Å; W157-P165 HydrophobicContact CE3-CB 4.48Å; W157-P165 HydrophobicContact CZ3-CB 4.41Å; W157-A174 HydrophobicContact CH2-CB 3.68Å; W157-A174 HydrophobicContact CZ3-CB 4.16Å; W157-W184 HydrophobicContact CD2-CB 4.12Å; W157-W184 HydrophobicContact CD2-CE3 4.28Å; W157-W184 HydrophobicContact CE3-CB 3.49Å; W157-W184 VanDerWaalsContact CE3-CB 3.49Å; W157-W184 HydrophobicContact CZ2-CE3 4.24Å; W157-W184 HydrophobicContact CZ3-CB 3.77Å
158	E	98.3	Very high	97	Very high	16 Å²	16	69.9 Å²	69.9	8%	0.075	41%	0.406	C	S	.	.			trans	-67.3	110.3	169.8	174.8	50.7	-117.8	0	0	109.7	E160 I161 A163 Q164 K183 W184 F185	E158-E160 WeakPolarHBondContact OE1-CA 3.11Å; E158-E160 WeakPolarHBondContact OE1-CB 3.45Å; E158-E160 PolarHBondContact OE1-N 3.23Å; E158-I161 PolarHBondContact OE1-N 3.46Å; E158-A163 CarbonylContact O-C 3.57Å; E158-A163 WeakPolarHBondContact O-CA 3.41Å; E158-A163 PolarHBondContact O-N 2.81Å; E158-Q164 HydrophobicContact CB-CB 4.42Å; E158-Q164 HydrophobicContact CB-CG 3.94Å; E158-Q164 WeakPolarHBondContact O-CB 3.37Å; E158-Q164 PolarHBondContact O-N 2.84Å; E158-K183 HydrophobicContact CB-CB 3.97Å; E158-K183 WeakPolarHBondContact OE2-CG 3.41Å; E158-W184 PolarHBondContact N-O 3.35Å; E158-F185 HydrophobicContact CB-CE1 3.91Å; E158-F185 HydrophobicContact CB-CE2 3.85Å; E158-F185 HydrophobicContact CB-CZ 3.49Å; E158-F185 VanDerWaalsContact CB-CZ 3.49Å; E158-F185 HydrophobicContact CG-CE1 4.01Å; E158-F185 HydrophobicContact CG-CE2 4.39Å; E158-F185 HydrophobicContact CG-CZ 3.61Å
159	T	96.9	Very high	97.1	Very high	81 Å²	81	72.3 Å²	72.3	50%	0.497	41%	0.406	S	S	.	.			trans	-114.1	-13.1	-173	39.1	0	0	0	0	113.5	W157	W157-T159 HydrophobicContact CB-CG2 4.49Å; W157-T159 PolarHBondContact O-N 3.35Å
160	E	96	Very high	97.1	Very high	167 Å²	167	74.1 Å²	74.1	78%	0.78	41%	0.407	S	S	*	.	S	Bend	trans	-87.3	-38.5	-172.6	-56.4	-61	145.6	0	0	111.7	E158	E158-E160 WeakPolarHBondContact OE1-CA 3.11Å; E158-E160 WeakPolarHBondContact OE1-CB 3.45Å; E158-E160 PolarHBondContact OE1-N 3.23Å
161	I	95.8	Very high	97.2	Very high	148 Å²	148	73.6 Å²	73.6	76%	0.759	40%	0.397	S	S	*	.	S	Bend	trans	-102.8	-52.5	-174.7	-54.2	178.9	0	0	0	112.3	E158	E158-I161 PolarHBondContact OE1-N 3.46Å
162	T	94.1	Very high	97.2	Very high	58 Å²	58	66.8 Å²	66.8	36%	0.356	37%	0.374	S	S	.	.	S	Bend	trans	-114.1	-11.8	-170.8	53.1	0	0	0	0	114.5	Q164	T162-Q164 WeakPolarHBondContact OG1-CG 3.44Å
163	A	96.4	Very high	97.3	Very high	65 Å²	65	65.6 Å²	65.6	54%	0.537	37%	0.367	S	S	.	.			trans	58.1	54	-180	0	0	0	0	0	114	E158	E158-A163 CarbonylContact O-C 3.57Å; E158-A163 WeakPolarHBondContact O-CA 3.41Å; E158-A163 PolarHBondContact O-N 2.81Å
164	Q	98.1	Very high	97.4	Very high	17 Å²	17	60.6 Å²	60.6	8%	0.079	33%	0.326	C	S	.	.	S	Bend	trans	-65.8	154.5	177.3	-62.6	-75.9	-61.8	0	0	112.8	W157 E158 T162 D166 F185 D186	W157-Q164 HydrophobicContact CB-CB 4.21Å; W157-Q164 WeakPolarHBondContact CB-O 3.47Å; W157-Q164 HydrophobicContact CE3-CB 4.2Å; E158-Q164 HydrophobicContact CB-CB 4.42Å; E158-Q164 HydrophobicContact CB-CG 3.94Å; E158-Q164 WeakPolarHBondContact O-CB 3.37Å; E158-Q164 PolarHBondContact O-N 2.84Å; T162-Q164 WeakPolarHBondContact OG1-CG 3.44Å; Q164-D166 PolarHBondContact NE2-OD1 3.04Å; Q164-D166 PolarHBondContact NE2-OD2 3.43Å; Q164-F185 HydrophobicContact CG-CB 4.44Å; Q164-F185 HydrophobicContact CG-CD1 3.48Å; Q164-F185 VanDerWaalsContact CG-CD1 3.48Å; Q164-F185 HydrophobicContact CG-CE1 3.86Å; Q164-F185 HydrophobicContact CG-CG 4.07Å; Q164-F185 VanDerWaalsContact OE1-CB 3.29Å; Q164-D186 PolarHBondContact OE1-OD1 3.28Å
