A0A669KBL4_HUMAN Loading...

Zinc finger protein AEBP2

Acts as an accessory subunit for the core Polycomb repressive complex 2 (PRC2), which mediates histone H3K27 (H3K27me3) trimethylation on chromatin leading to transcriptional repression of the affected target gene. Plays a role in nucleosome localization of the PRC2 complex.

AlphaFold DB , UniProt , Accession A0A669KBL4, Species HUMAN (Homo sapiens, Human), Gene AEBP2, Length 268 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.5	Very low	37	Very low	226 Å²	226	145.6 Å²	145.6	100%	1.113	83%	0.832	S	S	*	*				0	101.5	0	-61.9	172.6	-173	0	0	105.1
2	D	37.4	Very low	36.9	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	82%	0.824	S	S	*	*			cis	-144.4	171.3	10.6	-60.5	-60.5	0	0	0	111.2
3	V	40.4	Very low	37.2	Very low	144 Å²	144	141.7 Å²	141.7	87%	0.873	82%	0.824	S	S	*	*			trans	-114.5	141.4	-175.7	-63.7	0	0	0	0	111.2
4	D	34.1	Very low	37.6	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	82%	0.819	S	S	*	*				146.6	134.6	127.7	-165.9	-132.6	0	0	0	114.1
5	S	38	Very low	37	Very low	88 Å²	88	136.4 Å²	136.4	62%	0.615	81%	0.813	S	S	*	*			trans	31.1	138.2	151.3	-60.9	0	0	0	0	121.4
6	T	42.8	Very low	36.8	Very low	141 Å²	141	137.4 Å²	137.4	87%	0.865	81%	0.809	S	S	*	*				-162.6	168.2	50.5	-21.9	0	0	0	0	112.6
7	I	38.5	Very low	36.9	Very low	157 Å²	157	140.1 Å²	140.1	81%	0.805	81%	0.814	S	S	*	*			trans	-114.3	155.8	-164.6	-73.1	166.6	0	0	0	113.9
8	S	33.6	Very low	36.8	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	81%	0.814	S	S	*	*			trans	82.1	105.7	158	-86.9	0	0	0	0	122.3
9	S	35.2	Very low	36.8	Very low	122 Å²	122	136.9 Å²	136.9	85%	0.853	81%	0.809	S	S	*	*				31.4	134.9	104.1	-53.2	0	0	0	0	121.1
10	G	32.8	Very low	36.8	Very low	77 Å²	77	139.1 Å²	139.1	79%	0.794	81%	0.811	S	S	*	*			trans	151.7	73.6	144.5	0	0	0	0	0	120.4
11	R	32.8	Very low	36.4	Very low	250 Å²	250	135.6 Å²	135.6	94%	0.943	81%	0.805	S	S	*	*			trans	21.4	121.6	138.9	-150.7	177.1	-162.8	-161.4	3.8	120.2
12	S	35.9	Very low	35.9	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	79%	0.79	S	S	*	*			trans	-71.8	171.7	175.8	-42.7	0	0	0	0	116.4
13	T	40.7	Very low	35.6	Very low	135 Å²	135	129.2 Å²	129.2	83%	0.828	79%	0.789	S	S	*	*			trans	79.2	151.6	-175.6	74.6	0	0	0	0	113.9
14	P	42.8	Very low	35.4	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	79%	0.787	S	S	*	*			cis	-97.2	-158.5	15.4	36.5	-22.6	0	0	0	112.2	M16	P14-M16 HydrophobicContact CB-CE 4.32Å
15	A	28.9	Very low	35.5	Very low	88 Å²	88	126.1 Å²	126.1	73%	0.727	78%	0.78	S	S	*	*			cis	-151.9	178.9	13	0	0	0	0	0	116
16	M	33.4	Very low	35.9	Very low	152 Å²	152	128.3 Å²	128.3	75%	0.749	80%	0.795	S	S	*	*			trans	-77.6	136.2	-171.9	10.2	-73.7	159.9	0	0	115.9	P14	P14-M16 HydrophobicContact CB-CE 4.32Å
17	M	37.8	Very low	36	Very low	183 Å²	183	125.6 Å²	125.6	90%	0.901	78%	0.781	S	S	*	*			trans	-6.7	126.6	141.9	54.2	-171.6	72.3	0	0	117.8
18	N	36.7	Very low	36.6	Very low	150 Å²	150	127 Å²	127	80%	0.802	78%	0.782	S	S	*	*			trans	-110.4	109.3	168.6	-159	23.3	0	0	0	109.7
19	G	35.8	Very low	37.7	Very low	71 Å²	71	129 Å²	129	73%	0.732	79%	0.785	S	S	*	*			trans	-83.8	134	179.7	0	0	0	0	0	112
20	Q	37.4	Very low	39.4	Very low	179 Å²	179	128 Å²	128	84%	0.836	77%	0.769	S	S	*	*			trans	-126.6	105.2	166.1	-73.5	-168.7	-4.7	0	0	111.4
21	G	28.8	Very low	41.6	Very low	66 Å²	66	127.2 Å²	127.2	68%	0.68	76%	0.755	S	S	*	*			trans	60	63.3	137.3	0	0	0	0	0	117.8	T23	G21-T23 VanDerWaalsContact C-N 3.25Å; G21-T23 PolarHBondContact O-N 3.12Å
22	S	29.7	Very low	44	Very low	117 Å²	117	119 Å²	119	82%	0.818	72%	0.724	S	S	*	*			trans	-61.2	88.1	156.9	-58.6	0	0	0	0	110	T24	S22-T24 PolarHBondContact O-N 3.25Å
23	T	30.9	Very low	46.3	Very low	130 Å²	130	118.3 Å²	118.3	80%	0.798	71%	0.712	S	S	*	*			trans	-72.8	98.4	170.7	44.8	0	0	0	0	108.8	G21 S25	G21-T23 VanDerWaalsContact C-N 3.25Å; G21-T23 PolarHBondContact O-N 3.12Å; T23-S25 PolarHBondContact O-N 3.06Å
24	T	37.3	Very low	48.5	Very low	135 Å²	135	112.1 Å²	112.1	83%	0.828	68%	0.675	S	S	*	*			trans	-69	72.1	177.3	41.4	0	0	0	0	111.5	S22	S22-T24 PolarHBondContact O-N 3.25Å
25	S	35.2	Very low	50.7	Low	86 Å²	86	109.4 Å²	109.4	60%	0.601	66%	0.658	S	S	*	*			trans	-79.6	117.6	158.5	73.5	0	0	0	0	108.5	T23 S27	T23-S25 PolarHBondContact O-N 3.06Å; S25-S27 PolarHBondContact O-N 2.86Å; S25-S27 PolarHBondContact OG-OG 2.75Å
26	S	47.9	Very low	53.4	Low	133 Å²	133	106 Å²	106	93%	0.93	63%	0.626	S	S	*	*			trans	-70.2	69.4	173.5	-61.9	0	0	0	0	110.6
27	S	44.4	Very low	55.7	Low	84 Å²	84	100.9 Å²	100.9	59%	0.587	60%	0.602	S	S	*	*			trans	-92.4	122.8	-178.9	-65.9	0	0	0	0	109	S25 N29	S25-S27 PolarHBondContact O-N 2.86Å; S25-S27 PolarHBondContact OG-OG 2.75Å; S27-N29 PolarHBondContact O-N 2.77Å
28	K	50.2	Low	57.7	Low	186 Å²	186	101 Å²	101	81%	0.809	60%	0.6	S	S	*	*			trans	-53.6	124.9	178.9	-61.7	172.5	-177.6	177.7	0	109.1	I30	K28-I30 VanDerWaalsContact C-N 3.28Å; K28-I30 HydrophobicContact CB-CG1 4.39Å; K28-I30 PolarHBondContact O-N 2.74Å
29	N	57.2	Low	60	Low	144 Å²	144	95.1 Å²	95.1	77%	0.77	57%	0.571	S	S	*	*			trans	-66.4	87.8	176	-98.4	-55.3	0	0	0	109.7	S27 A31	S27-N29 PolarHBondContact O-N 2.77Å; N29-A31 PolarHBondContact O-N 3.38Å
30	I	70.1	Confident	62.2	Low	101 Å²	101	100.9 Å²	100.9	52%	0.518	58%	0.578	S	S	.	*			trans	-88.2	103.2	174.4	-65.3	159.2	0	0	0	106	K28 Y32	K28-I30 VanDerWaalsContact C-N 3.28Å; K28-I30 HydrophobicContact CB-CG1 4.39Å; K28-I30 PolarHBondContact O-N 2.74Å; I30-Y32 HydrophobicContact CB-CE2 4.47Å; I30-Y32 HydrophobicContact CG2-CE2 4.3Å; I30-Y32 WeakPolarHBondContact O-CD2 3.33Å; I30-Y32 VanDerWaalsContact O-CE2 3.22Å; I30-Y32 WeakPolarHBondContact O-CE2 3.47Å; I30-Y32 PolarHBondContact O-N 2.89Å
31	A	79.1	Confident	64.4	Low	61 Å²	61	93.7 Å²	93.7	50%	0.504	55%	0.55	S	S	.	.			trans	-69.2	126	173.4	0	0	0	0	0	110	N29	N29-A31 PolarHBondContact O-N 3.38Å
32	Y	82.9	Confident	67.2	Low	76 Å²	76	94.8 Å²	94.8	30%	0.298	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	103.3	176.9	-67.2	-89.3	0	0	0	108.8	I30 F43 S45	I30-Y32 HydrophobicContact CB-CE2 4.47Å; I30-Y32 HydrophobicContact CG2-CE2 4.3Å; I30-Y32 WeakPolarHBondContact O-CD2 3.33Å; I30-Y32 VanDerWaalsContact O-CE2 3.22Å; I30-Y32 WeakPolarHBondContact O-CE2 3.47Å; I30-Y32 PolarHBondContact O-N 2.89Å; Y32-F43 PolarHBondContact N-O 3.01Å; Y32-F43 PolarHBondContact O-N 3.37Å; Y32-S45 VanDerWaalsContact CD2-C 3.42Å
33	N	85.5	Confident	69.8	Low	91 Å²	91	91.5 Å²	91.5	49%	0.487	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.5	-176.6	-63.5	1.9	0	0	0	110.8	C35	N33-C35 PolarHBondContact O-N 3.45Å
34	C	87.4	Confident	72.3	Confident	6 Å²	6	91.5 Å²	91.5	4%	0.041	51%	0.512	C	S	.	.			trans	-79	111.5	172	-167.9	0	0	0	0	110	W36 A41 L49 H57	C34-W36 VanDerWaalsContact C-N 3.27Å; C34-W36 PolarHBondContact O-N 2.86Å; C34-A41 HydrophobicContact CB-CB 4.33Å; C34-A41 WeakPolarHBondContact CB-O 3.36Å; C34-A41 PolarHBondContact N-O 2.9Å; C34-L49 HydrophobicContact CB-CD1 3.73Å; C34-H57 PolarHBondContact SG-NE2 2.89Å
35	C	87.8	Confident	74.6	Confident	58 Å²	58	87 Å²	87	39%	0.392	49%	0.486	S	S	.	.			trans	-94.7	35.5	177	-57.3	0	0	0	0	112.2	N33 W70 K71	N33-C35 PolarHBondContact O-N 3.45Å; C35-W70 HydrophobicContact CB-CD2 4.18Å; C35-W70 HydrophobicContact CB-CH2 4.16Å; C35-W70 HydrophobicContact CB-CZ2 3.67Å; C35-W70 VanDerWaalsContact N-CH2 3.3Å; C35-W70 WeakPolarHBondContact O-CA 3.39Å; C35-K71 WeakPolarHBondContact O-CG 3.24Å; C35-K71 PolarHBondContact O-N 3.25Å
36	W	85.4	Confident	76.9	Confident	17 Å²	17	83.9 Å²	83.9	6%	0.064	46%	0.464	C	S	.	.	B	Isolated β-bridge	trans	-80.4	146.9	173.9	-165.9	-88.1	0	0	0	110.5	C34 Q38 C39 H57 V67 L69 W70 M90	C34-W36 VanDerWaalsContact C-N 3.27Å; C34-W36 PolarHBondContact O-N 2.86Å; W36-Q38 PolarHBondContact O-N 3.3Å; W36-C39 HydrophobicContact CB-CB 3.84Å; W36-C39 PolarHBondContact O-N 3.27Å; W36-H57 AromaticContact CD1-CE1 3.46Å; W36-H57 VanDerWaalsContact CD1-CE1 3.46Å; W36-H57 AromaticContact CD1-CG 3.72Å; W36-H57 AromaticContact CD1-ND1 3.35Å; W36-H57 AromaticContact CD1-NE2 3.87Å; W36-H57 HydrophobicContact CD2-CB 3.74Å; W36-H57 AromaticContact CD2-CD2 3.85Å; W36-H57 AromaticContact CD2-CG 3.61Å; W36-H57 AromaticContact CE2-CG 3.78Å; W36-H57 AromaticContact CE2-ND1 3.96Å; W36-H57 HydrophobicContact CE3-CB 3.98Å; W36-H57 HydrophobicContact CG-CB 4.28Å; W36-H57 AromaticContact CG-CD2 3.58Å; W36-H57 AromaticContact CG-CE1 3.73Å; W36-H57 AromaticContact CG-CG 3.61Å; W36-H57 AromaticContact CG-ND1 3.7Å; W36-H57 AromaticContact CG-NE2 3.66Å; W36-H57 HydrophobicContact CH2-CB 4.1Å; W36-H57 HydrophobicContact CZ2-CB 3.89Å; W36-H57 HydrophobicContact CZ3-CB 4.15Å; W36-H57 AromaticContact NE1-CG 3.83Å; W36-H57 AromaticContact NE1-ND1 3.53Å; W36-V67 WeakPolarHBondContact CH2-O 3.23Å; W36-L69 HydrophobicContact CD2-CB 4.23Å; W36-L69 HydrophobicContact CZ2-CB 3.83Å; W36-L69 HydrophobicContact CZ2-CD1 4.19Å; W36-L69 HydrophobicContact CZ2-CG 4.19Å; W36-W70 HydrophobicContact CE3-CB 4.4Å; W36-W70 HydrophobicContact CE3-CE3 4.3Å; W36-M90 HydrophobicContact CE3-SD 4.47Å; W36-M90 HydrophobicContact CH2-SD 4.42Å; W36-M90 HydrophobicContact CZ3-SD 3.61Å
37	D	82.2	Confident	78.5	Confident	44 Å²	44	80.1 Å²	80.1	24%	0.235	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	126.5	176.9	-168	45.6	0	0	0	111.4	C39 L69 K71	D37-C39 PolarHBondContact O-N 3.2Å; D37-L69 HydrophobicContact CB-CB 3.91Å; D37-L69 PolarHBondContact N-O 3.46Å; D37-K71 WeakPolarHBondContact OD1-CE 3.39Å; D37-K71 IonicContact OD1-NZ 3.11Å; D37-K71 PolarHBondContact OD1-NZ 2.94Å
38	Q	79.4	Confident	80.5	Confident	186 Å²	186	79.8 Å²	79.8	87%	0.869	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	17.9	-176.4	-52.1	163.3	47.4	0	0	115	W36	W36-Q38 PolarHBondContact O-N 3.3Å
39	C	85.3	Confident	82.3	Confident	27 Å²	27	71.1 Å²	71.1	18%	0.182	39%	0.391	C	S	.	.			trans	-109.9	141.6	168.6	-162.9	0	0	0	0	111.5	W36 D37 H52 H57	W36-C39 HydrophobicContact CB-CB 3.84Å; W36-C39 PolarHBondContact O-N 3.27Å; D37-C39 PolarHBondContact O-N 3.2Å; C39-H52 PolarHBondContact SG-NE2 2.88Å; C39-H57 WeakPolarHBondContact CB-NE2 3.34Å; C39-H57 PolarHBondContact SG-NE2 3.15Å
40	Q	81.8	Confident	83.7	Confident	192 Å²	192	64.3 Å²	64.3	90%	0.897	36%	0.355	S	S	*	.			trans	-133.6	20.7	179.7	-152.7	161.1	11.9	0	0	112.1
41	A	84.9	Confident	84.5	Confident	28 Å²	28	63.3 Å²	63.3	23%	0.231	35%	0.35	C	S	.	.			trans	-70.5	139.9	179.2	0	0	0	0	0	111.8	C34 F43	C34-A41 HydrophobicContact CB-CB 4.33Å; C34-A41 WeakPolarHBondContact CB-O 3.36Å; C34-A41 PolarHBondContact N-O 2.9Å; A41-F43 HydrophobicContact CB-CE2 3.58Å; A41-F43 HydrophobicContact CB-CZ 3.79Å
42	C	85.6	Confident	85	Confident	89 Å²	89	61.8 Å²	61.8	60%	0.601	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.6	177.7	56.5	0	0	0	0	110.3
43	F	85.6	Confident	85.2	Confident	48 Å²	48	58.2 Å²	58.2	21%	0.211	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	149.1	-173.4	-59.2	-86.5	0	0	0	110.8	Y32 A41 S45 D48 L49 H52	Y32-F43 PolarHBondContact N-O 3.01Å; Y32-F43 PolarHBondContact O-N 3.37Å; A41-F43 HydrophobicContact CB-CE2 3.58Å; A41-F43 HydrophobicContact CB-CZ 3.79Å; F43-S45 VanDerWaalsContact C-N 3.29Å; F43-D48 HydrophobicContact CB-CB 4.15Å; F43-D48 HydrophobicContact CD1-CB 3.79Å; F43-D48 HydrophobicContact CG-CB 4.23Å; F43-L49 HydrophobicContact CB-CB 4.23Å; F43-L49 HydrophobicContact CD2-CB 3.84Å; F43-L49 HydrophobicContact CD2-CD1 3.67Å; F43-L49 HydrophobicContact CD2-CG 4.37Å; F43-L49 HydrophobicContact CE2-CD1 3.9Å; F43-L49 HydrophobicContact CG-CB 4.19Å; F43-H52 HydrophobicContact CE1-CB 3.95Å; F43-H52 HydrophobicContact CE2-CB 3.73Å; F43-H52 AromaticContact CE2-CD2 3.57Å; F43-H52 AromaticContact CE2-CG 3.58Å; F43-H52 HydrophobicContact CZ-CB 3.31Å; F43-H52 AromaticContact CZ-CD2 3.78Å; F43-H52 AromaticContact CZ-CG 3.29Å; F43-H52 AromaticContact CZ-ND1 3.71Å
44	N	84.1	Confident	85.3	Confident	129 Å²	129	57.8 Å²	57.8	69%	0.69	31%	0.31	S	S	*	.	S	Bend	trans	-88.5	0.8	177.4	-61.9	-25.6	0	0	0	112.6
45	S	84.6	Confident	85.3	Confident	41 Å²	41	60.7 Å²	60.7	29%	0.287	33%	0.33	S	S	.	.	S	Bend	trans	-143	143.5	-174.8	-157.3	0	0	0	0	111.8	Y32 F43 P47 D48 L49	Y32-S45 VanDerWaalsContact CD2-C 3.42Å; F43-S45 VanDerWaalsContact C-N 3.29Å; S45-P47 VanDerWaalsContact OG-CD 3.31Å; S45-P47 WeakPolarHBondContact OG-CD 3.45Å; S45-P47 WeakPolarHBondContact OG-CG 3.37Å; S45-D48 VanDerWaalsContact CB-CG 3.44Å; S45-D48 WeakPolarHBondContact CB-OD2 3.28Å; S45-D48 PolarHBondContact O-N 3.46Å; S45-L49 PolarHBondContact O-N 2.83Å
46	S	83.2	Confident	85.2	Confident	20 Å²	20	62.7 Å²	62.7	14%	0.14	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-46.1	175	175.4	0	0	0	0	114	D48 L49 A50 S94	S46-D48 PolarHBondContact O-N 2.66Å; S46-L49 PolarHBondContact O-N 2.87Å; S46-A50 PolarHBondContact O-N 2.97Å; S46-S94 PolarHBondContact OG-O 2.8Å
47	P	82.7	Confident	85.3	Confident	54 Å²	54	62.9 Å²	62.9	35%	0.351	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-40.6	174.3	21.7	-34.9	0	0	0	113.1	S45 L49 A50 D51	S45-P47 VanDerWaalsContact OG-CD 3.31Å; S45-P47 WeakPolarHBondContact OG-CD 3.45Å; S45-P47 WeakPolarHBondContact OG-CG 3.37Å; P47-L49 VanDerWaalsContact C-N 3.35Å; P47-L49 PolarHBondContact O-N 2.83Å; P47-A50 CarbonylContact O-C 3.58Å; P47-A50 WeakPolarHBondContact O-CA 3.4Å; P47-A50 WeakPolarHBondContact O-CB 3.31Å; P47-A50 PolarHBondContact O-N 2.76Å; P47-D51 PolarHBondContact O-N 3.48Å