165	P	97.8	Very high	97.4	Very high	51 Å²	51	58.1 Å²	58.1	33%	0.331	32%	0.316	S	S	.	.	S	Bend	cis	-73.9	140.6	-9.2	29.7	-33.3	0	0	0	112.3	W144 W157 D186	W144-P165 HydrophobicContact CZ2-CB 3.81Å; W144-P165 HydrophobicContact CZ2-CG 4.18Å; W157-P165 HydrophobicContact CE3-CB 4.48Å; W157-P165 HydrophobicContact CZ3-CB 4.41Å; P165-D186 WeakPolarHBondContact CA-OD1 3.48Å; P165-D186 HydrophobicContact CB-CB 3.8Å; P165-D186 VanDerWaalsContact CB-CG 3.42Å; P165-D186 WeakPolarHBondContact CB-OD1 3.26Å
166	D	97.4	Very high	97.5	Very high	90 Å²	90	52.5 Å²	52.5	48%	0.481	29%	0.292	S	S	.	.			trans	-130.4	-6.5	-171.4	70	1.8	0	0	0	116.1	Q164 D186	Q164-D166 PolarHBondContact NE2-OD1 3.04Å; Q164-D166 PolarHBondContact NE2-OD2 3.43Å; D166-D186 PolarHBondContact N-OD1 2.64Å; D166-D186 PolarHBondContact N-OD2 2.93Å
167	G	95.7	Very high	97.5	Very high	17 Å²	17	51.6 Å²	51.6	18%	0.175	29%	0.287	C	S	.	.	S	Bend	trans	-87	-2.3	-175.8	0	0	0	0	0	115.3	T170 E171 D186	G167-T170 PolarHBondContact O-N 3.1Å; G167-T170 PolarHBondContact O-OG1 2.77Å; G167-E171 WeakPolarHBondContact CA-OE2 3.11Å; G167-D186 WeakPolarHBondContact CA-OD2 3.09Å; G167-D186 PolarHBondContact N-OD2 2.87Å
168	G	96.4	Very high	97.5	Very high	24 Å²	24	50.8 Å²	50.8	25%	0.247	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	54.7	-141.6	176.4	0	0	0	0	0	112.7	E141 T170 E171	E141-G168 VanDerWaalsContact CD-C 3.49Å; E141-G168 WeakPolarHBondContact OE1-CA 3.48Å; G168-T170 PolarHBondContact O-N 3.18Å; G168-E171 PolarHBondContact O-N 2.79Å; G168-E171 VanDerWaalsContact O-N 3.08Å
169	K	96.4	Very high	97.4	Very high	172 Å²	172	52.5 Å²	52.5	75%	0.748	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-60.7	-8.7	-179.8	-66.2	-176.2	178.8	-175.9	0	115.6	E141 N172	E141-K169 HydrophobicContact CG-CG 4.31Å; E141-K169 WeakPolarHBondContact OE2-CA 3.47Å; E141-K169 WeakPolarHBondContact OE2-CG 3.31Å; E141-K169 PolarHBondContact OE2-N 3.08Å; K169-N172 PolarHBondContact O-ND2 2.76Å
170	T	97.8	Very high	97.5	Very high	88 Å²	88	49.4 Å²	49.4	54%	0.54	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-92.4	-25.5	-179.8	67.8	0	0	0	0	112.9	G167 G168	G167-T170 PolarHBondContact O-N 3.1Å; G167-T170 PolarHBondContact O-OG1 2.77Å; G168-T170 PolarHBondContact O-N 3.18Å
171	E	98.5	Very high	97.6	Very high	35 Å²	35	47.3 Å²	47.3	16%	0.164	28%	0.279	C	S	.	.			trans	-123.3	90.7	-173.7	-59.9	-163.2	139	0	0	109.1	G167 G168 D186 K187 R188	G167-E171 WeakPolarHBondContact CA-OE2 3.11Å; G168-E171 PolarHBondContact O-N 2.79Å; G168-E171 VanDerWaalsContact O-N 3.08Å; E171-D186 HydrophobicContact CB-CB 3.98Å; E171-D186 WeakPolarHBondContact CB-OD2 3.47Å; E171-D186 WeakPolarHBondContact O-CB 3.41Å; E171-K187 CarbonylContact C-O 3.57Å; E171-K187 VanDerWaalsContact CA-O 3.31Å; E171-K187 WeakPolarHBondContact CA-O 3.31Å; E171-R188 HydrophobicContact CG-CG 3.87Å
172	N	98.8	Very high	97.7	Very high	29 Å²	29	40.2 Å²	40.2	16%	0.155	24%	0.243	C	C	.	.			trans	-109.7	11.5	-168.5	-53.8	-97.7	0	0	0	113	N136 D137 M138 K169 K187 C189	N136-N172 WeakPolarHBondContact CA-O 3.45Å; N136-N172 WeakPolarHBondContact CB-O 3.4Å; D137-N172 PolarHBondContact N-O 2.89Å; D137-N172 WeakPolarHBondContact OD1-CA 3.38Å; D137-N172 WeakPolarHBondContact OD1-CB 3.3Å; M138-N172 HydrophobicContact CB-CB 4.35Å; M138-N172 HydrophobicContact CG-CB 3.63Å; K169-N172 PolarHBondContact O-ND2 2.76Å; N172-K187 PolarHBondContact N-O 3.44Å; N172-C189 VanDerWaalsContact C-SG 3.59Å
173	C	98.8	Very high	97.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	134.3	-174.2	-72.6	0	0	0	0	111	F91 W132 M138 D186 K187 C189	F91-C173 HydrophobicContact CB-CB 4.38Å; F91-C173 HydrophobicContact CD2-CB 3.7Å; F91-C173 WeakPolarHBondContact CD2-SG 3.33Å; F91-C173 HydrophobicContact CE2-CB 4.13Å; F91-C173 HydrophobicContact CG-CB 4.12Å; F91-C173 WeakPolarHBondContact CG-SG 3.47Å; W132-C173 HydrophobicContact CE3-CB 4.09Å; W132-C173 HydrophobicContact CH2-CB 4.14Å; W132-C173 HydrophobicContact CZ3-CB 3.48Å; W132-C173 VanDerWaalsContact CZ3-CB 3.48Å; M138-C173 WeakPolarHBondContact CE-SG 3.34Å; C173-D186 CarbonylContact O-C 3.48Å; C173-D186 WeakPolarHBondContact O-CA 3.35Å; C173-K187 PolarHBondContact N-O 2.84Å; C173-K187 PolarHBondContact O-N 3.23Å; C173-C189 HydrophobicContact CB-CB 4.01Å; C173-C189 WeakPolarHBondContact CB-SG 3.42Å; C173-C189 VanDerWaalsContact SG-CA 3.53Å; C173-C189 WeakPolarHBondContact SG-CB 3.36Å; C173-C189 CovalentContact SG-SG 2.03Å; C173-C189 PolarHBondContact SG-SG 2.89Å
174	A	98.8	Very high	98	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	143.9	-177.4	0	0	0	0	0	111.5	L133 L135 W144 W157 F185	L133-A174 HydrophobicContact CB-CB 4.16Å; L133-A174 HydrophobicContact CD1-CB 4.35Å; L133-A174 PolarHBondContact N-O 2.94Å; L135-A174 HydrophobicContact CB-CB 3.8Å; L135-A174 HydrophobicContact CD1-CB 4.42Å; L135-A174 PolarHBondContact O-N 3.26Å; L135-A174 VanDerWaalsContact O-N 3.07Å; W144-A174 HydrophobicContact CE3-CB 4.23Å; W144-A174 HydrophobicContact CH2-CB 4.29Å; W144-A174 HydrophobicContact CZ3-CB 3.64Å; W157-A174 HydrophobicContact CH2-CB 3.68Å; W157-A174 HydrophobicContact CZ3-CB 4.16Å; A174-F185 CarbonylContact C-O 3.46Å; A174-F185 WeakPolarHBondContact CA-O 3.37Å
175	V	98.9	Very high	98	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.6	168.7	-58.4	0	0	0	0	110.7	I131 W132 W184 F185 K187 L193	I131-V175 CarbonylContact O-C 3.54Å; I131-V175 WeakPolarHBondContact O-CA 3.16Å; I131-V175 WeakPolarHBondContact O-CB 3.31Å; W132-V175 HydrophobicContact CD2-CG1 4.31Å; W132-V175 HydrophobicContact CE3-CG1 3.45Å; W132-V175 VanDerWaalsContact CE3-CG1 3.45Å; W132-V175 HydrophobicContact CH2-CG1 4.19Å; W132-V175 HydrophobicContact CZ3-CG1 3.37Å; V175-W184 WeakPolarHBondContact O-CA 3.33Å; V175-W184 WeakPolarHBondContact O-CB 3.45Å; V175-F185 HydrophobicContact CG2-CB 3.74Å; V175-F185 WeakPolarHBondContact CG2-O 3.4Å; V175-F185 PolarHBondContact N-O 3.38Å; V175-F185 PolarHBondContact O-N 3.04Å; V175-F185 VanDerWaalsContact O-N 3.11Å; V175-K187 HydrophobicContact CB-CG 4.4Å; V175-K187 HydrophobicContact CG1-CB 4.05Å; V175-K187 HydrophobicContact CG1-CG 3.72Å; V175-K187 HydrophobicContact CG2-CG 3.72Å; V175-L193 HydrophobicContact CB-CD1 4.47Å; V175-L193 HydrophobicContact CG1-CD1 3.44Å; V175-L193 VanDerWaalsContact CG1-CD1 3.44Å
176	L	98.8	Very high	98.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.2	164.7	-175.4	156.9	0	0	0	108.2	N114 L117 Y118 L121 E130 I131 L133	N114-L176 WeakPolarHBondContact OD1-CD1 3.39Å; L117-L176 HydrophobicContact CD2-CD1 4.19Å; L117-L176 HydrophobicContact CG-CD1 4.35Å; Y118-L176 HydrophobicContact CD2-CD2 4.38Å; L121-L176 HydrophobicContact CD2-CD2 3.37Å; E130-L176 WeakPolarHBondContact CA-O 3.21Å; I131-L176 HydrophobicContact CG1-CB 4.11Å; I131-L176 PolarHBondContact N-O 3.2Å; I131-L176 PolarHBondContact O-N 3.34Å; L133-L176 HydrophobicContact CD1-CB 4.09Å; L133-L176 HydrophobicContact CD2-CB 3.91Å; L133-L176 HydrophobicContact CD2-CD1 4.39Å; L133-L176 HydrophobicContact CG-CB 3.99Å