48	D	86.5	Confident	85.4	Confident	77 Å²	77	60.8 Å²	60.8	41%	0.412	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-42.5	-179.9	-51.4	-3.9	0	0	0	111.3	F43 S45 S46 A50 D51 H52	F43-D48 HydrophobicContact CB-CB 4.15Å; F43-D48 HydrophobicContact CD1-CB 3.79Å; F43-D48 HydrophobicContact CG-CB 4.23Å; S45-D48 VanDerWaalsContact CB-CG 3.44Å; S45-D48 WeakPolarHBondContact CB-OD2 3.28Å; S45-D48 PolarHBondContact O-N 3.46Å; S46-D48 PolarHBondContact O-N 2.66Å; D48-A50 VanDerWaalsContact C-N 3.32Å; D48-A50 PolarHBondContact O-N 2.98Å; D48-D51 PolarHBondContact O-N 3.01Å; D48-H52 WeakPolarHBondContact O-CB 3.28Å; D48-H52 PolarHBondContact O-N 2.94Å
49	L	87.2	Confident	85.6	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-62	-39.7	171.4	174.8	64.1	0	0	0	111.4	C34 F43 S45 S46 P47 I53	C34-L49 HydrophobicContact CB-CD1 3.73Å; F43-L49 HydrophobicContact CB-CB 4.23Å; F43-L49 HydrophobicContact CD2-CB 3.84Å; F43-L49 HydrophobicContact CD2-CD1 3.67Å; F43-L49 HydrophobicContact CD2-CG 4.37Å; F43-L49 HydrophobicContact CE2-CD1 3.9Å; F43-L49 HydrophobicContact CG-CB 4.19Å; S45-L49 PolarHBondContact O-N 2.83Å; S46-L49 PolarHBondContact O-N 2.87Å; P47-L49 VanDerWaalsContact C-N 3.35Å; P47-L49 PolarHBondContact O-N 2.83Å; L49-I53 HydrophobicContact CD1-CD1 3.72Å; L49-I53 HydrophobicContact CD1-CG1 4.07Å; L49-I53 HydrophobicContact CD2-CD1 4.36Å; L49-I53 HydrophobicContact CG-CD1 3.73Å; L49-I53 HydrophobicContact CG-CG1 4.49Å; L49-I53 WeakPolarHBondContact O-CD1 3.33Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.44Å; L49-I53 PolarHBondContact O-N 3.4Å
50	A	85.8	Confident	85.4	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.017	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-43.6	177.7	0	0	0	0	0	111.9	S46 P47 D48 I53 R54 S94 D96	S46-A50 PolarHBondContact O-N 2.97Å; P47-A50 CarbonylContact O-C 3.58Å; P47-A50 WeakPolarHBondContact O-CA 3.4Å; P47-A50 WeakPolarHBondContact O-CB 3.31Å; P47-A50 PolarHBondContact O-N 2.76Å; D48-A50 VanDerWaalsContact C-N 3.32Å; D48-A50 PolarHBondContact O-N 2.98Å; A50-I53 PolarHBondContact O-N 3Å; A50-R54 WeakPolarHBondContact O-CB 3.27Å; A50-R54 VanDerWaalsContact O-CG 3.23Å; A50-R54 WeakPolarHBondContact O-CG 3.32Å; A50-R54 PolarHBondContact O-N 2.76Å; A50-S94 WeakPolarHBondContact CA-OG 3.36Å; A50-D96 HydrophobicContact CB-CB 3.83Å
51	D	87.1	Confident	85.3	Confident	79 Å²	79	48.8 Å²	48.8	42%	0.422	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-40.6	176.9	-77	-27.2	0	0	0	111.9	P47 D48 R54 S55	P47-D51 PolarHBondContact O-N 3.48Å; D48-D51 PolarHBondContact O-N 3.01Å; D51-R54 PolarHBondContact O-N 3.29Å; D51-R54 IonicContact OD1-CZ 2.66Å; D51-R54 IonicContact OD1-NE 3.52Å; D51-R54 IonicContact OD1-NH1 2.76Å; D51-R54 IonicContact OD1-NH2 3.86Å; D51-R54 PolarHBondContact OD1-NH2 2.77Å; D51-S55 WeakPolarHBondContact O-CB 3.43Å; D51-S55 PolarHBondContact O-N 2.76Å; D51-S55 PolarHBondContact O-OG 3.09Å
52	H	89.1	Confident	84.5	Confident	30 Å²	30	59 Å²	59	14%	0.139	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-50.7	172.4	167	72.9	0	0	0	112.4	C39 F43 D48 R54 S55 I56 H57	C39-H52 PolarHBondContact SG-NE2 2.88Å; F43-H52 HydrophobicContact CE1-CB 3.95Å; F43-H52 HydrophobicContact CE2-CB 3.73Å; F43-H52 AromaticContact CE2-CD2 3.57Å; F43-H52 AromaticContact CE2-CG 3.58Å; F43-H52 HydrophobicContact CZ-CB 3.31Å; F43-H52 AromaticContact CZ-CD2 3.78Å; F43-H52 AromaticContact CZ-CG 3.29Å; F43-H52 AromaticContact CZ-ND1 3.71Å; D48-H52 WeakPolarHBondContact O-CB 3.28Å; D48-H52 PolarHBondContact O-N 2.94Å; H52-R54 VanDerWaalsContact C-N 3.31Å; H52-R54 PolarHBondContact O-N 3.47Å; H52-S55 PolarHBondContact O-N 2.94Å; H52-S55 PolarHBondContact O-OG 3.4Å; H52-I56 WeakPolarHBondContact O-CB 3.5Å; H52-I56 WeakPolarHBondContact O-CG1 3.5Å; H52-I56 PolarHBondContact O-N 3.19Å; H52-H57 AromaticContact NE2-CD2 3.93Å; H52-H57 AromaticContact NE2-NE2 3.4Å; H52-H57 PolarHBondContact NE2-NE2 3.1Å
53	I	87.8	Confident	83.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.307	C	S	.	.	I	π-helix	trans	-63.1	-40	-179.8	-65.8	159.8	0	0	0	110.6	L49 A50 H57 V58 W70 M90 S94	L49-I53 HydrophobicContact CD1-CD1 3.72Å; L49-I53 HydrophobicContact CD1-CG1 4.07Å; L49-I53 HydrophobicContact CD2-CD1 4.36Å; L49-I53 HydrophobicContact CG-CD1 3.73Å; L49-I53 HydrophobicContact CG-CG1 4.49Å; L49-I53 WeakPolarHBondContact O-CD1 3.33Å; L49-I53 VanDerWaalsContact O-CG1 3.26Å; L49-I53 WeakPolarHBondContact O-CG1 3.44Å; L49-I53 PolarHBondContact O-N 3.4Å; A50-I53 PolarHBondContact O-N 3Å; I53-H57 HydrophobicContact CG2-CB 4.35Å; I53-H57 CarbonylContact O-C 3.53Å; I53-H57 WeakPolarHBondContact O-CA 3.39Å; I53-H57 WeakPolarHBondContact O-CB 3.38Å; I53-H57 PolarHBondContact O-N 2.99Å; I53-V58 HydrophobicContact CG2-CG2 4.47Å; I53-V58 PolarHBondContact O-N 2.92Å; I53-W70 HydrophobicContact CD1-CE3 4.45Å; I53-W70 HydrophobicContact CD1-CH2 4.12Å; I53-W70 HydrophobicContact CD1-CZ3 3.54Å; I53-W70 HydrophobicContact CG1-CZ3 4.22Å; I53-M90 HydrophobicContact CG2-CB 3.77Å; I53-M90 HydrophobicContact CG2-CG 3.6Å; I53-M90 HydrophobicContact CG2-SD 3.87Å; I53-S94 WeakPolarHBondContact CD1-OG 3.31Å
54	R	87.6	Confident	83.2	Confident	83 Å²	83	57.3 Å²	57.3	31%	0.313	33%	0.328	S	S	.	.	I	π-helix	trans	-63.6	-54	178.1	-71.9	-170	-83.4	145.3	-14.3	111.9	A50 D51 H52 V58 D59	A50-R54 WeakPolarHBondContact O-CB 3.27Å; A50-R54 VanDerWaalsContact O-CG 3.23Å; A50-R54 WeakPolarHBondContact O-CG 3.32Å; A50-R54 PolarHBondContact O-N 2.76Å; D51-R54 PolarHBondContact O-N 3.29Å; D51-R54 IonicContact OD1-CZ 2.66Å; D51-R54 IonicContact OD1-NE 3.52Å; D51-R54 IonicContact OD1-NH1 2.76Å; D51-R54 IonicContact OD1-NH2 3.86Å; D51-R54 PolarHBondContact OD1-NH2 2.77Å; H52-R54 VanDerWaalsContact C-N 3.31Å; H52-R54 PolarHBondContact O-N 3.47Å; R54-V58 WeakPolarHBondContact O-CB 3.33Å; R54-V58 PolarHBondContact O-N 3.4Å; R54-D59 PolarHBondContact O-N 2.92Å
55	S	87.4	Confident	83.3	Confident	66 Å²	66	54.9 Å²	54.9	46%	0.462	32%	0.318	S	S	.	.	I	π-helix	trans	-69.8	-43.1	-175	55.1	0	0	0	0	113.9	D51 H52	D51-S55 WeakPolarHBondContact O-CB 3.43Å; D51-S55 PolarHBondContact O-N 2.76Å; D51-S55 PolarHBondContact O-OG 3.09Å; H52-S55 PolarHBondContact O-N 2.94Å; H52-S55 PolarHBondContact O-OG 3.4Å
56	I	86.3	Confident	83.5	Confident	100 Å²	100	54 Å²	54	51%	0.513	31%	0.308	S	S	.	.	I	π-helix	trans	-89.1	-47.9	-175.2	-54	-55.7	0	0	0	111.6	H52	H52-I56 WeakPolarHBondContact O-CB 3.5Å; H52-I56 WeakPolarHBondContact O-CG1 3.5Å; H52-I56 PolarHBondContact O-N 3.19Å
57	H	86.2	Confident	83.7	Confident	21 Å²	21	54.3 Å²	54.3	10%	0.097	31%	0.31	C	S	.	.	I	π-helix	trans	-96.8	-26.4	-168.4	-62.4	-43.4	0	0	0	114.7	C34 W36 C39 H52 I53 Q61	C34-H57 PolarHBondContact SG-NE2 2.89Å; W36-H57 AromaticContact CD1-CE1 3.46Å; W36-H57 VanDerWaalsContact CD1-CE1 3.46Å; W36-H57 AromaticContact CD1-CG 3.72Å; W36-H57 AromaticContact CD1-ND1 3.35Å; W36-H57 AromaticContact CD1-NE2 3.87Å; W36-H57 HydrophobicContact CD2-CB 3.74Å; W36-H57 AromaticContact CD2-CD2 3.85Å; W36-H57 AromaticContact CD2-CG 3.61Å; W36-H57 AromaticContact CE2-CG 3.78Å; W36-H57 AromaticContact CE2-ND1 3.96Å; W36-H57 HydrophobicContact CE3-CB 3.98Å; W36-H57 HydrophobicContact CG-CB 4.28Å; W36-H57 AromaticContact CG-CD2 3.58Å; W36-H57 AromaticContact CG-CE1 3.73Å; W36-H57 AromaticContact CG-CG 3.61Å; W36-H57 AromaticContact CG-ND1 3.7Å; W36-H57 AromaticContact CG-NE2 3.66Å; W36-H57 HydrophobicContact CH2-CB 4.1Å; W36-H57 HydrophobicContact CZ2-CB 3.89Å; W36-H57 HydrophobicContact CZ3-CB 4.15Å; W36-H57 AromaticContact NE1-CG 3.83Å; W36-H57 AromaticContact NE1-ND1 3.53Å; C39-H57 WeakPolarHBondContact CB-NE2 3.34Å; C39-H57 PolarHBondContact SG-NE2 3.15Å; H52-H57 AromaticContact NE2-CD2 3.93Å; H52-H57 AromaticContact NE2-NE2 3.4Å; H52-H57 PolarHBondContact NE2-NE2 3.1Å; I53-H57 HydrophobicContact CG2-CB 4.35Å; I53-H57 CarbonylContact O-C 3.53Å; I53-H57 WeakPolarHBondContact O-CA 3.39Å; I53-H57 WeakPolarHBondContact O-CB 3.38Å; I53-H57 PolarHBondContact O-N 2.99Å; H57-Q61 WeakPolarHBondContact O-CG 3.42Å; H57-Q61 PolarHBondContact O-NE2 3.22Å
58	V	84.6	Confident	84.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-96.7	-51	178	-176.1	0	0	0	0	111.4	I53 R54 G60 Q61 Q83 L86 Q87 M90	I53-V58 HydrophobicContact CG2-CG2 4.47Å; I53-V58 PolarHBondContact O-N 2.92Å; R54-V58 WeakPolarHBondContact O-CB 3.33Å; R54-V58 PolarHBondContact O-N 3.4Å; V58-G60 VanDerWaalsContact C-N 3.29Å; V58-G60 PolarHBondContact O-N 3.47Å; V58-Q61 WeakPolarHBondContact O-CB 3.43Å; V58-Q61 PolarHBondContact O-N 3.5Å; V58-Q61 VanDerWaalsContact O-N 3.11Å; V58-Q83 HydrophobicContact CG1-CG 4.35Å; V58-L86 HydrophobicContact CB-CD2 4.46Å; V58-L86 HydrophobicContact CG1-CB 4.46Å; V58-L86 HydrophobicContact CG1-CD2 3.95Å; V58-L86 HydrophobicContact CG1-CG 4.2Å; V58-L86 HydrophobicContact CG2-CD2 4.16Å; V58-L86 HydrophobicContact CG2-CG 4.19Å; V58-Q87 HydrophobicContact CG1-CG 3.76Å; V58-Q87 VanDerWaalsContact CG1-NE2 3.33Å; V58-M90 HydrophobicContact CG2-CG 3.5Å; V58-M90 HydrophobicContact CG2-SD 4.45Å
59	D	84.6	Confident	84.1	Confident	69 Å²	69	50.2 Å²	50.2	37%	0.369	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-14.6	-177.3	-60.9	-26.9	0	0	0	112.8	R54 Q61 Q83 Q87	R54-D59 PolarHBondContact O-N 2.92Å; D59-Q61 VanDerWaalsContact C-N 3.26Å; D59-Q83 PolarHBondContact OD1-NE2 3.02Å; D59-Q87 PolarHBondContact OD1-NE2 3.4Å
60	G	80	Confident	84.2	Confident	52 Å²	52	51.3 Å²	51.3	54%	0.536	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.3	163.6	0	0	0	0	0	113.9	V58 R62	V58-G60 VanDerWaalsContact C-N 3.29Å; V58-G60 PolarHBondContact O-N 3.47Å; G60-R62 VanDerWaalsContact C-N 3.26Å; G60-R62 PolarHBondContact O-N 2.77Å
61	Q	80.8	Confident	84.2	Confident	33 Å²	33	56.2 Å²	56.2	15%	0.154	31%	0.309	C	S	.	.			trans	-81.3	72.7	177.5	-64.2	-179.9	34.8	0	0	111.1	H57 V58 D59 G63 F66 V67	H57-Q61 WeakPolarHBondContact O-CG 3.42Å; H57-Q61 PolarHBondContact O-NE2 3.22Å; V58-Q61 WeakPolarHBondContact O-CB 3.43Å; V58-Q61 PolarHBondContact O-N 3.5Å; V58-Q61 VanDerWaalsContact O-N 3.11Å; D59-Q61 VanDerWaalsContact C-N 3.26Å; Q61-G63 PolarHBondContact O-N 2.77Å; Q61-F66 HydrophobicContact CB-CD1 4.14Å; Q61-F66 HydrophobicContact CB-CE1 4.47Å; Q61-F66 WeakPolarHBondContact O-CE1 3.28Å; Q61-F66 VanDerWaalsContact OE1-CA 3.31Å; Q61-V67 PolarHBondContact NE2-O 2.89Å; Q61-V67 PolarHBondContact OE1-O 2.67Å
62	R	67.5	Low	84	Confident	241 Å²	241	56.6 Å²	56.6	91%	0.909	33%	0.332	S	S	*	.			trans	-79.9	62.6	176.7	-66.6	-172.3	175.6	-167.6	-0.3	112.3	G60	G60-R62 VanDerWaalsContact C-N 3.26Å; G60-R62 PolarHBondContact O-N 2.77Å
63	G	67.2	Low	83.9	Confident	39 Å²	39	56 Å²	56	40%	0.402	33%	0.331	S	S	.	.	S	Bend	trans	-143.3	158.5	166	0	0	0	0	0	109.4	Q61 V65	Q61-G63 PolarHBondContact O-N 2.77Å; G63-V65 PolarHBondContact O-N 3.31Å
64	G	77.8	Confident	83.7	Confident	63 Å²	63	65.9 Å²	65.9	65%	0.649	37%	0.374	S	S	*	.	S	Bend	trans	-66.5	12	175.5	0	0	0	0	0	114.9
65	V	85.5	Confident	83.6	Confident	79 Å²	79	63.8 Å²	63.8	48%	0.479	37%	0.371	S	S	.	.			trans	-132.2	122	-177.7	-179.3	0	0	0	0	107.9	G63 V67 P79 S80	G63-V65 PolarHBondContact O-N 3.31Å; V65-V67 HydrophobicContact CG1-CG1 4.47Å; V65-P79 HydrophobicContact CG1-CB 3.32Å; V65-S80 WeakPolarHBondContact CA-O 3.16Å
66	F	88.3	Confident	83.6	Confident	21 Å²	21	65.3 Å²	65.3	9%	0.092	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-113.4	124.4	-176.5	-62.3	-80.4	0	0	0	109.2	Q61 S80 Q83 L86	Q61-F66 HydrophobicContact CB-CD1 4.14Å; Q61-F66 HydrophobicContact CB-CE1 4.47Å; Q61-F66 WeakPolarHBondContact O-CE1 3.28Å; Q61-F66 VanDerWaalsContact OE1-CA 3.31Å; F66-S80 WeakPolarHBondContact CD2-O 3.44Å; F66-S80 PolarHBondContact N-O 2.85Å; F66-S80 WeakPolarHBondContact O-CB 3.32Å; F66-S80 PolarHBondContact O-N 3.43Å; F66-Q83 HydrophobicContact CD1-CB 4.19Å; F66-Q83 HydrophobicContact CD1-CG 4.14Å; F66-Q83 HydrophobicContact CD2-CB 4.15Å; F66-Q83 VanDerWaalsContact CD2-N 3.32Å; F66-Q83 HydrophobicContact CE1-CB 3.74Å; F66-Q83 HydrophobicContact CE1-CG 3.62Å; F66-Q83 HydrophobicContact CE2-CB 3.7Å; F66-Q83 HydrophobicContact CE2-CG 4.5Å; F66-Q83 HydrophobicContact CG-CB 4.39Å; F66-Q83 HydrophobicContact CZ-CB 3.48Å; F66-Q83 VanDerWaalsContact CZ-CB 3.48Å; F66-Q83 HydrophobicContact CZ-CG 3.83Å; F66-L86 HydrophobicContact CB-CB 4.02Å; F66-L86 HydrophobicContact CB-CD2 3.73Å; F66-L86 HydrophobicContact CB-CG 4.45Å; F66-L86 HydrophobicContact CD1-CD2 4.36Å
67	V	88.6	Confident	83.6	Confident	28 Å²	28	65.1 Å²	65.1	17%	0.17	37%	0.367	C	S	.	.			trans	-120.6	150.9	-177.5	-68.1	0	0	0	0	111.3	W36 Q61 V65 L69 P79 L86	W36-V67 WeakPolarHBondContact CH2-O 3.23Å; Q61-V67 PolarHBondContact NE2-O 2.89Å; Q61-V67 PolarHBondContact OE1-O 2.67Å; V65-V67 HydrophobicContact CG1-CG1 4.47Å; V67-L69 HydrophobicContact CG2-CD1 4.48Å; V67-L69 HydrophobicContact CG2-CG 4.38Å; V67-P79 HydrophobicContact CG1-CB 4.46Å; V67-L86 WeakPolarHBondContact O-CD2 3.44Å
68	C	89.4	Confident	83.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-102.7	120.5	169.4	-175.6	0	0	0	0	109.7	W70 Y76 N77 L86 M90	C68-W70 WeakPolarHBondContact SG-CB 3.41Å; C68-Y76 CarbonylContact O-C 3.53Å; C68-Y76 WeakPolarHBondContact O-CA 3.45Å; C68-N77 PolarHBondContact O-N 2.81Å; C68-L86 HydrophobicContact CB-CD1 4.04Å; C68-M90 HydrophobicContact CB-CE 4.18Å