177	S	98.6	Very high	98.1	Very high	5 Å²	5	34.2 Å²	34.2	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124	-178.2	-177.2	0	0	0	0	111.7	E130 A180 G182 K183	E130-S177 PolarHBondContact OE1-OG 2.99Å; S177-A180 PolarHBondContact O-N 2.78Å; S177-G182 WeakPolarHBondContact O-CA 3.43Å; S177-G182 PolarHBondContact O-N 3.35Å; S177-K183 PolarHBondContact N-O 3.09Å
178	G	98.3	Very high	98.3	Very high	4 Å²	4	40.1 Å²	40.1	4%	0.041	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-40	173.4	0	0	0	0	0	112.1	N127 A129 A180 N181	N127-G178 CarbonylContact O-C 3.12Å; N127-G178 VanDerWaalsContact O-CA 3.3Å; N127-G178 WeakPolarHBondContact O-CA 3.14Å; A129-G178 PolarHBondContact O-N 3Å; G178-A180 PolarHBondContact O-N 2.96Å; G178-N181 PolarHBondContact O-N 3.47Å
179	A	97.9	Very high	98.4	Very high	52 Å²	52	39.7 Å²	39.7	43%	0.43	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.2	177.9	0	0	0	0	0	112.7	N127 E128	N127-A179 PolarHBondContact O-N 2.85Å; E128-A179 HydrophobicContact CB-CB 4.45Å; E128-A179 WeakPolarHBondContact OE2-CA 3.39Å; E128-A179 WeakPolarHBondContact OE2-CB 3.44Å
180	A	97.9	Very high	98.5	Very high	16 Å²	16	42 Å²	42	13%	0.132	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	30.1	179.8	0	0	0	0	0	113	S177 G178 G182 K183 F185	S177-A180 PolarHBondContact O-N 2.78Å; G178-A180 PolarHBondContact O-N 2.96Å; A180-G182 VanDerWaalsContact C-N 3.28Å; A180-G182 PolarHBondContact O-N 2.94Å; A180-K183 HydrophobicContact CB-CB 3.99Å; A180-K183 VanDerWaalsContact O-CB 3.22Å; A180-K183 WeakPolarHBondContact O-CB 3.24Å; A180-K183 WeakPolarHBondContact O-CG 3.33Å; A180-K183 PolarHBondContact O-N 3.41Å; A180-K183 VanDerWaalsContact O-N 3.08Å; A180-F185 HydrophobicContact CB-CE2 3.54Å; A180-F185 HydrophobicContact CB-CZ 3.95Å
181	N	97.6	Very high	98.5	Very high	122 Å²	122	40.4 Å²	40.4	65%	0.652	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	40	176.4	-53.7	-68.3	0	0	0	113.7	G178 K183	G178-N181 PolarHBondContact O-N 3.47Å; N181-K183 VanDerWaalsContact C-N 3.31Å; N181-K183 PolarHBondContact O-N 3.38Å
182	G	98	Very high	98.5	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	14.7	178.4	0	0	0	0	0	114.5	N114 N156 S177 A180	N114-G182 PolarHBondContact ND2-O 2.03Å; N156-G182 PolarHBondContact ND2-O 2.84Å; S177-G182 WeakPolarHBondContact O-CA 3.43Å; S177-G182 PolarHBondContact O-N 3.35Å; A180-G182 VanDerWaalsContact C-N 3.28Å; A180-G182 PolarHBondContact O-N 2.94Å
183	K	98.7	Very high	98.5	Very high	60 Å²	60	42.8 Å²	42.8	26%	0.261	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	155.2	171.3	-66.4	-71.5	-179.1	-175.8	0	111.9	N156 E158 S177 A180 N181 F185	N156-K183 CarbonylContact O-C 3.57Å; N156-K183 WeakPolarHBondContact O-CA 3.28Å; N156-K183 VanDerWaalsContact O-CD 3.3Å; N156-K183 WeakPolarHBondContact O-CD 3.34Å; N156-K183 PolarHBondContact OD1-NZ 3.18Å; E158-K183 HydrophobicContact CB-CB 3.97Å; E158-K183 WeakPolarHBondContact OE2-CG 3.41Å; S177-K183 PolarHBondContact N-O 3.09Å; A180-K183 HydrophobicContact CB-CB 3.99Å; A180-K183 VanDerWaalsContact O-CB 3.22Å; A180-K183 WeakPolarHBondContact O-CB 3.24Å; A180-K183 WeakPolarHBondContact O-CG 3.33Å; A180-K183 PolarHBondContact O-N 3.41Å; A180-K183 VanDerWaalsContact O-N 3.08Å; N181-K183 VanDerWaalsContact C-N 3.31Å; N181-K183 PolarHBondContact O-N 3.38Å; K183-F185 HydrophobicContact CB-CE2 4.45Å