69	L	88.2	Confident	83.7	Confident	44 Å²	44	71.6 Å²	71.6	23%	0.23	41%	0.41	C	S	.	.			trans	-105.4	25.3	176	-62.8	162.2	0	0	0	111.9	W36 D37 V67 Y76 N77	W36-L69 HydrophobicContact CD2-CB 4.23Å; W36-L69 HydrophobicContact CZ2-CB 3.83Å; W36-L69 HydrophobicContact CZ2-CD1 4.19Å; W36-L69 HydrophobicContact CZ2-CG 4.19Å; D37-L69 HydrophobicContact CB-CB 3.91Å; D37-L69 PolarHBondContact N-O 3.46Å; V67-L69 HydrophobicContact CG2-CD1 4.48Å; V67-L69 HydrophobicContact CG2-CG 4.38Å; L69-Y76 HydrophobicContact CB-CE2 4.4Å; L69-Y76 HydrophobicContact CD2-CE2 4.4Å; L69-N77 HydrophobicContact CD2-CB 4.47Å
70	W	88.7	Confident	83.8	Confident	27 Å²	27	69.3 Å²	69.3	10%	0.102	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-76.5	126.2	179.8	-171.9	-80.6	0	0	0	111.7	C35 W36 I53 C68 G72 C73 Y76 H93	C35-W70 HydrophobicContact CB-CD2 4.18Å; C35-W70 HydrophobicContact CB-CH2 4.16Å; C35-W70 HydrophobicContact CB-CZ2 3.67Å; C35-W70 VanDerWaalsContact N-CH2 3.3Å; C35-W70 WeakPolarHBondContact O-CA 3.39Å; W36-W70 HydrophobicContact CE3-CB 4.4Å; W36-W70 HydrophobicContact CE3-CE3 4.3Å; I53-W70 HydrophobicContact CD1-CE3 4.45Å; I53-W70 HydrophobicContact CD1-CH2 4.12Å; I53-W70 HydrophobicContact CD1-CZ3 3.54Å; I53-W70 HydrophobicContact CG1-CZ3 4.22Å; C68-W70 WeakPolarHBondContact SG-CB 3.41Å; W70-G72 PolarHBondContact O-N 3.43Å; W70-C73 HydrophobicContact CB-CB 4.07Å; W70-C73 WeakPolarHBondContact O-CB 3.48Å; W70-C73 PolarHBondContact O-N 2.82Å; W70-Y76 WeakPolarHBondContact O-CD2 3.39Å; W70-H93 AromaticContact CD1-CE1 3.56Å; W70-H93 AromaticContact CD1-CG 3.94Å; W70-H93 AromaticContact CD1-ND1 3.65Å; W70-H93 AromaticContact CD1-NE2 3.87Å; W70-H93 HydrophobicContact CD2-CB 3.83Å; W70-H93 AromaticContact CD2-CD2 3.75Å; W70-H93 AromaticContact CD2-CG 3.68Å; W70-H93 AromaticContact CE2-CG 3.8Å; W70-H93 HydrophobicContact CE3-CB 4.05Å; W70-H93 HydrophobicContact CG-CB 4.46Å; W70-H93 AromaticContact CG-CD2 3.6Å; W70-H93 AromaticContact CG-CE1 3.77Å; W70-H93 AromaticContact CG-CG 3.79Å; W70-H93 AromaticContact CG-ND1 3.94Å; W70-H93 AromaticContact CG-NE2 3.6Å; W70-H93 HydrophobicContact CH2-CB 4.04Å; W70-H93 HydrophobicContact CZ2-CB 3.81Å; W70-H93 HydrophobicContact CZ3-CB 4.16Å; W70-H93 AromaticContact NE1-CG 3.93Å; W70-H93 AromaticContact NE1-ND1 3.7Å
71	K	85	Confident	84.2	Confident	105 Å²	105	73 Å²	73	46%	0.457	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	129.8	-177.7	-59.1	-61.7	179.5	-178.2	0	111	C35 D37 C73	C35-K71 WeakPolarHBondContact O-CG 3.24Å; C35-K71 PolarHBondContact O-N 3.25Å; D37-K71 WeakPolarHBondContact OD1-CE 3.39Å; D37-K71 IonicContact OD1-NZ 3.11Å; D37-K71 PolarHBondContact OD1-NZ 2.94Å; K71-C73 VanDerWaalsContact C-N 3.3Å; K71-C73 PolarHBondContact O-N 3.08Å
72	G	82.5	Confident	84.5	Confident	88 Å²	88	73.5 Å²	73.5	91%	0.907	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	8	-176.1	0	0	0	0	0	115.2	W70	W70-G72 PolarHBondContact O-N 3.43Å
73	C	87.5	Confident	85.4	Confident	16 Å²	16	66 Å²	66	11%	0.108	39%	0.394	C	S	.	.			trans	-71.6	136.1	176.3	-174.5	0	0	0	0	112.6	W70 K71 V75 Y76 H89	W70-C73 HydrophobicContact CB-CB 4.07Å; W70-C73 WeakPolarHBondContact O-CB 3.48Å; W70-C73 PolarHBondContact O-N 2.82Å; K71-C73 VanDerWaalsContact C-N 3.3Å; K71-C73 PolarHBondContact O-N 3.08Å; C73-V75 PolarHBondContact O-N 2.6Å; C73-V75 VanDerWaalsContact O-N 3.16Å; C73-V75 WeakPolarHBondContact SG-CG2 3.27Å; C73-V75 PolarHBondContact SG-N 2.91Å; C73-V75 VanDerWaalsContact SG-N 3.39Å; C73-Y76 WeakPolarHBondContact O-CB 3.32Å; C73-Y76 PolarHBondContact O-N 3.03Å; C73-H89 VanDerWaalsContact SG-CE1 3.6Å; C73-H89 PolarHBondContact SG-NE2 3.3Å
74	K	84.6	Confident	86.3	Confident	208 Å²	208	68.4 Å²	68.4	90%	0.904	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.8	174.3	-176.3	171.4	-178.7	177.2	0	114.1
75	V	85.2	Confident	86.8	Confident	40 Å²	40	69.4 Å²	69.4	24%	0.242	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	36.6	-178.8	-66.7	0	0	0	0	110.8	C73 N77 T78 W85 H89	C73-V75 PolarHBondContact O-N 2.6Å; C73-V75 VanDerWaalsContact O-N 3.16Å; C73-V75 WeakPolarHBondContact SG-CG2 3.27Å; C73-V75 PolarHBondContact SG-N 2.91Å; C73-V75 VanDerWaalsContact SG-N 3.39Å; V75-N77 PolarHBondContact O-N 3.2Å; V75-T78 HydrophobicContact CB-CG2 4.3Å; V75-T78 WeakPolarHBondContact CB-OG1 3.26Å; V75-T78 PolarHBondContact O-N 3Å; V75-T78 PolarHBondContact O-OG1 3.05Å; V75-T78 VanDerWaalsContact O-OG1 3.08Å; V75-W85 HydrophobicContact CB-CH2 4.35Å; V75-W85 HydrophobicContact CG2-CH2 3.96Å; V75-H89 WeakPolarHBondContact CG2-NE2 3.05Å
76	Y	88	Confident	86.9	Confident	97 Å²	97	65.6 Å²	65.6	38%	0.38	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-59.6	129.9	175.7	-176.2	-97.9	0	0	0	111.4	C68 L69 W70 C73 T78	C68-Y76 CarbonylContact O-C 3.53Å; C68-Y76 WeakPolarHBondContact O-CA 3.45Å; L69-Y76 HydrophobicContact CB-CE2 4.4Å; L69-Y76 HydrophobicContact CD2-CE2 4.4Å; W70-Y76 WeakPolarHBondContact O-CD2 3.39Å; C73-Y76 WeakPolarHBondContact O-CB 3.32Å; C73-Y76 PolarHBondContact O-N 3.03Å; Y76-T78 PolarHBondContact O-N 3.44Å
77	N	86.1	Confident	86.7	Confident	96 Å²	96	66.6 Å²	66.6	51%	0.513	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	21	-178.6	-157.7	26	0	0	0	115.5	C68 L69 V75	C68-N77 PolarHBondContact O-N 2.81Å; L69-N77 HydrophobicContact CD2-CB 4.47Å; V75-N77 PolarHBondContact O-N 3.2Å
78	T	86.1	Confident	86.6	Confident	58 Å²	58	70 Å²	70	36%	0.356	38%	0.381	S	S	.	.			trans	-84.5	124.2	175.9	65	0	0	0	0	110.6	V75 Y76	V75-T78 HydrophobicContact CB-CG2 4.3Å; V75-T78 WeakPolarHBondContact CB-OG1 3.26Å; V75-T78 PolarHBondContact O-N 3Å; V75-T78 PolarHBondContact O-OG1 3.05Å; V75-T78 VanDerWaalsContact O-OG1 3.08Å; Y76-T78 PolarHBondContact O-N 3.44Å
79	P	86.8	Confident	86.4	Confident	99 Å²	99	70.9 Å²	70.9	64%	0.643	39%	0.385	S	S	*	.			trans	-72.7	133.6	-179.9	28.4	-34.5	0	0	0	112.4	V65 V67	V65-P79 HydrophobicContact CG1-CB 3.32Å; V67-P79 HydrophobicContact CG1-CB 4.46Å
80	S	86.7	Confident	86.3	Confident	22 Å²	22	68.9 Å²	68.9	15%	0.154	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-126.9	136.6	174.1	177.9	0	0	0	0	110.6	V65 F66 S82	V65-S80 WeakPolarHBondContact CA-O 3.16Å; F66-S80 WeakPolarHBondContact CD2-O 3.44Å; F66-S80 PolarHBondContact N-O 2.85Å; F66-S80 WeakPolarHBondContact O-CB 3.32Å; F66-S80 PolarHBondContact O-N 3.43Å; S80-S82 PolarHBondContact O-N 2.88Å; S80-S82 PolarHBondContact OG-N 2.86Å
81	T	87.4	Confident	86.1	Confident	130 Å²	130	68.5 Å²	68.5	80%	0.798	37%	0.374	S	S	*	.	S	Bend	trans	-82.7	10.4	176.1	52.9	0	0	0	0	113.6
82	S	87.3	Confident	86	Confident	42 Å²	42	67.9 Å²	67.9	29%	0.294	38%	0.379	S	S	.	.			trans	-127.4	105.2	-172.2	178.1	0	0	0	0	112.5	S80 S84 W85 L86	S80-S82 PolarHBondContact O-N 2.88Å; S80-S82 PolarHBondContact OG-N 2.86Å; S82-S84 VanDerWaalsContact C-N 3.3Å; S82-S84 PolarHBondContact O-N 3.09Å; S82-S84 PolarHBondContact OG-OG 3.05Å; S82-W85 WeakPolarHBondContact O-CB 3.21Å; S82-W85 PolarHBondContact O-N 3.38Å; S82-W85 VanDerWaalsContact O-N 3.12Å; S82-W85 WeakPolarHBondContact OG-CB 3.3Å; S82-W85 PolarHBondContact OG-N 3.38Å; S82-L86 PolarHBondContact O-N 2.93Å
83	Q	86	Confident	86	Confident	85 Å²	85	65.7 Å²	65.7	40%	0.397	35%	0.345	S	S	.	.	H	α-helix	trans	-56.3	-44	172.9	-166.4	179.4	1	0	0	111.4	V58 D59 F66 W85 L86 Q87	V58-Q83 HydrophobicContact CG1-CG 4.35Å; D59-Q83 PolarHBondContact OD1-NE2 3.02Å; F66-Q83 HydrophobicContact CD1-CB 4.19Å; F66-Q83 HydrophobicContact CD1-CG 4.14Å; F66-Q83 HydrophobicContact CD2-CB 4.15Å; F66-Q83 VanDerWaalsContact CD2-N 3.32Å; F66-Q83 HydrophobicContact CE1-CB 3.74Å; F66-Q83 HydrophobicContact CE1-CG 3.62Å; F66-Q83 HydrophobicContact CE2-CB 3.7Å; F66-Q83 HydrophobicContact CE2-CG 4.5Å; F66-Q83 HydrophobicContact CG-CB 4.39Å; F66-Q83 HydrophobicContact CZ-CB 3.48Å; F66-Q83 VanDerWaalsContact CZ-CB 3.48Å; F66-Q83 HydrophobicContact CZ-CG 3.83Å; Q83-W85 PolarHBondContact O-N 3.05Å; Q83-L86 PolarHBondContact O-N 3.36Å; Q83-Q87 HydrophobicContact CG-CG 4.26Å; Q83-Q87 WeakPolarHBondContact O-CB 3.27Å; Q83-Q87 WeakPolarHBondContact O-CG 3.27Å; Q83-Q87 PolarHBondContact O-N 3.44Å
84	S	86.3	Confident	85.7	Confident	89 Å²	89	65.1 Å²	65.1	62%	0.622	34%	0.342	S	S	*	.	H	α-helix	trans	-65.9	-25.3	179.4	57.5	0	0	0	0	113.4	S82 R88	S82-S84 VanDerWaalsContact C-N 3.3Å; S82-S84 PolarHBondContact O-N 3.09Å; S82-S84 PolarHBondContact OG-OG 3.05Å; S84-R88 WeakPolarHBondContact O-CB 3.05Å; S84-R88 PolarHBondContact O-N 2.89Å
85	W	87.8	Confident	85.4	Confident	83 Å²	83	57.2 Å²	57.2	31%	0.314	32%	0.319	S	S	.	.	H	α-helix	trans	-70.9	-43.7	168.3	177.7	103.2	0	0	0	111.6	V75 S82 Q83 H89	V75-W85 HydrophobicContact CB-CH2 4.35Å; V75-W85 HydrophobicContact CG2-CH2 3.96Å; S82-W85 WeakPolarHBondContact O-CB 3.21Å; S82-W85 PolarHBondContact O-N 3.38Å; S82-W85 VanDerWaalsContact O-N 3.12Å; S82-W85 WeakPolarHBondContact OG-CB 3.3Å; S82-W85 PolarHBondContact OG-N 3.38Å; Q83-W85 PolarHBondContact O-N 3.05Å; W85-H89 WeakPolarHBondContact O-CB 3.25Å; W85-H89 PolarHBondContact O-N 3.3Å
86	L	87.8	Confident	85.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.3	-48.3	179.8	-175.1	66.1	0	0	0	111.2	V58 F66 V67 C68 S82 Q83 R88 H89 M90	V58-L86 HydrophobicContact CB-CD2 4.46Å; V58-L86 HydrophobicContact CG1-CB 4.46Å; V58-L86 HydrophobicContact CG1-CD2 3.95Å; V58-L86 HydrophobicContact CG1-CG 4.2Å; V58-L86 HydrophobicContact CG2-CD2 4.16Å; V58-L86 HydrophobicContact CG2-CG 4.19Å; F66-L86 HydrophobicContact CB-CB 4.02Å; F66-L86 HydrophobicContact CB-CD2 3.73Å; F66-L86 HydrophobicContact CB-CG 4.45Å; F66-L86 HydrophobicContact CD1-CD2 4.36Å; V67-L86 WeakPolarHBondContact O-CD2 3.44Å; C68-L86 HydrophobicContact CB-CD1 4.04Å; S82-L86 PolarHBondContact O-N 2.93Å; Q83-L86 PolarHBondContact O-N 3.36Å; L86-R88 VanDerWaalsContact C-N 3.33Å; L86-R88 PolarHBondContact O-N 2.86Å; L86-H89 CarbonylContact O-C 3.57Å; L86-H89 WeakPolarHBondContact O-CA 3.45Å; L86-H89 WeakPolarHBondContact O-CB 3.43Å; L86-H89 PolarHBondContact O-N 2.89Å; L86-M90 HydrophobicContact CD1-CE 3.53Å; L86-M90 HydrophobicContact CD1-SD 4.32Å; L86-M90 HydrophobicContact CG-CE 4.32Å; L86-M90 WeakPolarHBondContact O-CG 3.35Å; L86-M90 PolarHBondContact O-N 3.31Å
87	Q	85.7	Confident	84.7	Confident	41 Å²	41	57.3 Å²	57.3	19%	0.192	32%	0.319	C	S	.	.	H	α-helix	trans	-47.8	-52.2	173.1	-77.7	-73.2	-12.5	0	0	111.6	V58 D59 Q83 H89 M90	V58-Q87 HydrophobicContact CG1-CG 3.76Å; V58-Q87 VanDerWaalsContact CG1-NE2 3.33Å; D59-Q87 PolarHBondContact OD1-NE2 3.4Å; Q83-Q87 HydrophobicContact CG-CG 4.26Å; Q83-Q87 WeakPolarHBondContact O-CB 3.27Å; Q83-Q87 WeakPolarHBondContact O-CG 3.27Å; Q83-Q87 PolarHBondContact O-N 3.44Å; Q87-H89 VanDerWaalsContact C-N 3.34Å; Q87-H89 PolarHBondContact O-N 3.12Å; Q87-M90 PolarHBondContact O-N 3.48Å
88	R	84.6	Confident	84.3	Confident	100 Å²	100	56 Å²	56	38%	0.377	32%	0.316	S	S	.	.	H	α-helix	trans	-67.8	-30.8	176.3	-178.9	-171.9	46.7	53.8	12.3	113.1	S84 L86	S84-R88 WeakPolarHBondContact O-CB 3.05Å; S84-R88 PolarHBondContact O-N 2.89Å; L86-R88 VanDerWaalsContact C-N 3.33Å; L86-R88 PolarHBondContact O-N 2.86Å
89	H	86.7	Confident	84.1	Confident	19 Å²	19	56.7 Å²	56.7	9%	0.088	31%	0.314	C	S	.	.	H	α-helix	trans	-67.3	-37.3	175.3	174.8	23.4	0	0	0	111.2	C73 V75 W85 L86 Q87 L91 T92 H93	C73-H89 VanDerWaalsContact SG-CE1 3.6Å; C73-H89 PolarHBondContact SG-NE2 3.3Å; V75-H89 WeakPolarHBondContact CG2-NE2 3.05Å; W85-H89 WeakPolarHBondContact O-CB 3.25Å; W85-H89 PolarHBondContact O-N 3.3Å; L86-H89 CarbonylContact O-C 3.57Å; L86-H89 WeakPolarHBondContact O-CA 3.45Å; L86-H89 WeakPolarHBondContact O-CB 3.43Å; L86-H89 PolarHBondContact O-N 2.89Å; Q87-H89 VanDerWaalsContact C-N 3.34Å; Q87-H89 PolarHBondContact O-N 3.12Å; H89-L91 PolarHBondContact O-N 2.93Å; H89-T92 PolarHBondContact ND1-OG1 3.16Å; H89-T92 WeakPolarHBondContact O-CB 3.31Å; H89-T92 PolarHBondContact O-N 3.36Å; H89-T92 PolarHBondContact O-OG1 2.99Å; H89-H93 AromaticContact CE1-CE1 3.72Å; H89-H93 AromaticContact CE1-NE2 3.31Å; H89-H93 PolarHBondContact CE1-NE2 3.26Å; H89-H93 VanDerWaalsContact CE1-NE2 3.31Å; H89-H93 AromaticContact NE2-NE2 3.53Å
90	M	86.3	Confident	84	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-62.5	-29.6	-178.7	-63.1	-50	87.7	0	0	113.4	W36 I53 V58 C68 L86 Q87 T92 H93 S94	W36-M90 HydrophobicContact CE3-SD 4.47Å; W36-M90 HydrophobicContact CH2-SD 4.42Å; W36-M90 HydrophobicContact CZ3-SD 3.61Å; I53-M90 HydrophobicContact CG2-CB 3.77Å; I53-M90 HydrophobicContact CG2-CG 3.6Å; I53-M90 HydrophobicContact CG2-SD 3.87Å; V58-M90 HydrophobicContact CG2-CG 3.5Å; V58-M90 HydrophobicContact CG2-SD 4.45Å; C68-M90 HydrophobicContact CB-CE 4.18Å; L86-M90 HydrophobicContact CD1-CE 3.53Å; L86-M90 HydrophobicContact CD1-SD 4.32Å; L86-M90 HydrophobicContact CG-CE 4.32Å; L86-M90 WeakPolarHBondContact O-CG 3.35Å; L86-M90 PolarHBondContact O-N 3.31Å; Q87-M90 PolarHBondContact O-N 3.48Å; M90-T92 PolarHBondContact O-N 3.48Å; M90-T92 VanDerWaalsContact O-N 3.11Å; M90-H93 WeakPolarHBondContact O-CB 3.41Å; M90-H93 PolarHBondContact O-N 3.36Å; M90-S94 PolarHBondContact O-N 3.36Å; M90-S94 PolarHBondContact O-OG 3.01Å
91	L	84.8	Confident	84.2	Confident	18 Å²	18	58.6 Å²	58.6	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-57.7	-23.3	171.9	-60.8	171.8	0	0	0	113.3	H89 H93 G95 D96 P98 A111	H89-L91 PolarHBondContact O-N 2.93Å; L91-H93 VanDerWaalsContact C-N 3.29Å; L91-G95 WeakPolarHBondContact O-CA 3.32Å; L91-G95 PolarHBondContact O-N 3.47Å; L91-G95 VanDerWaalsContact O-N 3.15Å; L91-D96 HydrophobicContact CD2-CB 4.02Å; L91-P98 HydrophobicContact CD1-CG 4.44Å; L91-A111 HydrophobicContact CB-CB 3.96Å; L91-A111 HydrophobicContact CD1-CB 4.17Å; L91-A111 VanDerWaalsContact CD1-O 3.27Å; L91-A111 WeakPolarHBondContact CD1-O 3.46Å
92	T	82.5	Confident	84.1	Confident	93 Å²	93	59.1 Å²	59.1	57%	0.571	31%	0.314	S	S	*	.	H	α-helix	trans	-74.2	-20.8	173.7	69.3	0	0	0	0	113.3	H89 M90	H89-T92 PolarHBondContact ND1-OG1 3.16Å; H89-T92 WeakPolarHBondContact O-CB 3.31Å; H89-T92 PolarHBondContact O-N 3.36Å; H89-T92 PolarHBondContact O-OG1 2.99Å; M90-T92 PolarHBondContact O-N 3.48Å; M90-T92 VanDerWaalsContact O-N 3.11Å
93	H	83	Confident	84	Confident	42 Å²	42	59.1 Å²	59.1	19%	0.194	31%	0.313	C	S	.	.	H	α-helix	trans	-93.6	-44.9	178.6	-61.5	-42.1	0	0	0	111.3	W70 H89 M90 L91 G95	W70-H93 AromaticContact CD1-CE1 3.56Å; W70-H93 AromaticContact CD1-CG 3.94Å; W70-H93 AromaticContact CD1-ND1 3.65Å; W70-H93 AromaticContact CD1-NE2 3.87Å; W70-H93 HydrophobicContact CD2-CB 3.83Å; W70-H93 AromaticContact CD2-CD2 3.75Å; W70-H93 AromaticContact CD2-CG 3.68Å; W70-H93 AromaticContact CE2-CG 3.8Å; W70-H93 HydrophobicContact CE3-CB 4.05Å; W70-H93 HydrophobicContact CG-CB 4.46Å; W70-H93 AromaticContact CG-CD2 3.6Å; W70-H93 AromaticContact CG-CE1 3.77Å; W70-H93 AromaticContact CG-CG 3.79Å; W70-H93 AromaticContact CG-ND1 3.94Å; W70-H93 AromaticContact CG-NE2 3.6Å; W70-H93 HydrophobicContact CH2-CB 4.04Å; W70-H93 HydrophobicContact CZ2-CB 3.81Å; W70-H93 HydrophobicContact CZ3-CB 4.16Å; W70-H93 AromaticContact NE1-CG 3.93Å; W70-H93 AromaticContact NE1-ND1 3.7Å; H89-H93 AromaticContact CE1-CE1 3.72Å; H89-H93 AromaticContact CE1-NE2 3.31Å; H89-H93 PolarHBondContact CE1-NE2 3.26Å; H89-H93 VanDerWaalsContact CE1-NE2 3.31Å; H89-H93 AromaticContact NE2-NE2 3.53Å; M90-H93 WeakPolarHBondContact O-CB 3.41Å; M90-H93 PolarHBondContact O-N 3.36Å; L91-H93 VanDerWaalsContact C-N 3.29Å; H93-G95 PolarHBondContact O-N 3.36Å
94	S	79.4	Confident	83.7	Confident	4 Å²	4	58.8 Å²	58.8	3%	0.028	33%	0.332	C	S	.	.	H	α-helix	trans	-70.4	-18.8	176.2	-41.1	0	0	0	0	113.6	S46 A50 I53 M90 D96	S46-S94 PolarHBondContact OG-O 2.8Å; A50-S94 WeakPolarHBondContact CA-OG 3.36Å; I53-S94 WeakPolarHBondContact CD1-OG 3.31Å; M90-S94 PolarHBondContact O-N 3.36Å; M90-S94 PolarHBondContact O-OG 3.01Å; S94-D96 PolarHBondContact O-N 3.33Å
95	G	79	Confident	83.4	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	35%	0.345	S	S	.	.			trans	73.5	-5.3	-172.6	0	0	0	0	0	114.8	L91 H93	L91-G95 WeakPolarHBondContact O-CA 3.32Å; L91-G95 PolarHBondContact O-N 3.47Å; L91-G95 VanDerWaalsContact O-N 3.15Å; H93-G95 PolarHBondContact O-N 3.36Å
96	D	78.6	Confident	83.3	Confident	27 Å²	27	55.8 Å²	55.8	14%	0.144	34%	0.337	C	S	.	.			trans	-66.4	142.4	-174.7	-177.7	32.2	0	0	0	112.7	A50 L91 S94	A50-D96 HydrophobicContact CB-CB 3.83Å; L91-D96 HydrophobicContact CD2-CB 4.02Å; S94-D96 PolarHBondContact O-N 3.33Å
97	K	81	Confident	83.1	Confident	112 Å²	112	63.3 Å²	63.3	49%	0.487	38%	0.377	S	S	.	.			trans	-139.1	72.3	-170.5	-71.5	164	-177.2	177	0	109.1	F99 F110	K97-F99 PolarHBondContact O-N 3.46Å; K97-F110 CarbonylContact C-O 3.45Å; K97-F110 WeakPolarHBondContact CA-O 3.43Å
98	P	77.5	Confident	82.9	Confident	68 Å²	68	62.9 Å²	62.9	44%	0.442	38%	0.38	S	S	.	.			trans	-65.2	-22.9	-173	23.8	-33.7	0	0	0	113.5	L91 K100	L91-P98 HydrophobicContact CD1-CG 4.44Å; P98-K100 PolarHBondContact O-N 2.62Å; P98-K100 VanDerWaalsContact O-N 3.16Å
99	F	81.6	Confident	82.9	Confident	72 Å²	72	60 Å²	60	32%	0.316	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	81.4	-177.9	-56	-81.4	0	0	0	111.2	K97 F110 S112 Q113 L116	K97-F99 PolarHBondContact O-N 3.46Å; F99-F110 HydrophobicContact CB-CB 4.24Å; F99-F110 WeakPolarHBondContact CB-O 3.45Å; F99-F110 WeakPolarHBondContact CD2-O 3.44Å; F99-F110 PolarHBondContact N-O 2.83Å; F99-F110 VanDerWaalsContact N-O 3.16Å; F99-F110 WeakPolarHBondContact O-CD2 3.18Å; F99-F110 PolarHBondContact O-N 2.86Å; F99-S112 VanDerWaalsContact CD2-C 3.41Å; F99-S112 VanDerWaalsContact CD2-CA 3.46Å; F99-Q113 HydrophobicContact CD1-CB 4.15Å; F99-Q113 HydrophobicContact CE1-CB 3.84Å; F99-Q113 HydrophobicContact CZ-CB 4.18Å; F99-L116 HydrophobicContact CB-CB 4.18Å; F99-L116 HydrophobicContact CB-CD2 4.1Å
100	K	84.8	Confident	82.8	Confident	144 Å²	144	61.6 Å²	61.6	63%	0.626	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	149.6	174.1	-57.6	-172.4	178.7	175.3	0	111.4	P98	P98-K100 PolarHBondContact O-N 2.62Å; P98-K100 VanDerWaalsContact O-N 3.16Å
101	C	89.5	Confident	82.5	Confident	17 Å²	17	63 Å²	63	12%	0.115	40%	0.395	C	S	.	.			trans	-70.4	140.3	170.2	-162.3	0	0	0	0	110.7	C106 A108 L116 H123	C101-C106 HydrophobicContact CB-CB 4.04Å; C101-A108 WeakPolarHBondContact CB-O 3.34Å; C101-A108 PolarHBondContact N-O 2.88Å; C101-L116 HydrophobicContact CB-CD1 4.36Å; C101-H123 PolarHBondContact SG-NE2 2.67Å; C101-H123 VanDerWaalsContact SG-NE2 3.4Å
102	V	86.8	Confident	82.4	Confident	141 Å²	141	64 Å²	64	86%	0.855	40%	0.403	S	S	*	.			trans	-91.1	-10.5	178.2	-173.6	0	0	0	0	111.6	G104	V102-G104 PolarHBondContact O-N 2.83Å
103	V	84.6	Confident	82.4	Confident	43 Å²	43	66.4 Å²	66.4	26%	0.261	41%	0.408	S	S	.	.	S	Bend	trans	-74.9	122.9	-179.8	-178.2	0	0	0	0	109.9	G105 C106 H123	V103-G105 PolarHBondContact O-N 3.35Å; V103-C106 HydrophobicContact CB-CB 4.38Å; V103-C106 VanDerWaalsContact O-CB 3.3Å; V103-C106 WeakPolarHBondContact O-CB 3.39Å; V103-C106 PolarHBondContact O-N 3.19Å; V103-H123 HydrophobicContact CG1-CB 4.16Å; V103-H123 HydrophobicContact CG2-CB 4.19Å
104	G	78.8	Confident	82.5	Confident	77 Å²	77	67 Å²	67	79%	0.794	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	136.2	177.3	0	0	0	0	0	112.2	V102 C106	V102-G104 PolarHBondContact O-N 2.83Å; G104-C106 VanDerWaalsContact C-N 3.29Å; G104-C106 PolarHBondContact O-N 3.48Å
105	G	80.4	Confident	82.7	Confident	87 Å²	87	67.5 Å²	67.5	90%	0.897	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-6.4	-173.4	0	0	0	0	0	115	V103	V103-G105 PolarHBondContact O-N 3.35Å
106	C	85.9	Confident	83.1	Confident	22 Å²	22	66.9 Å²	66.9	15%	0.149	42%	0.418	C	S	.	.			trans	-103.7	106.6	176.6	-170.3	0	0	0	0	113.1	C101 V103 G104 A108 H119 H123	C101-C106 HydrophobicContact CB-CB 4.04Å; V103-C106 HydrophobicContact CB-CB 4.38Å; V103-C106 VanDerWaalsContact O-CB 3.3Å; V103-C106 WeakPolarHBondContact O-CB 3.39Å; V103-C106 PolarHBondContact O-N 3.19Å; G104-C106 VanDerWaalsContact C-N 3.29Å; G104-C106 PolarHBondContact O-N 3.48Å; C106-A108 PolarHBondContact O-N 3.46Å; C106-A108 WeakPolarHBondContact SG-CB 3.38Å; C106-A108 PolarHBondContact SG-N 3.01Å; C106-H119 PolarHBondContact SG-NE2 2.74Å; C106-H123 VanDerWaalsContact CB-CE1 3.46Å; C106-H123 WeakPolarHBondContact CB-CE1 3.3Å; C106-H123 PolarHBondContact SG-CE1 2.73Å
107	N	83.4	Confident	83.5	Confident	158 Å²	158	68.6 Å²	68.6	85%	0.845	44%	0.436	S	S	*	.			trans	-85	12.2	174	-66.1	-26	0	0	0	113.8	S109	N107-S109 PolarHBondContact O-N 3.38Å; N107-S109 PolarHBondContact O-OG 3.48Å
108	A	82.9	Confident	83.8	Confident	32 Å²	32	73 Å²	73	26%	0.264	45%	0.449	S	S	.	.			trans	-69.2	128.8	-178.6	0	0	0	0	0	111.4	C101 C106 F110	C101-A108 WeakPolarHBondContact CB-O 3.34Å; C101-A108 PolarHBondContact N-O 2.88Å; C106-A108 PolarHBondContact O-N 3.46Å; C106-A108 WeakPolarHBondContact SG-CB 3.38Å; C106-A108 PolarHBondContact SG-N 3.01Å; A108-F110 HydrophobicContact CB-CE2 3.79Å; A108-F110 HydrophobicContact CB-CZ 3.87Å
109	S	84.3	Confident	84.3	Confident	40 Å²	40	71.3 Å²	71.3	28%	0.28	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138.6	-179.2	-53.6	0	0	0	0	110	N107	N107-S109 PolarHBondContact O-N 3.38Å; N107-S109 PolarHBondContact O-OG 3.48Å
110	F	83.3	Confident	84.6	Confident	52 Å²	52	70.3 Å²	70.3	23%	0.228	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.4	-171.1	-57.9	-89.1	0	0	0	111.8	K97 F99 A108 S112 L116 H119	K97-F110 CarbonylContact C-O 3.45Å; K97-F110 WeakPolarHBondContact CA-O 3.43Å; F99-F110 HydrophobicContact CB-CB 4.24Å; F99-F110 WeakPolarHBondContact CB-O 3.45Å; F99-F110 WeakPolarHBondContact CD2-O 3.44Å; F99-F110 PolarHBondContact N-O 2.83Å; F99-F110 VanDerWaalsContact N-O 3.16Å; F99-F110 WeakPolarHBondContact O-CD2 3.18Å; F99-F110 PolarHBondContact O-N 2.86Å; A108-F110 HydrophobicContact CB-CE2 3.79Å; A108-F110 HydrophobicContact CB-CZ 3.87Å; F110-S112 PolarHBondContact O-N 2.96Å; F110-L116 HydrophobicContact CD2-CB 4.06Å; F110-L116 HydrophobicContact CD2-CD1 4.09Å; F110-L116 HydrophobicContact CE2-CD1 4.26Å; F110-L116 HydrophobicContact CG-CB 4.47Å; F110-H119 HydrophobicContact CE1-CB 4.08Å; F110-H119 HydrophobicContact CE2-CB 3.86Å; F110-H119 AromaticContact CE2-CD2 3.27Å; F110-H119 WeakPolarHBondContact CE2-CD2 3.47Å; F110-H119 AromaticContact CE2-CG 3.64Å; F110-H119 AromaticContact CE2-NE2 4Å; F110-H119 HydrophobicContact CZ-CB 3.45Å; F110-H119 VanDerWaalsContact CZ-CB 3.45Å; F110-H119 AromaticContact CZ-CD2 3.43Å; F110-H119 VanDerWaalsContact CZ-CD2 3.43Å; F110-H119 WeakPolarHBondContact CZ-CD2 3.47Å; F110-H119 AromaticContact CZ-CG 3.31Å; F110-H119 AromaticContact CZ-ND1 3.91Å
111	A	79.7	Confident	84.7	Confident	32 Å²	32	66.9 Å²	66.9	26%	0.264	43%	0.427	S	S	.	.	S	Bend	trans	-82.5	8.6	171.9	0	0	0	0	0	113.3	L91	L91-A111 HydrophobicContact CB-CB 3.96Å; L91-A111 HydrophobicContact CD1-CB 4.17Å; L91-A111 VanDerWaalsContact CD1-O 3.27Å; L91-A111 WeakPolarHBondContact CD1-O 3.46Å
112	S	82.6	Confident	84.4	Confident	39 Å²	39	68.7 Å²	68.7	27%	0.273	44%	0.438	S	S	.	.	S	Bend	trans	-159.1	146.1	174.1	65.4	0	0	0	0	113.3	F99 F110 G114 G115 L116	F99-S112 VanDerWaalsContact CD2-C 3.41Å; F99-S112 VanDerWaalsContact CD2-CA 3.46Å; F110-S112 PolarHBondContact O-N 2.96Å; S112-G114 VanDerWaalsContact C-N 3.27Å; S112-G114 PolarHBondContact O-N 3.08Å; S112-G115 WeakPolarHBondContact O-CA 3.3Å; S112-G115 PolarHBondContact O-N 3.16Å; S112-G115 PolarHBondContact OG-N 2.94Å; S112-L116 PolarHBondContact O-N 3.14Å
113	Q	83.6	Confident	84.1	Confident	144 Å²	144	64.6 Å²	64.6	67%	0.673	41%	0.41	S	S	*	.	H	α-helix	trans	-54.7	-39.7	173.2	-173	-175.1	4.9	0	0	112.5	F99 G115 L116 A117	F99-Q113 HydrophobicContact CD1-CB 4.15Å; F99-Q113 HydrophobicContact CE1-CB 3.84Å; F99-Q113 HydrophobicContact CZ-CB 4.18Å; Q113-G115 VanDerWaalsContact C-N 3.28Å; Q113-G115 PolarHBondContact O-N 3.03Å; Q113-L116 PolarHBondContact O-N 3.1Å; Q113-A117 WeakPolarHBondContact O-CB 3.43Å; Q113-A117 PolarHBondContact O-N 2.99Å
114	G	84.5	Confident	84	Confident	55 Å²	55	70.4 Å²	70.4	57%	0.567	43%	0.431	S	S	*	.	H	α-helix	trans	-66	-28.6	176.9	0	0	0	0	0	113.8	S112 R118	S112-G114 VanDerWaalsContact C-N 3.27Å; S112-G114 PolarHBondContact O-N 3.08Å; G114-R118 PolarHBondContact O-N 3.27Å
115	G	84.6	Confident	83.5	Confident	14 Å²	14	71.4 Å²	71.4	14%	0.144	43%	0.427	C	S	.	.	H	α-helix	trans	-68	-49.3	171.1	0	0	0	0	0	111.6	S112 Q113 R118 H119	S112-G115 WeakPolarHBondContact O-CA 3.3Å; S112-G115 PolarHBondContact O-N 3.16Å; S112-G115 PolarHBondContact OG-N 2.94Å; Q113-G115 VanDerWaalsContact C-N 3.28Å; Q113-G115 PolarHBondContact O-N 3.03Å; G115-R118 PolarHBondContact O-N 3.11Å; G115-H119 PolarHBondContact O-N 3.35Å; G115-H119 VanDerWaalsContact O-N 3.11Å
116	L	87.8	Confident	82.5	Confident	29 Å²	29	73 Å²	73	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-60	-46.7	175.6	176.7	61.7	0	0	0	111.8	F99 C101 F110 S112 Q113 R118 H119 V120	F99-L116 HydrophobicContact CB-CB 4.18Å; F99-L116 HydrophobicContact CB-CD2 4.1Å; C101-L116 HydrophobicContact CB-CD1 4.36Å; F110-L116 HydrophobicContact CD2-CB 4.06Å; F110-L116 HydrophobicContact CD2-CD1 4.09Å; F110-L116 HydrophobicContact CE2-CD1 4.26Å; F110-L116 HydrophobicContact CG-CB 4.47Å; S112-L116 PolarHBondContact O-N 3.14Å; Q113-L116 PolarHBondContact O-N 3.1Å; L116-R118 VanDerWaalsContact C-N 3.25Å; L116-R118 PolarHBondContact O-N 3.34Å; L116-H119 WeakPolarHBondContact O-CA 3.43Å; L116-H119 WeakPolarHBondContact O-CB 3.47Å; L116-H119 PolarHBondContact O-N 2.96Å; L116-V120 HydrophobicContact CD1-CG2 3.81Å; L116-V120 HydrophobicContact CG-CG2 4.18Å; L116-V120 WeakPolarHBondContact O-CG2 3.27Å; L116-V120 PolarHBondContact O-N 3.16Å
117	A	86.9	Confident	80.9	Confident	63 Å²	63	80.7 Å²	80.7	52%	0.521	44%	0.444	S	S	.	.	H	α-helix	trans	-62.2	-29.3	-179.6	0	0	0	0	0	113.5	Q113 P121	Q113-A117 WeakPolarHBondContact O-CB 3.43Å; Q113-A117 PolarHBondContact O-N 2.99Å; A117-P121 WeakPolarHBondContact O-CD 3.49Å
118	R	86.8	Confident	79.1	Confident	205 Å²	205	80.8 Å²	80.8	77%	0.774	45%	0.445	S	S	*	.	H	α-helix	trans	-79.5	-26.6	171.8	-172.6	178.6	65.1	176.1	0.7	112.7	G114 G115 L116	G114-R118 PolarHBondContact O-N 3.27Å; G115-R118 PolarHBondContact O-N 3.11Å; L116-R118 VanDerWaalsContact C-N 3.25Å; L116-R118 PolarHBondContact O-N 3.34Å