184	W	98.8	Very high	98.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	147.4	-175	-51.8	-10.8	0	0	0	112.1	P108 N114 L133 L135 I152 Y154 K155 N156 W157 E158 V175	P108-W184 HydrophobicContact CG-CH2 4.49Å; P108-W184 HydrophobicContact CG-CZ2 3.71Å; N114-W184 PolarHBondContact OD1-NE1 2.88Å; L133-W184 HydrophobicContact CD1-CD2 3.71Å; L133-W184 HydrophobicContact CD1-CE3 4.32Å; L133-W184 HydrophobicContact CD1-CG 3.8Å; L133-W184 HydrophobicContact CD1-CZ2 4.28Å; L135-W184 HydrophobicContact CD1-CE3 4.08Å; L135-W184 HydrophobicContact CD1-CH2 3.95Å; L135-W184 HydrophobicContact CD1-CZ3 3.53Å; I152-W184 HydrophobicContact CD1-CZ3 4.28Å; Y154-W184 AromaticContact CD1-CH2 3.65Å; Y154-W184 HydrophobicContact CD1-CH2 3.65Å; Y154-W184 AromaticContact CD1-CZ2 3.71Å; Y154-W184 HydrophobicContact CD1-CZ2 3.71Å; Y154-W184 AromaticContact CE1-CH2 3.92Å; Y154-W184 HydrophobicContact CE1-CH2 3.92Å; Y154-W184 AromaticContact CE1-CZ2 3.51Å; Y154-W184 HydrophobicContact CE1-CZ2 3.51Å; Y154-W184 WeakPolarHBondContact O-CH2 3.42Å; K155-W184 HydrophobicContact CB-CZ3 4.42Å; N156-W184 HydrophobicContact CB-CD2 3.97Å; N156-W184 HydrophobicContact CB-CG 4.21Å; N156-W184 HydrophobicContact CB-CZ2 3.97Å; N156-W184 PolarHBondContact O-N 3.11Å; W157-W184 HydrophobicContact CD2-CB 4.12Å; W157-W184 HydrophobicContact CD2-CE3 4.28Å; W157-W184 HydrophobicContact CE3-CB 3.49Å; W157-W184 VanDerWaalsContact CE3-CB 3.49Å; W157-W184 HydrophobicContact CZ2-CE3 4.24Å; W157-W184 HydrophobicContact CZ3-CB 3.77Å; E158-W184 PolarHBondContact N-O 3.35Å; V175-W184 WeakPolarHBondContact O-CA 3.33Å; V175-W184 WeakPolarHBondContact O-CB 3.45Å
185	F	98.8	Very high	98.5	Very high	33 Å²	33	43.9 Å²	43.9	15%	0.145	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.5	175.4	-66.4	-103.3	0	0	0	109.6	E158 Q164 A174 V175 A180 K183	E158-F185 HydrophobicContact CB-CE1 3.91Å; E158-F185 HydrophobicContact CB-CE2 3.85Å; E158-F185 HydrophobicContact CB-CZ 3.49Å; E158-F185 VanDerWaalsContact CB-CZ 3.49Å; E158-F185 HydrophobicContact CG-CE1 4.01Å; E158-F185 HydrophobicContact CG-CE2 4.39Å; E158-F185 HydrophobicContact CG-CZ 3.61Å; Q164-F185 HydrophobicContact CG-CB 4.44Å; Q164-F185 HydrophobicContact CG-CD1 3.48Å; Q164-F185 VanDerWaalsContact CG-CD1 3.48Å; Q164-F185 HydrophobicContact CG-CE1 3.86Å; Q164-F185 HydrophobicContact CG-CG 4.07Å; Q164-F185 VanDerWaalsContact OE1-CB 3.29Å; A174-F185 CarbonylContact C-O 3.46Å; A174-F185 WeakPolarHBondContact CA-O 3.37Å; V175-F185 HydrophobicContact CG2-CB 3.74Å; V175-F185 WeakPolarHBondContact CG2-O 3.4Å; V175-F185 PolarHBondContact N-O 3.38Å; V175-F185 PolarHBondContact O-N 3.04Å; V175-F185 VanDerWaalsContact O-N 3.11Å; A180-F185 HydrophobicContact CB-CE2 3.54Å; A180-F185 HydrophobicContact CB-CZ 3.95Å; K183-F185 HydrophobicContact CB-CE2 4.45Å
186	D	98.6	Very high	98.5	Very high	5 Å²	5	43.9 Å²	43.9	3%	0.027	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	144.7	162.4	60.1	-41.1	0	0	0	110.1	W144 Q164 P165 D166 G167 E171 C173	W144-D186 HydrophobicContact CH2-CB 3.75Å; W144-D186 HydrophobicContact CZ2-CB 3.79Å; Q164-D186 PolarHBondContact OE1-OD1 3.28Å; P165-D186 WeakPolarHBondContact CA-OD1 3.48Å; P165-D186 HydrophobicContact CB-CB 3.8Å; P165-D186 VanDerWaalsContact CB-CG 3.42Å; P165-D186 WeakPolarHBondContact CB-OD1 3.26Å; D166-D186 PolarHBondContact N-OD1 2.64Å; D166-D186 PolarHBondContact N-OD2 2.93Å; G167-D186 WeakPolarHBondContact CA-OD2 3.09Å; G167-D186 PolarHBondContact N-OD2 2.87Å; E171-D186 HydrophobicContact CB-CB 3.98Å; E171-D186 WeakPolarHBondContact CB-OD2 3.47Å; E171-D186 WeakPolarHBondContact O-CB 3.41Å; C173-D186 CarbonylContact O-C 3.48Å; C173-D186 WeakPolarHBondContact O-CA 3.35Å