119	H	87.4	Confident	77.1	Confident	32 Å²	32	82.8 Å²	82.8	15%	0.148	46%	0.457	C	S	.	.	H	α-helix	trans	-81.8	-40	180	169.1	62.6	0	0	0	113.2	C106 F110 G115 L116 P121 T122 H123	C106-H119 PolarHBondContact SG-NE2 2.74Å; F110-H119 HydrophobicContact CE1-CB 4.08Å; F110-H119 HydrophobicContact CE2-CB 3.86Å; F110-H119 AromaticContact CE2-CD2 3.27Å; F110-H119 WeakPolarHBondContact CE2-CD2 3.47Å; F110-H119 AromaticContact CE2-CG 3.64Å; F110-H119 AromaticContact CE2-NE2 4Å; F110-H119 HydrophobicContact CZ-CB 3.45Å; F110-H119 VanDerWaalsContact CZ-CB 3.45Å; F110-H119 AromaticContact CZ-CD2 3.43Å; F110-H119 VanDerWaalsContact CZ-CD2 3.43Å; F110-H119 WeakPolarHBondContact CZ-CD2 3.47Å; F110-H119 AromaticContact CZ-CG 3.31Å; F110-H119 AromaticContact CZ-ND1 3.91Å; G115-H119 PolarHBondContact O-N 3.35Å; G115-H119 VanDerWaalsContact O-N 3.11Å; L116-H119 WeakPolarHBondContact O-CA 3.43Å; L116-H119 WeakPolarHBondContact O-CB 3.47Å; L116-H119 PolarHBondContact O-N 2.96Å; H119-P121 VanDerWaalsContact C-CD 3.5Å; H119-P121 VanDerWaalsContact C-N 3.32Å; H119-T122 PolarHBondContact O-N 2.98Å; H119-T122 PolarHBondContact O-OG1 3.24Å; H119-H123 AromaticContact CD2-NE2 3.77Å; H119-H123 AromaticContact CE1-CE1 3.74Å; H119-H123 AromaticContact CE1-NE2 3.17Å; H119-H123 PolarHBondContact CE1-NE2 2.88Å; H119-H123 AromaticContact NE2-CD2 3.93Å; H119-H123 AromaticContact NE2-CE1 3.77Å; H119-H123 AromaticContact NE2-NE2 2.94Å; H119-H123 PolarHBondContact NE2-NE2 3.14Å
120	V	87.3	Confident	75	Confident	50 Å²	50	86.1 Å²	86.1	30%	0.303	48%	0.48	S	S	.	.	H	α-helix	trans	-51.5	-43.2	-178.1	170.6	0	0	0	0	113.3	L116 T122 H123 F124	L116-V120 HydrophobicContact CD1-CG2 3.81Å; L116-V120 HydrophobicContact CG-CG2 4.18Å; L116-V120 WeakPolarHBondContact O-CG2 3.27Å; L116-V120 PolarHBondContact O-N 3.16Å; V120-T122 PolarHBondContact O-N 3.4Å; V120-H123 PolarHBondContact O-N 3.35Å; V120-F124 HydrophobicContact CG1-CE2 3.97Å; V120-F124 WeakPolarHBondContact O-CD2 3.33Å
121	P	87.1	Confident	73.2	Confident	72 Å²	72	93.2 Å²	93.2	47%	0.468	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-23.7	175.8	-26.7	36.3	0	0	0	115.7	A117 H119 H123 F124 S125	A117-P121 WeakPolarHBondContact O-CD 3.49Å; H119-P121 VanDerWaalsContact C-CD 3.5Å; H119-P121 VanDerWaalsContact C-N 3.32Å; P121-H123 VanDerWaalsContact C-N 3.26Å; P121-H123 PolarHBondContact O-N 2.83Å; P121-F124 PolarHBondContact O-N 3.46Å; P121-S125 WeakPolarHBondContact O-CB 3.45Å; P121-S125 PolarHBondContact O-N 3.06Å
122	T	83.4	Confident	71.2	Confident	56 Å²	56	98.7 Å²	98.7	34%	0.344	54%	0.541	S	S	.	.	H	α-helix	trans	-68.7	-27.6	-178.5	68.1	0	0	0	0	112.1	H119 V120 S125 Q126	H119-T122 PolarHBondContact O-N 2.98Å; H119-T122 PolarHBondContact O-OG1 3.24Å; V120-T122 PolarHBondContact O-N 3.4Å; T122-S125 PolarHBondContact O-N 3.31Å; T122-Q126 WeakPolarHBondContact O-CB 3.49Å; T122-Q126 PolarHBondContact O-N 3.1Å; T122-Q126 VanDerWaalsContact O-N 3.14Å
123	H	81.6	Confident	69.1	Low	55 Å²	55	101.5 Å²	101.5	26%	0.255	56%	0.56	S	S	.	*	H	α-helix	trans	-65.3	-40.9	174.8	-66.3	-66.6	0	0	0	112.7	C101 V103 C106 H119 V120 P121	C101-H123 PolarHBondContact SG-NE2 2.67Å; C101-H123 VanDerWaalsContact SG-NE2 3.4Å; V103-H123 HydrophobicContact CG1-CB 4.16Å; V103-H123 HydrophobicContact CG2-CB 4.19Å; C106-H123 VanDerWaalsContact CB-CE1 3.46Å; C106-H123 WeakPolarHBondContact CB-CE1 3.3Å; C106-H123 PolarHBondContact SG-CE1 2.73Å; H119-H123 AromaticContact CD2-NE2 3.77Å; H119-H123 AromaticContact CE1-CE1 3.74Å; H119-H123 AromaticContact CE1-NE2 3.17Å; H119-H123 PolarHBondContact CE1-NE2 2.88Å; H119-H123 AromaticContact NE2-CD2 3.93Å; H119-H123 AromaticContact NE2-CE1 3.77Å; H119-H123 AromaticContact NE2-NE2 2.94Å; H119-H123 PolarHBondContact NE2-NE2 3.14Å; V120-H123 PolarHBondContact O-N 3.35Å; P121-H123 VanDerWaalsContact C-N 3.26Å; P121-H123 PolarHBondContact O-N 2.83Å
124	F	80.9	Confident	67.1	Low	164 Å²	164	99.4 Å²	99.4	72%	0.719	56%	0.562	S	S	*	*	H	α-helix	trans	-81.5	-20.5	-179.8	-58.6	-76.8	0	0	0	112.8	V120 P121	V120-F124 HydrophobicContact CG1-CE2 3.97Å; V120-F124 WeakPolarHBondContact O-CD2 3.33Å; P121-F124 PolarHBondContact O-N 3.46Å
125	S	68.6	Low	64.6	Low	99 Å²	99	105 Å²	105	69%	0.692	57%	0.573	S	S	*	*	H	α-helix	trans	-96.3	-7.8	-178.9	-170.8	0	0	0	0	114.6	P121 T122	P121-S125 WeakPolarHBondContact O-CB 3.45Å; P121-S125 PolarHBondContact O-N 3.06Å; T122-S125 PolarHBondContact O-N 3.31Å
126	Q	59.1	Low	62.6	Low	119 Å²	119	109.6 Å²	109.6	56%	0.556	60%	0.601	S	S	*	*			trans	-134.4	53.8	-173.3	-62.8	-166.2	-43.4	0	0	114.2	T122 N128	T122-Q126 WeakPolarHBondContact O-CB 3.49Å; T122-Q126 PolarHBondContact O-N 3.1Å; T122-Q126 VanDerWaalsContact O-N 3.14Å; Q126-N128 PolarHBondContact O-N 2.86Å
127	Q	53.1	Low	59.8	Low	185 Å²	185	118.3 Å²	118.3	86%	0.864	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	41.7	164.2	-78.3	-92.3	14	0	0	113
128	N	44.9	Very low	57.2	Low	159 Å²	159	120 Å²	120	85%	0.85	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.8	26.7	162.1	-140.2	2.2	0	0	0	117.8	Q126	Q126-N128 PolarHBondContact O-N 2.86Å
129	S	40.9	Very low	55	Low	74 Å²	74	120 Å²	120	52%	0.517	66%	0.657	S	S	.	*			trans	-137.3	73.3	175.7	65.1	0	0	0	0	113.2
130	S	41.5	Very low	52.1	Low	110 Å²	110	127 Å²	127	77%	0.769	69%	0.69	S	S	*	*			trans	-61.9	141.5	168.7	-46.1	0	0	0	0	111.4
131	K	44.5	Very low	49.4	Very low	201 Å²	201	132.8 Å²	132.8	87%	0.874	71%	0.713	S	S	*	*			trans	72	92.7	170.4	-49.6	174.3	-176.7	175.9	0	117.2
132	V	39.1	Very low	47.4	Very low	148 Å²	148	134.3 Å²	134.3	90%	0.897	73%	0.726	S	S	*	*				-138	112.9	125.2	-179.7	0	0	0	0	109.3
133	S	38.2	Very low	45.5	Very low	97 Å²	97	137.3 Å²	137.3	68%	0.678	75%	0.746	S	S	*	*			trans	-87.8	135.6	164.5	54.3	0	0	0	0	110.6
134	S	40.6	Very low	43.2	Very low	101 Å²	101	140.1 Å²	140.1	71%	0.706	77%	0.772	S	S	*	*			trans	34.7	96.6	145.6	59.9	0	0	0	0	119.4
135	Q	32.1	Very low	41.6	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	78%	0.784	S	S	*	*			trans	-145.3	141.2	140.1	-85.6	-58.8	-47.6	0	0	109.4
136	P	42.8	Very low	40.4	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	79%	0.789	S	S	*	*			trans	-76.9	142.5	162.2	33.4	-31.2	0	0	0	109.4
137	K	29.4	Very low	40	Very low	211 Å²	211	140.6 Å²	140.6	92%	0.917	80%	0.798	S	S	*	*			trans	-122.9	145.9	166.2	-92.7	-165.9	166.1	-173.4	0	112
138	A	31.1	Very low	39.5	Very low	100 Å²	100	140.7 Å²	140.7	83%	0.826	80%	0.801	S	S	*	*			trans	-83.6	-176	-164.1	0	0	0	0	0	113.2
139	K	40.5	Very low	39.8	Very low	203 Å²	203	140.6 Å²	140.6	88%	0.883	80%	0.801	S	S	*	*			trans	-48.9	141.1	172.3	-61.1	171.6	174	179.7	0	111.7
140	E	27.8	Very low	40.4	Very low	181 Å²	181	146.6 Å²	146.6	85%	0.846	82%	0.817	S	S	*	*			trans	-140.5	155.2	142.3	-95.4	-52.5	147.7	0	0	108.2
141	E	31	Very low	41	Very low	170 Å²	170	153 Å²	153	79%	0.794	82%	0.824	S	S	*	*			trans	-81.3	155.5	-169	-71.7	-162.1	69.8	0	0	115
142	S	45.5	Very low	41.7	Very low	104 Å²	104	155.3 Å²	155.3	73%	0.727	83%	0.828	S	S	*	*			trans	22	130.2	146.6	-58.5	0	0	0	0	119.1
143	P	41.5	Very low	42.6	Very low	119 Å²	119	157.3 Å²	157.3	77%	0.773	82%	0.824	S	S	*	*				-150.2	169.5	72.9	39.3	-21	0	0	0	118
144	S	34.5	Very low	43.7	Very low	114 Å²	114	160.2 Å²	160.2	80%	0.797	83%	0.832	S	S	*	*			trans	57.9	103.2	148.9	-61.8	0	0	0	0	120.3	A146	S144-A146 PolarHBondContact O-N 2.86Å; S144-A146 VanDerWaalsContact O-N 3.1Å
145	K	47.8	Very low	44.5	Very low	223 Å²	223	163.9 Å²	163.9	97%	0.97	84%	0.835	S	S	*	*			trans	-63	102.6	162.8	-68.5	168.8	178.6	165.1	0	111.5
146	A	42.8	Very low	45.9	Very low	97 Å²	97	162.5 Å²	162.5	80%	0.802	83%	0.833	S	S	*	*			trans	-143.9	140.7	158.3	0	0	0	0	0	110.3	S144	S144-A146 PolarHBondContact O-N 2.86Å; S144-A146 VanDerWaalsContact O-N 3.1Å
147	G	49.8	Very low	46.8	Very low	72 Å²	72	163.5 Å²	163.5	74%	0.742	83%	0.826	S	S	*	*			trans	84.3	26.2	165.3	0	0	0	0	0	118.5	N149	G147-N149 VanDerWaalsContact C-N 3.26Å; G147-N149 PolarHBondContact O-N 2.88Å
148	M	44.3	Very low	48.3	Very low	187 Å²	187	165.1 Å²	165.1	92%	0.921	83%	0.826	S	S	*	*			trans	-69.7	87.9	161.5	-75.5	-142.6	87.4	0	0	110.4	K150	M148-K150 PolarHBondContact O-N 3.2Å
149	N	50.4	Low	49.7	Very low	158 Å²	158	168.2 Å²	168.2	85%	0.845	82%	0.816	S	S	*	*			trans	-54.1	102.3	162.8	-86.1	-28.4	0	0	0	108.4	G147 R151	G147-N149 VanDerWaalsContact C-N 3.26Å; G147-N149 PolarHBondContact O-N 2.88Å; N149-R151 PolarHBondContact O-N 3.37Å
150	K	54.3	Low	50.9	Low	199 Å²	199	171 Å²	171	87%	0.865	82%	0.821	S	S	*	*			trans	-53.5	106.8	176.2	-97	173.2	177.2	163.7	0	107.6	M148 R152	M148-K150 PolarHBondContact O-N 3.2Å; K150-R152 PolarHBondContact O-N 3.32Å
151	R	53.8	Low	52.7	Low	244 Å²	244	167.1 Å²	167.1	92%	0.921	81%	0.814	S	S	*	*			trans	-35.2	107.7	165	-125.1	175.9	169	-177.8	-5.8	107	N149 K153	N149-R151 PolarHBondContact O-N 3.37Å; R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 2.92Å
152	R	58.5	Low	54.7	Low	250 Å²	250	164.3 Å²	164.3	94%	0.943	80%	0.804	S	S	*	*			trans	-57.1	102	178	-97.2	176.8	157.2	-173.2	-5.1	105.8	K150 L154	K150-R152 PolarHBondContact O-N 3.32Å; R152-L154 PolarHBondContact O-N 2.87Å
153	K	58.3	Low	56.2	Low	190 Å²	190	165.3 Å²	165.3	83%	0.826	81%	0.808	S	S	*	*			trans	-51.7	119.2	170.6	-92.2	-175	172.8	-179	0	105.4	R151 K155	R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 2.92Å; K153-K155 PolarHBondContact O-N 3.21Å
154	L	61.2	Low	57.8	Low	159 Å²	159	170.3 Å²	170.3	83%	0.832	81%	0.812	S	S	*	*			trans	-54.3	110.5	172	-162.5	76.3	0	0	0	105.7	R152 N156	R152-L154 PolarHBondContact O-N 2.87Å; L154-N156 PolarHBondContact O-N 2.89Å
155	K	57.9	Low	60	Low	178 Å²	178	170.2 Å²	170.2	77%	0.774	81%	0.808	S	S	*	*			trans	-73.9	85.7	-172.3	-82	-176.3	176.7	175.1	0	107.5	K153 K157	K153-K155 PolarHBondContact O-N 3.21Å; K155-K157 HydrophobicContact CB-CG 4.5Å; K155-K157 PolarHBondContact O-N 3.02Å
156	N	60.8	Low	61.7	Low	142 Å²	142	168.4 Å²	168.4	76%	0.759	80%	0.803	S	S	*	*			trans	-65	73.5	163.4	-85.9	7.3	0	0	0	109	L154 R158	L154-N156 PolarHBondContact O-N 2.89Å; N156-R158 PolarHBondContact O-N 2.78Å
157	K	61.4	Low	63.6	Low	132 Å²	132	168.9 Å²	168.9	57%	0.574	79%	0.792	S	S	*	*			trans	-69.3	74.6	167.2	-81	-178.9	174.9	178	0	108.1	K155 R159	K155-K157 HydrophobicContact CB-CG 4.5Å; K155-K157 PolarHBondContact O-N 3.02Å; K157-R159 HydrophobicContact CB-CG 4.38Å; K157-R159 PolarHBondContact O-N 2.81Å
158	R	60.6	Low	65.4	Low	246 Å²	246	174.3 Å²	174.3	93%	0.928	80%	0.796	S	S	*	*			trans	-71	73.4	153.5	-77	-172	173.8	-174.4	-2	107.9	N156	N156-R158 PolarHBondContact O-N 2.78Å
159	R	61.3	Low	67.4	Low	164 Å²	164	171.1 Å²	171.1	62%	0.619	78%	0.777	S	S	*	*			trans	-82	137.3	164.2	-70.3	-162.9	179.3	-76.6	9.4	107.3	K157 S161 L162	K157-R159 HydrophobicContact CB-CG 4.38Å; K157-R159 PolarHBondContact O-N 2.81Å; R159-S161 PolarHBondContact O-N 2.71Å; R159-L162 HydrophobicContact CB-CD2 4.05Å; R159-L162 HydrophobicContact CG-CD2 4.35Å
160	R	65.2	Low	69.3	Low	261 Å²	261	167 Å²	167	99%	0.985	76%	0.755	S	S	*	*	S	Bend	trans	-64.3	-24	-170.8	-72.2	-171.2	176.6	-145.2	1.1	113.9
161	S	66.8	Low	70.9	Confident	100 Å²	100	160.9 Å²	160.9	70%	0.699	74%	0.741	S	S	*	*			trans	-151.6	150.3	155.4	50.6	0	0	0	0	108.2	R159	R159-S161 PolarHBondContact O-N 2.71Å
162	L	72	Confident	72.6	Confident	112 Å²	112	156.6 Å²	156.6	59%	0.586	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-100.3	150.3	159.9	-66.6	174.8	0	0	0	106.9	R159 R164	R159-L162 HydrophobicContact CB-CD2 4.05Å; R159-L162 HydrophobicContact CG-CD2 4.35Å; L162-R164 PolarHBondContact O-N 2.89Å
163	P	76.9	Confident	74	Confident	125 Å²	125	147.8 Å²	147.8	81%	0.812	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-50.6	127	165.2	-24.2	34.4	0	0	0	108.8
164	R	75.5	Confident	75.6	Confident	224 Å²	224	142.6 Å²	142.6	85%	0.845	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-60	129	177.2	171.3	172.4	-82	-98.2	4.2	107.3	L162 H166	L162-R164 PolarHBondContact O-N 2.89Å; R164-H166 PolarHBondContact O-N 3.03Å
165	P	79.6	Confident	76.9	Confident	112 Å²	112	138.7 Å²	138.7	73%	0.727	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-58.3	137	172.5	26.1	-33.8	0	0	0	108.5	D167	P165-D167 PolarHBondContact O-N 3.5Å
166	H	83.2	Confident	78.3	Confident	185 Å²	185	132.1 Å²	132.1	86%	0.856	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-62	121.9	174.5	-170.8	-72.5	0	0	0	108.1	R164	R164-H166 PolarHBondContact O-N 3.03Å
167	D	83.9	Confident	79.5	Confident	107 Å²	107	129.7 Å²	129.7	57%	0.572	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-74.5	139	173.8	-154.1	-33.7	0	0	0	108.6	P165 F169	P165-D167 PolarHBondContact O-N 3.5Å; D167-F169 PolarHBondContact OD1-N 3.49Å; D167-F169 VanDerWaalsContact OD1-N 3.16Å
168	F	87.3	Confident	80.6	Confident	186 Å²	186	129.7 Å²	129.7	82%	0.816	63%	0.628	S	S	*	*	S	Bend	trans	-81.5	-27	177.6	-178	-98.5	0	0	0	111.3	D170	F168-D170 PolarHBondContact O-N 3.43Å
169	F	87	Confident	81.8	Confident	119 Å²	119	124.1 Å²	124.1	52%	0.522	61%	0.612	S	S	.	*			trans	-80.1	120	179.3	-64.6	-76.2	0	0	0	110.7	D167 T173 L174	D167-F169 PolarHBondContact OD1-N 3.49Å; D167-F169 VanDerWaalsContact OD1-N 3.16Å; F169-T173 HydrophobicContact CD1-CG2 4.35Å; F169-L174 HydrophobicContact CB-CD2 4.47Å; F169-L174 HydrophobicContact CB-CG 4.38Å
170	D	89.6	Confident	82.8	Confident	73 Å²	73	121.3 Å²	121.3	39%	0.39	60%	0.602	S	S	.	*			trans	-91.2	167.4	171.9	71.3	-14.1	0	0	0	111.7	F168 Q172 T173 L174	F168-D170 PolarHBondContact O-N 3.43Å; D170-Q172 PolarHBondContact O-N 2.94Å; D170-T173 PolarHBondContact O-N 3.33Å; D170-T173 WeakPolarHBondContact OD1-CB 3.45Å; D170-T173 PolarHBondContact OD1-N 3.17Å; D170-T173 PolarHBondContact OD1-OG1 3.4Å; D170-L174 WeakPolarHBondContact O-CG 3.39Å; D170-L174 PolarHBondContact O-N 2.95Å
171	A	88.3	Confident	83.6	Confident	70 Å²	70	111.5 Å²	111.5	58%	0.579	58%	0.576	S	S	*	*	H	α-helix	trans	-61.2	-35.1	177.6	0	0	0	0	0	111.9	L174 D175	A171-L174 PolarHBondContact O-N 3.25Å; A171-D175 VanDerWaalsContact O-CB 3.3Å; A171-D175 WeakPolarHBondContact O-CB 3.43Å; A171-D175 PolarHBondContact O-N 3.29Å
172	Q	90.1	Very high	84.4	Confident	154 Å²	154	111.1 Å²	111.1	72%	0.72	57%	0.565	S	S	*	*	H	α-helix	trans	-66.2	-43.4	-178	-170.2	172.4	7.5	0	0	112.3	D170 D175 A176	D170-Q172 PolarHBondContact O-N 2.94Å; Q172-D175 PolarHBondContact O-N 3.41Å; Q172-A176 WeakPolarHBondContact O-CB 3.47Å; Q172-A176 PolarHBondContact O-N 3.25Å
173	T	87.8	Confident	84.7	Confident	64 Å²	64	108.8 Å²	108.8	39%	0.393	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-43.8	174.4	-58.6	0	0	0	0	110.9	F169 D170 D175 A176 I177	F169-T173 HydrophobicContact CD1-CG2 4.35Å; D170-T173 PolarHBondContact O-N 3.33Å; D170-T173 WeakPolarHBondContact OD1-CB 3.45Å; D170-T173 PolarHBondContact OD1-N 3.17Å; D170-T173 PolarHBondContact OD1-OG1 3.4Å; T173-D175 PolarHBondContact O-N 3.11Å; T173-A176 PolarHBondContact O-N 2.89Å; T173-I177 HydrophobicContact CG2-CD1 3.95Å; T173-I177 VanDerWaalsContact O-CG1 3.27Å; T173-I177 WeakPolarHBondContact O-CG1 3.35Å; T173-I177 PolarHBondContact O-N 3.21Å
174	L	91.1	Very high	84.6	Confident	82 Å²	82	105.5 Å²	105.5	43%	0.429	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-37.1	177.9	-68.9	174.6	0	0	0	112.8	F169 D170 A171 I177 R178	F169-L174 HydrophobicContact CB-CD2 4.47Å; F169-L174 HydrophobicContact CB-CG 4.38Å; D170-L174 WeakPolarHBondContact O-CG 3.39Å; D170-L174 PolarHBondContact O-N 2.95Å; A171-L174 PolarHBondContact O-N 3.25Å; L174-I177 PolarHBondContact O-N 3.35Å; L174-R178 WeakPolarHBondContact O-CB 3.4Å; L174-R178 PolarHBondContact O-N 2.9Å
175	D	88.9	Confident	84.7	Confident	76 Å²	76	97 Å²	97	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-70.2	-39.3	176.8	-73.6	-5.2	0	0	0	111.5	A171 Q172 T173 R178 H179	A171-D175 VanDerWaalsContact O-CB 3.3Å; A171-D175 WeakPolarHBondContact O-CB 3.43Å; A171-D175 PolarHBondContact O-N 3.29Å; Q172-D175 PolarHBondContact O-N 3.41Å; T173-D175 PolarHBondContact O-N 3.11Å; D175-R178 PolarHBondContact O-N 2.85Å; D175-R178 IonicContact OD1-CZ 3.38Å; D175-R178 IonicContact OD1-NH1 3.57Å; D175-R178 PolarHBondContact OD1-NH1 3.28Å; D175-R178 IonicContact OD1-NH2 3.99Å; D175-R178 PolarHBondContact OD1-NH2 3.18Å; D175-H179 WeakPolarHBondContact O-CB 3.27Å; D175-H179 PolarHBondContact O-N 2.83Å
176	A	86.3	Confident	84.3	Confident	41 Å²	41	97.3 Å²	97.3	34%	0.339	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-42.3	172.8	0	0	0	0	0	112.2	Q172 T173 R180	Q172-A176 WeakPolarHBondContact O-CB 3.47Å; Q172-A176 PolarHBondContact O-N 3.25Å; T173-A176 PolarHBondContact O-N 2.89Å; A176-R180 WeakPolarHBondContact O-CG 3.41Å; A176-R180 PolarHBondContact O-N 2.88Å; A176-R180 VanDerWaalsContact O-N 3.16Å
177	I	86.1	Confident	83.6	Confident	90 Å²	90	91.6 Å²	91.6	46%	0.462	48%	0.478	S	S	.	.	H	α-helix	trans	-63.2	-46.1	173.8	-67.5	163.9	0	0	0	110.4	T173 L174 H179 R180 A181	T173-I177 HydrophobicContact CG2-CD1 3.95Å; T173-I177 VanDerWaalsContact O-CG1 3.27Å; T173-I177 WeakPolarHBondContact O-CG1 3.35Å; T173-I177 PolarHBondContact O-N 3.21Å; L174-I177 PolarHBondContact O-N 3.35Å; I177-H179 PolarHBondContact O-N 3.49Å; I177-R180 PolarHBondContact O-N 3.48Å; I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.41Å
178	R	86.1	Confident	82.7	Confident	133 Å²	133	86.5 Å²	86.5	50%	0.502	45%	0.451	S	S	.	.	H	α-helix	trans	-61.3	-45.6	179.8	-166.5	-171.8	-50.3	113.5	18.3	111.8	L174 D175 A181 I182	L174-R178 WeakPolarHBondContact O-CB 3.4Å; L174-R178 PolarHBondContact O-N 2.9Å; D175-R178 PolarHBondContact O-N 2.85Å; D175-R178 IonicContact OD1-CZ 3.38Å; D175-R178 IonicContact OD1-NH1 3.57Å; D175-R178 PolarHBondContact OD1-NH1 3.28Å; D175-R178 IonicContact OD1-NH2 3.99Å; D175-R178 PolarHBondContact OD1-NH2 3.18Å; R178-A181 PolarHBondContact O-N 3.16Å; R178-I182 HydrophobicContact CG-CD1 3.97Å; R178-I182 VanDerWaalsContact O-CG1 3.31Å; R178-I182 WeakPolarHBondContact O-CG1 3.5Å; R178-I182 PolarHBondContact O-N 3.16Å
179	H	85.7	Confident	81.8	Confident	129 Å²	129	81 Å²	81	60%	0.597	43%	0.427	S	S	*	.	H	α-helix	trans	-60.9	-46.3	178.7	-171.7	-76.2	0	0	0	111.3	D175 I177 I182 C183	D175-H179 WeakPolarHBondContact O-CB 3.27Å; D175-H179 PolarHBondContact O-N 2.83Å; I177-H179 PolarHBondContact O-N 3.49Å; H179-I182 PolarHBondContact O-N 3.29Å; H179-C183 PolarHBondContact CE1-SG 2.94Å; H179-C183 PolarHBondContact O-N 3.39Å; H179-C183 PolarHBondContact O-SG 3.02Å; H179-C183 VanDerWaalsContact O-SG 3.33Å
180	R	81.8	Confident	80.8	Confident	105 Å²	105	76 Å²	76	40%	0.396	41%	0.406	S	S	.	.	H	α-helix	trans	-60.5	-47.5	175.8	-71.8	178	-170	149.2	10.4	112	A176 I177 I182 C183 F184 N262	A176-R180 WeakPolarHBondContact O-CG 3.41Å; A176-R180 PolarHBondContact O-N 2.88Å; A176-R180 VanDerWaalsContact O-N 3.16Å; I177-R180 PolarHBondContact O-N 3.48Å; R180-I182 VanDerWaalsContact C-N 3.31Å; R180-I182 PolarHBondContact O-N 3.31Å; R180-C183 PolarHBondContact O-N 3.4Å; R180-F184 VanDerWaalsContact O-CB 3.27Å; R180-F184 WeakPolarHBondContact O-CB 3.48Å; R180-F184 PolarHBondContact O-N 3.32Å; R180-N262 VanDerWaalsContact NH1-CG 3.34Å; R180-N262 PolarHBondContact NH1-ND2 2.72Å; R180-N262 PolarHBondContact NH1-OD1 3.48Å
181	A	81.9	Confident	79.4	Confident	54 Å²	54	79.3 Å²	79.3	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-59.7	-39.3	178.6	0	0	0	0	0	112.6	I177 R178 N185	I177-A181 WeakPolarHBondContact O-CB 3.49Å; I177-A181 PolarHBondContact O-N 3.41Å; R178-A181 PolarHBondContact O-N 3.16Å; A181-N185 VanDerWaalsContact O-CB 3.31Å; A181-N185 WeakPolarHBondContact O-CB 3.46Å; A181-N185 PolarHBondContact O-N 3.22Å
182	I	82.9	Confident	78.3	Confident	93 Å²	93	80.3 Å²	80.3	48%	0.477	42%	0.422	S	S	.	.	H	α-helix	trans	-66.2	-49.8	175.6	-69.1	166.8	0	0	0	110.9	R178 H179 R180 F184 N185 L186	R178-I182 HydrophobicContact CG-CD1 3.97Å; R178-I182 VanDerWaalsContact O-CG1 3.31Å; R178-I182 WeakPolarHBondContact O-CG1 3.5Å; R178-I182 PolarHBondContact O-N 3.16Å; H179-I182 PolarHBondContact O-N 3.29Å; R180-I182 VanDerWaalsContact C-N 3.31Å; R180-I182 PolarHBondContact O-N 3.31Å; I182-F184 VanDerWaalsContact C-N 3.28Å; I182-F184 PolarHBondContact O-N 3.36Å; I182-N185 PolarHBondContact O-N 3.3Å; I182-L186 HydrophobicContact CG2-CD1 3.91Å; I182-L186 HydrophobicContact CG2-CG 4.48Å; I182-L186 WeakPolarHBondContact O-CB 3.11Å; I182-L186 VanDerWaalsContact O-CG 3.32Å; I182-L186 WeakPolarHBondContact O-CG 3.39Å; I182-L186 PolarHBondContact O-N 3.2Å
183	C	79.6	Confident	77	Confident	63 Å²	63	77.8 Å²	77.8	43%	0.426	41%	0.412	S	S	.	.	H	α-helix	trans	-57.9	-41.7	176.8	-67.8	0	0	0	0	112.1	H179 R180 L186 S187	H179-C183 PolarHBondContact CE1-SG 2.94Å; H179-C183 PolarHBondContact O-N 3.39Å; H179-C183 PolarHBondContact O-SG 3.02Å; H179-C183 VanDerWaalsContact O-SG 3.33Å; R180-C183 PolarHBondContact O-N 3.4Å; C183-L186 PolarHBondContact O-N 3.18Å; C183-S187 PolarHBondContact O-N 3.15Å; C183-S187 PolarHBondContact O-OG 3.05Å
184	F	74.9	Confident	75.7	Confident	56 Å²	56	74.9 Å²	74.9	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-68.1	-40.3	178.8	-175.8	-112.3	0	0	0	113	R180 I182 L186 S187 A188 I190 L259	R180-F184 VanDerWaalsContact O-CB 3.27Å; R180-F184 WeakPolarHBondContact O-CB 3.48Å; R180-F184 PolarHBondContact O-N 3.32Å; I182-F184 VanDerWaalsContact C-N 3.28Å; I182-F184 PolarHBondContact O-N 3.36Å; F184-L186 VanDerWaalsContact C-N 3.34Å; F184-S187 PolarHBondContact O-N 3.19Å; F184-S187 PolarHBondContact O-OG 2.88Å; F184-S187 VanDerWaalsContact O-OG 3.05Å; F184-A188 HydrophobicContact CE2-CB 4.36Å; F184-A188 HydrophobicContact CZ-CB 4.39Å; F184-A188 VanDerWaalsContact O-CB 3.25Å; F184-A188 WeakPolarHBondContact O-CB 3.39Å; F184-A188 PolarHBondContact O-N 3.39Å; F184-I190 HydrophobicContact CD1-CD1 4.09Å; F184-I190 HydrophobicContact CE1-CD1 3.24Å; F184-I190 HydrophobicContact CZ-CD1 3.54Å; F184-L259 HydrophobicContact CE2-CB 3.86Å; F184-L259 HydrophobicContact CE2-CD2 3.8Å; F184-L259 HydrophobicContact CE2-CG 4.39Å; F184-L259 HydrophobicContact CZ-CB 4.29Å; F184-L259 HydrophobicContact CZ-CD2 4.19Å
185	N	77.1	Confident	74.8	Confident	44 Å²	44	79.7 Å²	79.7	24%	0.235	41%	0.413	C	S	.	.	H	α-helix	trans	-70.1	-32.9	176.2	-168.1	30.6	0	0	0	112.1	A181 I182 H189 E191	A181-N185 VanDerWaalsContact O-CB 3.31Å; A181-N185 WeakPolarHBondContact O-CB 3.46Å; A181-N185 PolarHBondContact O-N 3.22Å; I182-N185 PolarHBondContact O-N 3.3Å; N185-H189 WeakPolarHBondContact O-CA 3.45Å; N185-H189 PolarHBondContact O-N 3.45Å; N185-E191 PolarHBondContact ND2-OE2 3.12Å; N185-E191 WeakPolarHBondContact OD1-CB 3.42Å; N185-E191 PolarHBondContact OD1-N 3.2Å; N185-E191 VanDerWaalsContact OD1-N 3.14Å
186	L	71.9	Confident	73.8	Confident	119 Å²	119	78 Å²	78	62%	0.623	41%	0.413	S	S	*	.	H	α-helix	trans	-67.2	-36.8	172.8	-74.1	170	0	0	0	112.6	I182 C183 F184 H189	I182-L186 HydrophobicContact CG2-CD1 3.91Å; I182-L186 HydrophobicContact CG2-CG 4.48Å; I182-L186 WeakPolarHBondContact O-CB 3.11Å; I182-L186 VanDerWaalsContact O-CG 3.32Å; I182-L186 WeakPolarHBondContact O-CG 3.39Å; I182-L186 PolarHBondContact O-N 3.2Å; C183-L186 PolarHBondContact O-N 3.18Å; F184-L186 VanDerWaalsContact C-N 3.34Å; L186-H189 PolarHBondContact O-CE1 3.35Å; L186-H189 PolarHBondContact O-ND1 2.83Å
187	S	68.1	Low	73.2	Confident	65 Å²	65	82 Å²	82	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-79.2	-43	176.8	62.7	0	0	0	0	113.1	C183 F184 P224	C183-S187 PolarHBondContact O-N 3.15Å; C183-S187 PolarHBondContact O-OG 3.05Å; F184-S187 PolarHBondContact O-N 3.19Å; F184-S187 PolarHBondContact O-OG 2.88Å; F184-S187 VanDerWaalsContact O-OG 3.05Å; S187-P224 WeakPolarHBondContact O-CG 3.34Å
188	A	65.2	Low	72.9	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.008	41%	0.41	C	S	.	.	H	α-helix	trans	-98.6	-11.2	-168.6	0	0	0	0	0	115.1	F184 I190 V199 V200	F184-A188 HydrophobicContact CE2-CB 4.36Å; F184-A188 HydrophobicContact CZ-CB 4.39Å; F184-A188 VanDerWaalsContact O-CB 3.25Å; F184-A188 WeakPolarHBondContact O-CB 3.39Å; F184-A188 PolarHBondContact O-N 3.39Å; A188-I190 HydrophobicContact CB-CD1 3.5Å; A188-I190 VanDerWaalsContact CB-CD1 3.5Å; A188-I190 HydrophobicContact CB-CG1 3.66Å; A188-I190 PolarHBondContact O-N 3.26Å; A188-I190 VanDerWaalsContact O-N 3.09Å; A188-V199 HydrophobicContact CB-CG1 4.17Å; A188-V200 PolarHBondContact O-N 3.08Å
189	H	67.2	Low	72.5	Confident	70 Å²	70	72.5 Å²	72.5	32%	0.324	39%	0.386	S	S	.	.			trans	49.7	33.7	-179.7	-64.9	-29.2	0	0	0	114.8	N185 L186 S192 L193 G194	N185-H189 WeakPolarHBondContact O-CA 3.45Å; N185-H189 PolarHBondContact O-N 3.45Å; L186-H189 PolarHBondContact O-CE1 3.35Å; L186-H189 PolarHBondContact O-ND1 2.83Å; H189-S192 PolarHBondContact O-OG 3.06Å; H189-L193 HydrophobicContact CB-CD1 4.17Å; H189-L193 PolarHBondContact O-N 3.31Å; H189-L193 VanDerWaalsContact O-N 3.1Å; H189-G194 PolarHBondContact O-N 2.81Å
190	I	66.9	Low	72.2	Confident	14 Å²	14	66.6 Å²	66.6	7%	0.072	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-36.2	-171.7	-68.1	162.4	0	0	0	112	F184 A188 G194 K195 G196 V199	F184-I190 HydrophobicContact CD1-CD1 4.09Å; F184-I190 HydrophobicContact CE1-CD1 3.24Å; F184-I190 HydrophobicContact CZ-CD1 3.54Å; A188-I190 HydrophobicContact CB-CD1 3.5Å; A188-I190 VanDerWaalsContact CB-CD1 3.5Å; A188-I190 HydrophobicContact CB-CG1 3.66Å; A188-I190 PolarHBondContact O-N 3.26Å; A188-I190 VanDerWaalsContact O-N 3.09Å; I190-G194 CarbonylContact O-C 3.56Å; I190-G194 WeakPolarHBondContact O-CA 3.1Å; I190-G194 PolarHBondContact O-N 3.11Å; I190-G194 VanDerWaalsContact O-N 3.11Å; I190-K195 PolarHBondContact O-N 2.92Å; I190-G196 PolarHBondContact O-N 3.2Å; I190-V199 HydrophobicContact CD1-CG2 3.96Å; I190-V199 HydrophobicContact CG1-CB 4.49Å; I190-V199 HydrophobicContact CG1-CG2 4.06Å
191	E	60.1	Low	72.1	Confident	143 Å²	143	61.6 Å²	61.6	67%	0.668	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-41.3	178.7	-67.4	-174.7	157	0	0	112.4	N185	N185-E191 PolarHBondContact ND2-OE2 3.12Å; N185-E191 WeakPolarHBondContact OD1-CB 3.42Å; N185-E191 PolarHBondContact OD1-N 3.2Å; N185-E191 VanDerWaalsContact OD1-N 3.14Å
192	S	64.6	Low	72	Confident	90 Å²	90	62.7 Å²	62.7	63%	0.629	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-42.6	-174.4	56.6	0	0	0	0	113.5	H189	H189-S192 PolarHBondContact O-OG 3.06Å
193	L	62.7	Low	72	Confident	101 Å²	101	58.7 Å²	58.7	53%	0.529	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-29.4	-175.5	-65.7	165.6	0	0	0	112.5	H189 V200	H189-L193 HydrophobicContact CB-CD1 4.17Å; H189-L193 PolarHBondContact O-N 3.31Å; H189-L193 VanDerWaalsContact O-N 3.1Å; L193-V200 HydrophobicContact CB-CG2 3.49Å; L193-V200 VanDerWaalsContact CB-CG2 3.49Å; L193-V200 HydrophobicContact CD1-CB 4.5Å; L193-V200 HydrophobicContact CD1-CG1 4.29Å; L193-V200 HydrophobicContact CD1-CG2 4.22Å