187	K	98.6	Very high	98.4	Very high	56 Å²	56	43.9 Å²	43.9	24%	0.243	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.3	179.8	-73.9	-69.3	-170.3	-171.9	0	110.3	E130 W132 E171 N172 C173 V175 C189	E130-K187 VanDerWaalsContact OE2-CE 3.25Å; E130-K187 WeakPolarHBondContact OE2-CE 3.25Å; E130-K187 IonicContact OE2-NZ 2.79Å; W132-K187 HydrophobicContact CH2-CB 3.95Å; W132-K187 HydrophobicContact CZ3-CB 3.98Å; E171-K187 CarbonylContact C-O 3.57Å; E171-K187 VanDerWaalsContact CA-O 3.31Å; E171-K187 WeakPolarHBondContact CA-O 3.31Å; N172-K187 PolarHBondContact N-O 3.44Å; C173-K187 PolarHBondContact N-O 2.84Å; C173-K187 PolarHBondContact O-N 3.23Å; V175-K187 HydrophobicContact CB-CG 4.4Å; V175-K187 HydrophobicContact CG1-CB 4.05Å; V175-K187 HydrophobicContact CG1-CG 3.72Å; V175-K187 HydrophobicContact CG2-CG 3.72Å; K187-C189 PolarHBondContact O-N 3.08Å
188	R	98.8	Very high	98.3	Very high	142 Å²	142	45 Å²	45	54%	0.536	22%	0.223	S	C	.	.			trans	-66.2	121.4	169.8	-59.2	-179.5	-176.9	168.2	2.3	108.9	W132 E171 R190 D191	W132-R188 WeakPolarHBondContact CH2-O 3.37Å; E171-R188 HydrophobicContact CG-CG 3.87Å; R188-R190 PolarHBondContact O-N 3.22Å; R188-D191 WeakPolarHBondContact O-CB 3.24Å; R188-D191 PolarHBondContact O-N 3.26Å
189	C	98.8	Very high	98.1	Very high	15 Å²	15	45.4 Å²	45.4	10%	0.101	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.1	-177.9	-57.9	0	0	0	0	115.4	F91 M138 N172 C173 K187	F91-C189 HydrophobicContact CB-CB 4.11Å; F91-C189 WeakPolarHBondContact CB-O 3.49Å; F91-C189 PolarHBondContact N-O 2.97Å; M138-C189 HydrophobicContact CE-CB 4.06Å; M138-C189 WeakPolarHBondContact CE-SG 3.41Å; N172-C189 VanDerWaalsContact C-SG 3.59Å; C173-C189 HydrophobicContact CB-CB 4.01Å; C173-C189 WeakPolarHBondContact CB-SG 3.42Å; C173-C189 VanDerWaalsContact SG-CA 3.53Å; C173-C189 WeakPolarHBondContact SG-CB 3.36Å; C173-C189 CovalentContact SG-SG 2.03Å; C173-C189 PolarHBondContact SG-SG 2.89Å; K187-C189 PolarHBondContact O-N 3.08Å
190	R	98.6	Very high	97.6	Very high	219 Å²	219	45.3 Å²	45.3	83%	0.826	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.3	178	-64.3	-176.8	-177.1	161.1	1.9	113.5	T90 R188	T90-R190 WeakPolarHBondContact CG2-O 3.45Å; R188-R190 PolarHBondContact O-N 3.22Å
191	D	98.6	Very high	96.9	Very high	55 Å²	55	46.3 Å²	46.3	29%	0.294	23%	0.23	S	C	.	.	S	Bend	trans	-67.2	141.2	176.4	-67.3	-14.9	0	0	0	109.5	T90 W132 R188 L193	T90-D191 WeakPolarHBondContact CA-O 3.37Å; W132-D191 HydrophobicContact CZ2-CB 4.35Å; W132-D191 VanDerWaalsContact CZ2-O 3.26Å; W132-D191 WeakPolarHBondContact CZ2-O 3.36Å; R188-D191 WeakPolarHBondContact O-CB 3.24Å; R188-D191 PolarHBondContact O-N 3.26Å; D191-L193 PolarHBondContact O-N 3.38Å
192	P	98.6	Very high	95.7	Very high	89 Å²	89	49.5 Å²	49.5	58%	0.578	25%	0.254	S	S	*	.			trans	-84.3	112.5	175.2	31	-31.3	0	0	0	109.6	A88	A88-P192 HydrophobicContact CB-CB 4.02Å
193	L	98.8	Very high	95.6	Very high	25 Å²	25	52 Å²	52	13%	0.131	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151	175.9	-64.2	175.5	0	0	0	111.7	A88 K89 E130 W132 V175 D191	A88-L193 VanDerWaalsContact CA-O 3.31Å; A88-L193 WeakPolarHBondContact CA-O 3.35Å; K89-L193 PolarHBondContact N-O 3.03Å; K89-L193 PolarHBondContact O-N 3.48Å; E130-L193 HydrophobicContact CB-CD2 4.44Å; W132-L193 HydrophobicContact CD2-CB 4.39Å; W132-L193 HydrophobicContact CD2-CD1 4.14Å; W132-L193 HydrophobicContact CE3-CD1 4.28Å; W132-L193 HydrophobicContact CG-CB 4.46Å; W132-L193 HydrophobicContact CH2-CD1 3.87Å; W132-L193 HydrophobicContact CZ2-CB 4.31Å; W132-L193 HydrophobicContact CZ2-CD1 3.76Å; W132-L193 HydrophobicContact CZ2-CG 4.09Å; W132-L193 HydrophobicContact CZ3-CD1 4.15Å; V175-L193 HydrophobicContact CB-CD1 4.47Å; V175-L193 HydrophobicContact CG1-CD1 3.44Å; V175-L193 VanDerWaalsContact CG1-CD1 3.44Å; D191-L193 PolarHBondContact O-N 3.38Å