194	G	61.1	Low	72.2	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.031	31%	0.314	C	S	.	.	S	Bend	trans	-87	-5.2	-174.1	0	0	0	0	0	116.8	H189 I190 G196 H197 S198	H189-G194 PolarHBondContact O-N 2.81Å; I190-G194 CarbonylContact O-C 3.56Å; I190-G194 WeakPolarHBondContact O-CA 3.1Å; I190-G194 PolarHBondContact O-N 3.11Å; I190-G194 VanDerWaalsContact O-N 3.11Å; G194-G196 PolarHBondContact O-N 2.92Å; G194-G196 VanDerWaalsContact O-N 3.16Å; G194-H197 PolarHBondContact O-N 3.3Å; G194-H197 VanDerWaalsContact O-N 3.08Å; G194-S198 WeakPolarHBondContact CA-O 3.36Å; G194-S198 PolarHBondContact O-N 3.43Å
195	K	70.9	Confident	72.8	Confident	184 Å²	184	59 Å²	59	80%	0.8	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	31.6	-174.6	-55.9	-179.6	-179.1	178.5	0	113.6	I190 H197	I190-K195 PolarHBondContact O-N 2.92Å; K195-H197 PolarHBondContact O-N 3.45Å; K195-H197 PolarHBondContact O-ND1 3.23Å
196	G	68.8	Low	73.2	Confident	40 Å²	40	61.3 Å²	61.3	41%	0.412	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-6.7	-178.2	0	0	0	0	0	116	I190 G194	I190-G196 PolarHBondContact O-N 3.2Å; G194-G196 PolarHBondContact O-N 2.92Å; G194-G196 VanDerWaalsContact O-N 3.16Å
197	H	74.7	Confident	73.9	Confident	125 Å²	125	57.4 Å²	57.4	58%	0.579	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	-3.8	-168.8	-59.7	83.2	0	0	0	114.1	G194 K195 H247 L248	G194-H197 PolarHBondContact O-N 3.3Å; G194-H197 VanDerWaalsContact O-N 3.08Å; K195-H197 PolarHBondContact O-N 3.45Å; K195-H197 PolarHBondContact O-ND1 3.23Å; H197-H247 PolarHBondContact O-CD2 2.94Å; H197-L248 VanDerWaalsContact O-CD1 3.27Å; H197-L248 WeakPolarHBondContact O-CD1 3.47Å; H197-L248 PolarHBondContact O-N 3.46Å
198	S	78.4	Confident	74.9	Confident	23 Å²	23	60.2 Å²	60.2	16%	0.161	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.8	175.5	-53.6	0	0	0	0	111	G194 V245 V246	G194-S198 WeakPolarHBondContact CA-O 3.36Å; G194-S198 PolarHBondContact O-N 3.43Å; S198-V245 VanDerWaalsContact CB-CG1 3.49Å; S198-V246 CarbonylContact C-O 3.55Å; S198-V246 VanDerWaalsContact CA-O 3.26Å; S198-V246 WeakPolarHBondContact CA-O 3.43Å; S198-V246 WeakPolarHBondContact CB-O 3.41Å
199	V	77.9	Confident	76	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.9	171.2	-176.8	0	0	0	0	108.7	A188 I190 F201 V245 V246 L248 L251	A188-V199 HydrophobicContact CB-CG1 4.17Å; I190-V199 HydrophobicContact CD1-CG2 3.96Å; I190-V199 HydrophobicContact CG1-CB 4.49Å; I190-V199 HydrophobicContact CG1-CG2 4.06Å; V199-F201 HydrophobicContact CB-CE2 3.71Å; V199-F201 HydrophobicContact CB-CZ 3.88Å; V199-F201 HydrophobicContact CG1-CD2 4.3Å; V199-F201 HydrophobicContact CG1-CE1 3.99Å; V199-F201 HydrophobicContact CG1-CE2 3.63Å; V199-F201 HydrophobicContact CG1-CZ 3.45Å; V199-F201 VanDerWaalsContact CG1-CZ 3.45Å; V199-V245 WeakPolarHBondContact O-CA 3.42Å; V199-V246 PolarHBondContact N-O 2.91Å; V199-V246 PolarHBondContact O-N 2.86Å; V199-L248 HydrophobicContact CG2-CD1 3.78Å; V199-L248 HydrophobicContact CG2-CG 4.21Å; V199-L251 HydrophobicContact CG2-CD1 3.97Å
200	V	79.1	Confident	77	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.03	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	126.4	174	-175.5	0	0	0	0	109.8	A188 L193 V245	A188-V200 PolarHBondContact O-N 3.08Å; L193-V200 HydrophobicContact CB-CG2 3.49Å; L193-V200 VanDerWaalsContact CB-CG2 3.49Å; L193-V200 HydrophobicContact CD1-CB 4.5Å; L193-V200 HydrophobicContact CD1-CG1 4.29Å; L193-V200 HydrophobicContact CD1-CG2 4.22Å; V200-V245 HydrophobicContact CG1-CG2 4.49Å; V200-V245 HydrophobicContact CG2-CG1 4.44Å; V200-V245 HydrophobicContact CG2-CG2 4.05Å
201	F	80.4	Confident	77.8	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.1	176	-61.4	-84.6	0	0	0	110.8	V199 W222 M223 I227 L228 T243 K244 V246 L251	V199-F201 HydrophobicContact CB-CE2 3.71Å; V199-F201 HydrophobicContact CB-CZ 3.88Å; V199-F201 HydrophobicContact CG1-CD2 4.3Å; V199-F201 HydrophobicContact CG1-CE1 3.99Å; V199-F201 HydrophobicContact CG1-CE2 3.63Å; V199-F201 HydrophobicContact CG1-CZ 3.45Å; V199-F201 VanDerWaalsContact CG1-CZ 3.45Å; F201-W222 HydrophobicContact CB-CB 4.39Å; F201-W222 HydrophobicContact CB-CD2 4.38Å; F201-W222 HydrophobicContact CB-CE3 3.65Å; F201-W222 HydrophobicContact CB-CZ3 4.37Å; F201-W222 HydrophobicContact CD1-CB 4.34Å; F201-M223 CarbonylContact C-O 3.42Å; F201-M223 WeakPolarHBondContact CA-O 3.35Å; F201-I227 HydrophobicContact CE1-CB 3.75Å; F201-I227 HydrophobicContact CE1-CD1 3.8Å; F201-I227 HydrophobicContact CE1-CG1 4.42Å; F201-I227 HydrophobicContact CE1-CG2 3.77Å; F201-I227 HydrophobicContact CZ-CB 4.1Å; F201-I227 HydrophobicContact CZ-CD1 4.35Å; F201-I227 HydrophobicContact CZ-CG2 3.56Å; F201-L228 HydrophobicContact CB-CD1 4.19Å; F201-L228 HydrophobicContact CD1-CD1 3.94Å; F201-L228 HydrophobicContact CD1-CG 4.28Å; F201-L228 HydrophobicContact CD2-CD1 3.6Å; F201-L228 HydrophobicContact CD2-CG 4.42Å; F201-L228 HydrophobicContact CE1-CD1 4.25Å; F201-L228 HydrophobicContact CE1-CG 4.18Å; F201-L228 HydrophobicContact CE2-CD1 3.93Å; F201-L228 HydrophobicContact CE2-CG 4.31Å; F201-L228 HydrophobicContact CG-CD1 3.6Å; F201-L228 HydrophobicContact CG-CG 4.41Å; F201-L228 HydrophobicContact CZ-CD1 4.24Å; F201-L228 HydrophobicContact CZ-CG 4.19Å; F201-T243 CarbonylContact O-C 3.07Å; F201-T243 VanDerWaalsContact O-CA 3.3Å; F201-T243 WeakPolarHBondContact O-CA 3.34Å; F201-K244 PolarHBondContact N-O 2.91Å; F201-K244 PolarHBondContact O-N 3.36Å; F201-V246 HydrophobicContact CD2-CB 4.37Å; F201-V246 HydrophobicContact CD2-CG2 3.98Å; F201-V246 HydrophobicContact CE2-CB 4.02Å; F201-V246 HydrophobicContact CE2-CG2 4.06Å; F201-L251 HydrophobicContact CE2-CD2 3.94Å; F201-L251 HydrophobicContact CZ-CD2 3.9Å
202	H	79.1	Confident	78.7	Confident	77 Å²	77	72.4 Å²	72.4	36%	0.356	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.1	174.7	-65.8	-92.7	0	0	0	109.1	M223	H202-M223 PolarHBondContact N-O 3.39Å; H202-M223 PolarHBondContact O-N 2.81Å
203	S	82.9	Confident	79.3	Confident	9 Å²	9	72 Å²	72	6%	0.063	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.6	-178.9	61.1	0	0	0	0	113.4	H221 R238 L241 K242	S203-H221 CarbonylContact C-O 3.57Å; S203-H221 VanDerWaalsContact CA-O 3.23Å; S203-H221 WeakPolarHBondContact CA-O 3.49Å; S203-R238 PolarHBondContact O-NH1 3.03Å; S203-R238 PolarHBondContact O-NH2 3.43Å; S203-R238 PolarHBondContact OG-NH1 3.03Å; S203-L241 PolarHBondContact OG-O 3.23Å; S203-K242 PolarHBondContact N-O 3.16Å; S203-K242 WeakPolarHBondContact OG-CA 3.38Å; S203-K242 PolarHBondContact OG-O 2.92Å
204	T	84.6	Confident	80.2	Confident	62 Å²	62	69.4 Å²	69.4	38%	0.38	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	153.7	169.1	54	0	0	0	0	109.6	L220 H221	T204-L220 WeakPolarHBondContact O-CA 3.33Å; T204-H221 PolarHBondContact N-O 3.5Å; T204-H221 PolarHBondContact O-N 3.26Å; T204-H221 PolarHBondContact OG1-O 3.29Å
205	V	86.1	Confident	81.3	Confident	63 Å²	63	75.5 Å²	75.5	38%	0.382	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.1	174.7	178.4	0	0	0	0	107.7	L218 L219 L220 R238	V205-L218 HydrophobicContact CG1-CB 4.13Å; V205-L218 HydrophobicContact CG1-CD2 4.27Å; V205-L218 HydrophobicContact CG2-CD1 4.25Å; V205-L219 WeakPolarHBondContact CA-O 3.19Å; V205-L220 HydrophobicContact CG2-CD2 3.81Å; V205-R238 VanDerWaalsContact CG2-NE 3.27Å
206	I	86.9	Confident	81.9	Confident	93 Å²	93	68.9 Å²	68.9	48%	0.477	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-24.3	-179.3	56.7	161.4	0	0	0	113.2	L219 H221 D230	I206-L219 HydrophobicContact CD1-CD2 3.61Å; I206-L219 HydrophobicContact CD1-CG 3.84Å; I206-L219 HydrophobicContact CG1-CB 4.03Å; I206-L219 HydrophobicContact CG1-CD2 3.88Å; I206-L219 HydrophobicContact CG1-CG 3.75Å; I206-L219 PolarHBondContact N-O 3.23Å; I206-H221 HydrophobicContact CD1-CB 4.02Å; I206-H221 HydrophobicContact CG1-CB 4.1Å; I206-H221 HydrophobicContact CG2-CB 3.65Å; I206-D230 WeakPolarHBondContact CD1-OD2 3.4Å
207	A	86.4	Confident	82.8	Confident	38 Å²	38	69.2 Å²	69.2	31%	0.314	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	156.8	174.9	0	0	0	0	0	112.2	L218 L219 W232	A207-L218 CarbonylContact O-C 3.5Å; A207-L218 WeakPolarHBondContact O-CA 3.36Å; A207-L219 HydrophobicContact CB-CB 3.89Å; A207-L219 HydrophobicContact CB-CD2 4.26Å; A207-L219 PolarHBondContact O-N 3.03Å; A207-W232 HydrophobicContact CB-CH2 3.94Å
208	K	88.5	Confident	83.4	Confident	124 Å²	124	63.9 Å²	63.9	54%	0.539	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.2	173.5	174.1	164.2	172.8	147.9	0	108.6	I216 L218 E235	K208-I216 HydrophobicContact CD-CG2 4.01Å; K208-I216 VanDerWaalsContact CE-CG2 3.4Å; K208-I216 HydrophobicContact CG-CG2 3.9Å; K208-L218 HydrophobicContact CB-CD2 3.78Å; K208-L218 HydrophobicContact CD-CD2 3.74Å; K208-L218 HydrophobicContact CG-CD2 3.69Å; K208-E235 IonicContact NZ-OE1 2.74Å; K208-E235 PolarHBondContact NZ-OE1 3.32Å; K208-E235 IonicContact NZ-OE2 3.49Å
209	R	87.8	Confident	83.8	Confident	98 Å²	98	64 Å²	64	37%	0.37	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.3	173.9	80.3	-175.9	-161.4	-160.3	11.2	110.5	E211 K217 W232	R209-E211 IonicContact CZ-OE1 2.73Å; R209-E211 IonicContact NE-OE1 3.08Å; R209-E211 PolarHBondContact NE-OE1 2.82Å; R209-E211 IonicContact NH2-OE1 2.67Å; R209-E211 PolarHBondContact NH2-OE1 3.05Å; R209-K217 HydrophobicContact CG-CB 4.03Å; R209-K217 PolarHBondContact N-O 3.19Å; R209-K217 PolarHBondContact O-N 3.04Å; R209-W232 HydrophobicContact CB-CH2 3.94Å; R209-W232 HydrophobicContact CB-CZ3 3.81Å; R209-W232 HydrophobicContact CG-CE3 3.9Å; R209-W232 HydrophobicContact CG-CH2 3.95Å; R209-W232 HydrophobicContact CG-CZ3 3.5Å
210	K	88.8	Confident	84.1	Confident	159 Å²	159	64 Å²	64	69%	0.691	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	124	172.6	-174	-178.2	178.3	-173.4	0	107.5	I216	K210-I216 HydrophobicContact CG-CG1 4.36Å
211	E	84.4	Confident	84.3	Confident	49 Å²	49	65.4 Å²	65.4	23%	0.229	34%	0.341	C	S	.	.			trans	-85.7	155.2	173	-73.6	173.4	178	0	0	110	R209 S213 G214 K215 K217	R209-E211 IonicContact CZ-OE1 2.73Å; R209-E211 IonicContact NE-OE1 3.08Å; R209-E211 PolarHBondContact NE-OE1 2.82Å; R209-E211 IonicContact NH2-OE1 2.67Å; R209-E211 PolarHBondContact NH2-OE1 3.05Å; E211-S213 PolarHBondContact O-N 3.39Å; E211-G214 PolarHBondContact O-N 2.76Å; E211-K215 PolarHBondContact N-O 2.75Å; E211-K217 WeakPolarHBondContact OE1-CD 3.49Å; E211-K217 WeakPolarHBondContact OE1-CE 3.22Å; E211-K217 IonicContact OE1-NZ 2.75Å; E211-K217 PolarHBondContact OE1-NZ 3.05Å; E211-K217 WeakPolarHBondContact OE2-CE 3.31Å; E211-K217 IonicContact OE2-NZ 2.77Å; E211-K217 PolarHBondContact OE2-NZ 2.81Å
212	D	79.1	Confident	84.4	Confident	177 Å²	177	65.7 Å²	65.7	95%	0.947	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-22	-175.5	-49.9	-71.2	0	0	0	112.8	G214	D212-G214 PolarHBondContact O-N 2.85Å; D212-G214 VanDerWaalsContact O-N 3.12Å
213	S	77.9	Confident	83.7	Confident	82 Å²	82	65.7 Å²	65.7	57%	0.573	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	8.5	169.8	69.5	0	0	0	0	115	E211 K215	E211-S213 PolarHBondContact O-N 3.39Å; S213-K215 PolarHBondContact O-N 3.29Å
214	G	80.6	Confident	82.9	Confident	46 Å²	46	66.3 Å²	66.3	47%	0.474	35%	0.347	S	S	.	.	S	Bend	trans	77.4	-4.9	-178.6	0	0	0	0	0	115.1	E211 D212	E211-G214 PolarHBondContact O-N 2.76Å; D212-G214 PolarHBondContact O-N 2.85Å; D212-G214 VanDerWaalsContact O-N 3.12Å
215	K	83.1	Confident	81.9	Confident	132 Å²	132	69.4 Å²	69.4	57%	0.574	36%	0.357	S	S	*	.			trans	-78.3	137.3	-178.2	-66.7	176	-176.9	174.2	0	111.7	E211 S213	E211-K215 PolarHBondContact N-O 2.75Å; S213-K215 PolarHBondContact O-N 3.29Å
216	I	84.7	Confident	80.6	Confident	45 Å²	45	71.8 Å²	71.8	23%	0.231	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	128	177.6	-67.6	168.2	0	0	0	109.6	K208 K210 L218 E235	K208-I216 HydrophobicContact CD-CG2 4.01Å; K208-I216 VanDerWaalsContact CE-CG2 3.4Å; K208-I216 HydrophobicContact CG-CG2 3.9Å; K210-I216 HydrophobicContact CG-CG1 4.36Å; I216-L218 HydrophobicContact CG2-CD2 4.2Å; I216-E235 HydrophobicContact CB-CB 4.32Å; I216-E235 VanDerWaalsContact CD1-OE2 3.31Å; I216-E235 WeakPolarHBondContact CD1-OE2 3.5Å; I216-E235 HydrophobicContact CG2-CB 4.13Å; I216-E235 WeakPolarHBondContact CG2-OE2 3.45Å; I216-E235 PolarHBondContact O-N 2.78Å
217	K	87.1	Confident	79.7	Confident	46 Å²	46	67.6 Å²	67.6	20%	0.2	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138.4	172.8	-70.2	174.4	-178	163.2	0	110.3	R209 E211 W232 V233	R209-K217 HydrophobicContact CG-CB 4.03Å; R209-K217 PolarHBondContact N-O 3.19Å; R209-K217 PolarHBondContact O-N 3.04Å; E211-K217 WeakPolarHBondContact OE1-CD 3.49Å; E211-K217 WeakPolarHBondContact OE1-CE 3.22Å; E211-K217 IonicContact OE1-NZ 2.75Å; E211-K217 PolarHBondContact OE1-NZ 3.05Å; E211-K217 WeakPolarHBondContact OE2-CE 3.31Å; E211-K217 IonicContact OE2-NZ 2.77Å; E211-K217 PolarHBondContact OE2-NZ 2.81Å; K217-W232 HydrophobicContact CB-CE3 3.94Å; K217-V233 CarbonylContact C-O 3.55Å; K217-V233 WeakPolarHBondContact CA-O 3.42Å