194	P	98.7	Very high	95.4	Very high	21 Å²	21	51.6 Å²	51.6	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	166.3	165.5	30.4	-34.1	0	0	0	110	F85 V125 E130 I131 W132	F85-P194 WeakPolarHBondContact O-CA 3.32Å; F85-P194 WeakPolarHBondContact O-CB 3.38Å; V125-P194 HydrophobicContact CG1-CB 3.89Å; V125-P194 HydrophobicContact CG1-CG 3.67Å; E130-P194 WeakPolarHBondContact O-CD 3.46Å; E130-P194 VanDerWaalsContact O-CG 3.24Å; E130-P194 WeakPolarHBondContact O-CG 3.46Å; I131-P194 VanDerWaalsContact CA-O 3.31Å; I131-P194 WeakPolarHBondContact CA-O 3.3Å; I131-P194 HydrophobicContact CG2-CB 4.31Å; I131-P194 HydrophobicContact CG2-CG 4.06Å; W132-P194 PolarHBondContact N-O 3.24Å
195	Y	98.8	Very high	95.3	Very high	3 Å²	3	54.4 Å²	54.4	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.5	-174.5	57	-80	0	0	0	110.8	F85 Q87 K89 A94 D97 L105	F85-Y195 HydrophobicContact CB-CD1 4.26Å; F85-Y195 HydrophobicContact CB-CD2 4.11Å; F85-Y195 HydrophobicContact CB-CE1 3.82Å; F85-Y195 HydrophobicContact CB-CE2 3.68Å; F85-Y195 HydrophobicContact CB-CG 4.38Å; F85-Y195 VanDerWaalsContact CB-CZ 3.5Å; F85-Y195 HydrophobicContact CD2-CD2 4.08Å; F85-Y195 AromaticContact CD2-CE2 3.68Å; F85-Y195 HydrophobicContact CD2-CE2 3.68Å; F85-Y195 HydrophobicContact CG-CD2 4.41Å; F85-Y195 AromaticContact CG-CE2 3.77Å; F85-Y195 HydrophobicContact CG-CE2 3.77Å; F85-Y195 AromaticContact CG-CZ 3.92Å; F85-Y195 PolarHBondContact N-O 3.48Å; F85-Y195 PolarHBondContact O-N 2.91Å; F85-Y195 VanDerWaalsContact O-N 3.08Å; Q87-Y195 WeakPolarHBondContact O-CE1 3.09Å; K89-Y195 HydrophobicContact CB-CD1 4.38Å; K89-Y195 HydrophobicContact CB-CE1 4.1Å; K89-Y195 HydrophobicContact CD-CE1 3.62Å; K89-Y195 WeakPolarHBondContact CE-OH 3.48Å; K89-Y195 HydrophobicContact CG-CE1 3.89Å; A94-Y195 HydrophobicContact CB-CD1 3.68Å; A94-Y195 HydrophobicContact CB-CD2 4Å; A94-Y195 HydrophobicContact CB-CE1 4.19Å; A94-Y195 HydrophobicContact CB-CE2 4.45Å; A94-Y195 HydrophobicContact CB-CG 3.59Å; D97-Y195 HydrophobicContact CB-CE2 4.24Å; D97-Y195 WeakPolarHBondContact OD2-CE2 3.22Å; D97-Y195 PolarHBondContact OD2-OH 3.26Å; L105-Y195 HydrophobicContact CD2-CD2 4.28Å; L105-Y195 HydrophobicContact CD2-CG 4.41Å
196	I	98.4	Very high	95	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.9	174.8	-58.6	-168.5	0	0	0	107.1	F82 L83 A84 G106 L117 Y120 L121 I131	F82-I196 HydrophobicContact CB-CG2 3.76Å; F82-I196 HydrophobicContact CD1-CG2 4.2Å; F82-I196 HydrophobicContact CG-CG2 4.42Å; L83-I196 WeakPolarHBondContact O-CA 3.33Å; A84-I196 HydrophobicContact CB-CD1 4.07Å; A84-I196 HydrophobicContact CB-CG1 3.86Å; G106-I196 WeakPolarHBondContact CA-O 3.31Å; G106-I196 PolarHBondContact N-O 3.26Å; L117-I196 HydrophobicContact CD1-CB 4.12Å; L117-I196 HydrophobicContact CD1-CD1 3.88Å; L117-I196 HydrophobicContact CD1-CG2 3.75Å; Y120-I196 HydrophobicContact CD1-CD1 3.78Å; Y120-I196 HydrophobicContact CD1-CG2 4.27Å; Y120-I196 HydrophobicContact CE1-CD1 4.08Å; Y120-I196 HydrophobicContact CE1-CG2 4.11Å; L121-I196 HydrophobicContact CB-CD1 4.26Å; I131-I196 HydrophobicContact CD1-CB 4.11Å; I131-I196 HydrophobicContact CD1-CD1 3.46Å; I131-I196 VanDerWaalsContact CD1-CD1 3.46Å; I131-I196 HydrophobicContact CD1-CG1 3.58Å; I131-I196 HydrophobicContact CG2-CG1 4.2Å
197	C	97.8	Very high	94.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	145.9	172.6	-56.5	0	0	0	0	109.9	F82 L83 F85 C98 T104 F199	F82-C197 CarbonylContact C-O 3.1Å; F82-C197 VanDerWaalsContact CA-O 3.25Å; F82-C197 WeakPolarHBondContact CA-O 3.1Å; L83-C197 PolarHBondContact N-O 3.34Å; L83-C197 PolarHBondContact O-N 3.47Å; F85-C197 HydrophobicContact CE2-CB 4.04Å; F85-C197 WeakPolarHBondContact CE2-SG 3.38Å; C98-C197 WeakPolarHBondContact CA-SG 3.42Å; C98-C197 HydrophobicContact CB-CB 3.75Å; C98-C197 WeakPolarHBondContact CB-SG 3.49Å; C98-C197 WeakPolarHBondContact SG-CA 3.45Å; C98-C197 WeakPolarHBondContact SG-CB 3.43Å; C98-C197 CovalentContact SG-SG 2.03Å; C98-C197 PolarHBondContact SG-SG 3.05Å; T104-C197 CarbonylContact O-C 3.36Å; T104-C197 VanDerWaalsContact O-CA 3.25Å; T104-C197 WeakPolarHBondContact O-CA 3.35Å; C197-F199 HydrophobicContact CB-CD2 4.48Å; C197-F199 HydrophobicContact CB-CE2 3.54Å; C197-F199 HydrophobicContact CB-CZ 3.66Å
198	Q	95.7	Very high	94.6	Very high	28 Å²	28	59.1 Å²	59.1	13%	0.131	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.7	167.8	69.9	178.2	22.2	0	0	111.2	C81 F82 G103 T104 T107	C81-Q198 CarbonylContact O-C 3.43Å; C81-Q198 VanDerWaalsContact O-CA 3.29Å; C81-Q198 WeakPolarHBondContact O-CA 3.3Å; F82-Q198 HydrophobicContact CD1-CB 3.66Å; F82-Q198 HydrophobicContact CE1-CB 3.52Å; F82-Q198 HydrophobicContact CZ-CB 4.49Å; G103-Q198 CarbonylContact C-O 3.54Å; G103-Q198 WeakPolarHBondContact CA-O 3.33Å; T104-Q198 PolarHBondContact N-O 3.19Å; T104-Q198 PolarHBondContact O-N 3.22Å; T104-Q198 VanDerWaalsContact OG1-CG 3.26Å; T104-Q198 WeakPolarHBondContact OG1-CG 3.38Å; T104-Q198 PolarHBondContact OG1-NE2 2.81Å; T104-Q198 VanDerWaalsContact OG1-NE2 3.13Å; T107-Q198 PolarHBondContact O-OE1 3.2Å
199	F	93.3	Very high	94.3	Very high	13 Å²	13	53.1 Å²	53.1	6%	0.057	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	128.9	179.6	-56.7	-92.2	0	0	0	108.8	L67 V70 K80 C81 L83 R101 C197	L67-F199 HydrophobicContact CD1-CB 3.99Å; V70-F199 HydrophobicContact CG1-CD2 3.39Å; V70-F199 HydrophobicContact CG1-CE2 3.64Å; V70-F199 HydrophobicContact CG1-CG 3.95Å; V70-F199 HydrophobicContact CG1-CZ 4.39Å; K80-F199 CarbonylContact C-O 3.53Å; K80-F199 WeakPolarHBondContact CA-O 3.43Å; C81-F199 PolarHBondContact N-O 3.23Å; C81-F199 PolarHBondContact O-N 3.17Å; L83-F199 HydrophobicContact CB-CE2 4Å; R101-F199 HydrophobicContact CB-CE1 3.93Å; R101-F199 HydrophobicContact CB-CZ 4.15Å; R101-F199 WeakPolarHBondContact O-CE1 3.02Å; C197-F199 HydrophobicContact CB-CD2 4.48Å; C197-F199 HydrophobicContact CB-CE2 3.54Å; C197-F199 HydrophobicContact CB-CZ 3.66Å
200	G	88.9	Confident	93.9	Very high	49 Å²	49	56.1 Å²	56.1	51%	0.505	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.8	174.5	0	0	0	0	0	110.6	V202	G200-V202 PolarHBondContact O-N 2.9Å
201	I	82.3	Confident	93.5	Very high	38 Å²	38	42.5 Å²	42.5	20%	0.195	27%	0.265	C	S	.	.			trans	-80.7	113.8	169.7	-57.6	177.2	0	0	0	107.5	K76 M79	K76-I201 HydrophobicContact CD-CD1 3.72Å; K76-I201 HydrophobicContact CG-CD1 3.98Å; M79-I201 HydrophobicContact CE-CB 4.04Å; M79-I201 HydrophobicContact CE-CG2 4.17Å; M79-I201 VanDerWaalsContact CE-O 3.25Å; M79-I201 WeakPolarHBondContact CE-O 3.43Å; M79-I201 PolarHBondContact O-N 3.4Å
202	V	72.8	Confident	93.1	Very high	189 Å²	189	41.4 Å²	41.4	100%	1.145	26%	0.263	S	S	*	.			trans	-102.9	0	176.7	-65.8	0	0	0	0	111.9	L67 G200	L67-V202 HydrophobicContact CD2-CG2 4.37Å; G200-V202 PolarHBondContact O-N 2.9Å

Retrieved 202 of 202 residues in 39.4 ms (Link to these results)

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