218	L	86.8	Confident	79.1	Confident	13 Å²	13	66.8 Å²	66.8	7%	0.068	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.5	178.1	-55	179.8	0	0	0	108.3	V205 A207 K208 I216 W232 V233 E235 R238	V205-L218 HydrophobicContact CG1-CB 4.13Å; V205-L218 HydrophobicContact CG1-CD2 4.27Å; V205-L218 HydrophobicContact CG2-CD1 4.25Å; A207-L218 CarbonylContact O-C 3.5Å; A207-L218 WeakPolarHBondContact O-CA 3.36Å; K208-L218 HydrophobicContact CB-CD2 3.78Å; K208-L218 HydrophobicContact CD-CD2 3.74Å; K208-L218 HydrophobicContact CG-CD2 3.69Å; I216-L218 HydrophobicContact CG2-CD2 4.2Å; L218-W232 WeakPolarHBondContact O-CA 3.48Å; L218-V233 PolarHBondContact N-O 3.41Å; L218-V233 PolarHBondContact O-N 3.01Å; L218-E235 HydrophobicContact CD1-CG 4.39Å; L218-R238 HydrophobicContact CD1-CB 4.11Å; L218-R238 HydrophobicContact CD1-CG 4.01Å
219	L	87	Confident	78.6	Confident	25 Å²	25	65.6 Å²	65.6	13%	0.131	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	115.9	170.5	-172.9	57.3	0	0	0	108.2	V205 I206 A207 D230 W232	V205-L219 WeakPolarHBondContact CA-O 3.19Å; I206-L219 HydrophobicContact CD1-CD2 3.61Å; I206-L219 HydrophobicContact CD1-CG 3.84Å; I206-L219 HydrophobicContact CG1-CB 4.03Å; I206-L219 HydrophobicContact CG1-CD2 3.88Å; I206-L219 HydrophobicContact CG1-CG 3.75Å; I206-L219 PolarHBondContact N-O 3.23Å; A207-L219 HydrophobicContact CB-CB 3.89Å; A207-L219 HydrophobicContact CB-CD2 4.26Å; A207-L219 PolarHBondContact O-N 3.03Å; L219-D230 HydrophobicContact CD1-CB 3.67Å; L219-D230 HydrophobicContact CD2-CB 4.5Å; L219-D230 HydrophobicContact CG-CB 4.1Å; L219-W232 HydrophobicContact CB-CD2 4.05Å; L219-W232 HydrophobicContact CB-CE3 3.89Å; L219-W232 HydrophobicContact CB-CH2 3.87Å; L219-W232 HydrophobicContact CB-CZ2 4.01Å; L219-W232 HydrophobicContact CB-CZ3 3.79Å; L219-W232 HydrophobicContact CD1-CD2 3.97Å; L219-W232 HydrophobicContact CD1-CG 4.03Å; L219-W232 HydrophobicContact CD1-CZ2 4.41Å; L219-W232 HydrophobicContact CD2-CH2 4.49Å; L219-W232 HydrophobicContact CD2-CZ2 4.01Å; L219-W232 HydrophobicContact CG-CZ2 4.38Å
220	L	84.8	Confident	78.4	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.4	176	-61.3	-170.6	0	0	0	110.1	T204 V205 D230 V231 V233 L241	T204-L220 WeakPolarHBondContact O-CA 3.33Å; V205-L220 HydrophobicContact CG2-CD2 3.81Å; L220-D230 VanDerWaalsContact O-CA 3.27Å; L220-D230 WeakPolarHBondContact O-CA 3.39Å; L220-V231 PolarHBondContact N-O 3.47Å; L220-V231 PolarHBondContact O-N 3.04Å; L220-V233 HydrophobicContact CD1-CB 3.96Å; L220-V233 HydrophobicContact CD1-CG1 4.2Å; L220-V233 HydrophobicContact CD1-CG2 3.69Å; L220-V233 HydrophobicContact CG-CB 4.13Å; L220-V233 HydrophobicContact CG-CG2 4.04Å; L220-L241 HydrophobicContact CD1-CB 4.02Å
221	H	83.8	Confident	78.2	Confident	36 Å²	36	59.7 Å²	59.7	17%	0.167	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	148.8	165.9	-178.6	69	0	0	0	109.5	S203 T204 I206 D230	S203-H221 CarbonylContact C-O 3.57Å; S203-H221 VanDerWaalsContact CA-O 3.23Å; S203-H221 WeakPolarHBondContact CA-O 3.49Å; T204-H221 PolarHBondContact N-O 3.5Å; T204-H221 PolarHBondContact O-N 3.26Å; T204-H221 PolarHBondContact OG1-O 3.29Å; I206-H221 HydrophobicContact CD1-CB 4.02Å; I206-H221 HydrophobicContact CG1-CB 4.1Å; I206-H221 HydrophobicContact CG2-CB 3.65Å; H221-D230 WeakPolarHBondContact CA-OD1 3.26Å; H221-D230 IonicContact CE1-OD1 3.56Å; H221-D230 IonicContact CG-OD1 2.63Å; H221-D230 IonicContact ND1-OD1 3.74Å; H221-D230 PolarHBondContact ND1-OD1 2.99Å; H221-D230 IonicContact ND1-OD2 2.6Å
222	W	82.3	Confident	78.3	Confident	5 Å²	5	62.1 Å²	62.1	2%	0.019	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	126	-174.3	-60.3	96.5	0	0	0	111.4	F201 P224 L228 L241 K244	F201-W222 HydrophobicContact CB-CB 4.39Å; F201-W222 HydrophobicContact CB-CD2 4.38Å; F201-W222 HydrophobicContact CB-CE3 3.65Å; F201-W222 HydrophobicContact CB-CZ3 4.37Å; F201-W222 HydrophobicContact CD1-CB 4.34Å; W222-P224 CarbonylContact O-C 3.53Å; W222-L228 HydrophobicContact CB-CB 4.06Å; W222-L228 HydrophobicContact CB-CD1 4.46Å; W222-L228 HydrophobicContact CD2-CD1 4.23Å; W222-L228 HydrophobicContact CG-CB 3.93Å; W222-L228 HydrophobicContact CG-CD1 4.12Å; W222-L241 HydrophobicContact CH2-CB 4.36Å; W222-L241 HydrophobicContact CH2-CD2 4.35Å; W222-K244 HydrophobicContact CE3-CB 4.23Å; W222-K244 HydrophobicContact CH2-CB 3.76Å; W222-K244 HydrophobicContact CH2-CD 3.7Å; W222-K244 HydrophobicContact CH2-CG 4.36Å; W222-K244 HydrophobicContact CZ2-CD 4.03Å; W222-K244 HydrophobicContact CZ3-CB 3.41Å; W222-K244 VanDerWaalsContact CZ3-CB 3.41Å; W222-K244 HydrophobicContact CZ3-CD 4.01Å; W222-K244 HydrophobicContact CZ3-CG 4.37Å
223	M	64.1	Low	78.6	Confident	77 Å²	77	54 Å²	54	38%	0.379	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.9	167.5	-64.2	-60.8	-69.2	0	0	109.7	F201 H202 E225	F201-M223 CarbonylContact C-O 3.42Å; F201-M223 WeakPolarHBondContact CA-O 3.35Å; H202-M223 PolarHBondContact N-O 3.39Å; H202-M223 PolarHBondContact O-N 2.81Å; M223-E225 HydrophobicContact CE-CG 3.98Å; M223-E225 HydrophobicContact SD-CG 3.68Å
224	P	66.3	Low	78.9	Confident	22 Å²	22	52.5 Å²	52.5	14%	0.143	28%	0.277	C	S	.	.	S	Bend	cis	-68.6	151.7	1.3	-16.4	31	0	0	0	113.5	S187 W222 I227	S187-P224 WeakPolarHBondContact O-CG 3.34Å; W222-P224 CarbonylContact O-C 3.53Å; P224-I227 HydrophobicContact CB-CD1 3.85Å; P224-I227 HydrophobicContact CG-CD1 4.37Å
225	E	63	Low	78.9	Confident	127 Å²	127	54 Å²	54	59%	0.593	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	157.9	-171.6	-67.8	175.5	139.3	0	0	113.7	M223 I227	M223-E225 HydrophobicContact CE-CG 3.98Å; M223-E225 HydrophobicContact SD-CG 3.68Å; E225-I227 WeakPolarHBondContact O-CG1 3.4Å; E225-I227 PolarHBondContact O-N 3.4Å
226	D	60.1	Low	78.6	Confident	114 Å²	114	52.5 Å²	52.5	61%	0.61	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-2.1	170.8	-60.7	-30.3	0	0	0	119	T255 L258	D226-T255 WeakPolarHBondContact O-CB 3.41Å; D226-T255 VanDerWaalsContact O-CG2 3.28Å; D226-T255 WeakPolarHBondContact O-CG2 3.12Å; D226-L258 HydrophobicContact CB-CD1 3.91Å
227	I	67.9	Low	78.2	Confident	5 Å²	5	54 Å²	54	3%	0.026	28%	0.283	C	S	.	.	S	Bend	trans	-84.2	-36.1	-178.2	-58.8	145.2	0	0	0	112.7	F201 P224 E225 L251 T255 L259	F201-I227 HydrophobicContact CE1-CB 3.75Å; F201-I227 HydrophobicContact CE1-CD1 3.8Å; F201-I227 HydrophobicContact CE1-CG1 4.42Å; F201-I227 HydrophobicContact CE1-CG2 3.77Å; F201-I227 HydrophobicContact CZ-CB 4.1Å; F201-I227 HydrophobicContact CZ-CD1 4.35Å; F201-I227 HydrophobicContact CZ-CG2 3.56Å; P224-I227 HydrophobicContact CB-CD1 3.85Å; P224-I227 HydrophobicContact CG-CD1 4.37Å; E225-I227 WeakPolarHBondContact O-CG1 3.4Å; E225-I227 PolarHBondContact O-N 3.4Å; I227-L251 HydrophobicContact CG2-CD1 4.4Å; I227-L251 HydrophobicContact CG2-CD2 3.95Å; I227-T255 PolarHBondContact O-OG1 2.63Å; I227-L259 HydrophobicContact CD1-CD2 3.4Å; I227-L259 HydrophobicContact CD1-CG 4.4Å; I227-L259 HydrophobicContact CG1-CD2 3.81Å; I227-L259 HydrophobicContact CG1-CG 4.31Å
228	L	72.9	Confident	77.6	Confident	20 Å²	20	54 Å²	54	11%	0.105	28%	0.282	C	S	.	.	S	Bend	trans	-122.6	135.1	179	-69.2	-179.3	0	0	0	110.4	F201 W222 K244 V246	F201-L228 HydrophobicContact CB-CD1 4.19Å; F201-L228 HydrophobicContact CD1-CD1 3.94Å; F201-L228 HydrophobicContact CD1-CG 4.28Å; F201-L228 HydrophobicContact CD2-CD1 3.6Å; F201-L228 HydrophobicContact CD2-CG 4.42Å; F201-L228 HydrophobicContact CE1-CD1 4.25Å; F201-L228 HydrophobicContact CE1-CG 4.18Å; F201-L228 HydrophobicContact CE2-CD1 3.93Å; F201-L228 HydrophobicContact CE2-CG 4.31Å; F201-L228 HydrophobicContact CG-CD1 3.6Å; F201-L228 HydrophobicContact CG-CG 4.41Å; F201-L228 HydrophobicContact CZ-CD1 4.24Å; F201-L228 HydrophobicContact CZ-CG 4.19Å; W222-L228 HydrophobicContact CB-CB 4.06Å; W222-L228 HydrophobicContact CB-CD1 4.46Å; W222-L228 HydrophobicContact CD2-CD1 4.23Å; W222-L228 HydrophobicContact CG-CB 3.93Å; W222-L228 HydrophobicContact CG-CD1 4.12Å; L228-K244 HydrophobicContact CD1-CD 4.35Å; L228-V246 HydrophobicContact CD1-CG2 4.43Å
229	P	77.4	Confident	77	Confident	99 Å²	99	60.1 Å²	60.1	64%	0.643	31%	0.31	S	S	*	.			trans	-68.1	153.6	178	30	-36	0	0	0	111.8	V231	P229-V231 WeakPolarHBondContact O-CG2 3.47Å
230	D	84.4	Confident	76.6	Confident	72 Å²	72	66.6 Å²	66.6	39%	0.385	34%	0.34	S	S	.	.			trans	-64.9	136.6	176	-62	-18.6	0	0	0	111.4	I206 L219 L220 H221	I206-D230 WeakPolarHBondContact CD1-OD2 3.4Å; L219-D230 HydrophobicContact CD1-CB 3.67Å; L219-D230 HydrophobicContact CD2-CB 4.5Å; L219-D230 HydrophobicContact CG-CB 4.1Å; L220-D230 VanDerWaalsContact O-CA 3.27Å; L220-D230 WeakPolarHBondContact O-CA 3.39Å; H221-D230 WeakPolarHBondContact CA-OD1 3.26Å; H221-D230 IonicContact CE1-OD1 3.56Å; H221-D230 IonicContact CG-OD1 2.63Å; H221-D230 IonicContact ND1-OD1 3.74Å; H221-D230 PolarHBondContact ND1-OD1 2.99Å; H221-D230 IonicContact ND1-OD2 2.6Å
231	V	85	Confident	76.2	Confident	62 Å²	62	69.1 Å²	69.1	38%	0.376	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130	-175.4	-176.1	0	0	0	0	111.5	L220 P229 V233	L220-V231 PolarHBondContact N-O 3.47Å; L220-V231 PolarHBondContact O-N 3.04Å; P229-V231 WeakPolarHBondContact O-CG2 3.47Å; V231-V233 HydrophobicContact CB-CG2 4.32Å; V231-V233 HydrophobicContact CG1-CG2 3.87Å; V231-V233 PolarHBondContact O-N 3.5Å
232	W	85.6	Confident	75.8	Confident	100 Å²	100	72.5 Å²	72.5	38%	0.379	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	117.5	168.3	-71.6	98.9	0	0	0	110.7	A207 R209 K217 L218 L219	A207-W232 HydrophobicContact CB-CH2 3.94Å; R209-W232 HydrophobicContact CB-CH2 3.94Å; R209-W232 HydrophobicContact CB-CZ3 3.81Å; R209-W232 HydrophobicContact CG-CE3 3.9Å; R209-W232 HydrophobicContact CG-CH2 3.95Å; R209-W232 HydrophobicContact CG-CZ3 3.5Å; K217-W232 HydrophobicContact CB-CE3 3.94Å; L218-W232 WeakPolarHBondContact O-CA 3.48Å; L219-W232 HydrophobicContact CB-CD2 4.05Å; L219-W232 HydrophobicContact CB-CE3 3.89Å; L219-W232 HydrophobicContact CB-CH2 3.87Å; L219-W232 HydrophobicContact CB-CZ2 4.01Å; L219-W232 HydrophobicContact CB-CZ3 3.79Å; L219-W232 HydrophobicContact CD1-CD2 3.97Å; L219-W232 HydrophobicContact CD1-CG 4.03Å; L219-W232 HydrophobicContact CD1-CZ2 4.41Å; L219-W232 HydrophobicContact CD2-CH2 4.49Å; L219-W232 HydrophobicContact CD2-CZ2 4.01Å; L219-W232 HydrophobicContact CG-CZ2 4.38Å
233	V	86.3	Confident	75.7	Confident	7 Å²	7	76 Å²	76	4%	0.042	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.7	-174.4	172.7	0	0	0	0	109.9	K217 L218 L220 V231 E237 L241	K217-V233 CarbonylContact C-O 3.55Å; K217-V233 WeakPolarHBondContact CA-O 3.42Å; L218-V233 PolarHBondContact N-O 3.41Å; L218-V233 PolarHBondContact O-N 3.01Å; L220-V233 HydrophobicContact CD1-CB 3.96Å; L220-V233 HydrophobicContact CD1-CG1 4.2Å; L220-V233 HydrophobicContact CD1-CG2 3.69Å; L220-V233 HydrophobicContact CG-CB 4.13Å; L220-V233 HydrophobicContact CG-CG2 4.04Å; V231-V233 HydrophobicContact CB-CG2 4.32Å; V231-V233 HydrophobicContact CG1-CG2 3.87Å; V231-V233 PolarHBondContact O-N 3.5Å; V233-E237 HydrophobicContact CG1-CB 3.55Å; V233-L241 HydrophobicContact CG1-CD1 3.68Å; V233-L241 HydrophobicContact CG2-CD1 3.94Å
234	N	83	Confident	76.5	Confident	50 Å²	50	76 Å²	76	27%	0.267	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	146.8	177.8	-60.3	-50.6	0	0	0	111	S236 E237 R238	N234-S236 PolarHBondContact O-N 3.39Å; N234-S236 VanDerWaalsContact O-N 3.09Å; N234-E237 HydrophobicContact CB-CG 4.5Å; N234-E237 PolarHBondContact ND2-OE1 3.39Å; N234-E237 PolarHBondContact O-N 2.87Å; N234-R238 PolarHBondContact O-N 3.44Å
235	E	80.9	Confident	77.2	Confident	77 Å²	77	79.2 Å²	79.2	36%	0.36	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-31.1	-179.7	-169.6	155	-122.6	0	0	113.1	K208 I216 L218 R238	K208-E235 IonicContact NZ-OE1 2.74Å; K208-E235 PolarHBondContact NZ-OE1 3.32Å; K208-E235 IonicContact NZ-OE2 3.49Å; I216-E235 HydrophobicContact CB-CB 4.32Å; I216-E235 VanDerWaalsContact CD1-OE2 3.31Å; I216-E235 WeakPolarHBondContact CD1-OE2 3.5Å; I216-E235 HydrophobicContact CG2-CB 4.13Å; I216-E235 WeakPolarHBondContact CG2-OE2 3.45Å; I216-E235 PolarHBondContact O-N 2.78Å; L218-E235 HydrophobicContact CD1-CG 4.39Å; E235-R238 VanDerWaalsContact O-CB 3.28Å; E235-R238 WeakPolarHBondContact O-CB 3.23Å; E235-R238 PolarHBondContact O-N 3.4Å
236	S	77.6	Confident	78.1	Confident	101 Å²	101	74.1 Å²	74.1	71%	0.706	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.8	173.5	-22.8	0	0	0	0	113.7	N234 R238	N234-S236 PolarHBondContact O-N 3.39Å; N234-S236 VanDerWaalsContact O-N 3.09Å; S236-R238 VanDerWaalsContact C-N 3.33Å
237	E	76.4	Confident	79	Confident	75 Å²	75	72.5 Å²	72.5	35%	0.35	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-82.7	-13.1	-174.5	-71.4	154.6	-143.1	0	0	112.3	V233 N234 H239 Q240 L241	V233-E237 HydrophobicContact CG1-CB 3.55Å; N234-E237 HydrophobicContact CB-CG 4.5Å; N234-E237 PolarHBondContact ND2-OE1 3.39Å; N234-E237 PolarHBondContact O-N 2.87Å; E237-H239 PolarHBondContact O-N 3Å; E237-Q240 PolarHBondContact O-N 2.6Å; E237-L241 HydrophobicContact CB-CD1 4.42Å; E237-L241 PolarHBondContact O-N 2.82Å
238	R	74.6	Confident	79.4	Confident	48 Å²	48	75.9 Å²	75.9	18%	0.181	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-50.3	-36.2	-179.3	178.6	60.6	-169.2	128.6	-13.1	113.3	S203 V205 L218 N234 E235 S236 K242	S203-R238 PolarHBondContact O-NH1 3.03Å; S203-R238 PolarHBondContact O-NH2 3.43Å; S203-R238 PolarHBondContact OG-NH1 3.03Å; V205-R238 VanDerWaalsContact CG2-NE 3.27Å; L218-R238 HydrophobicContact CD1-CB 4.11Å; L218-R238 HydrophobicContact CD1-CG 4.01Å; N234-R238 PolarHBondContact O-N 3.44Å; E235-R238 VanDerWaalsContact O-CB 3.28Å; E235-R238 WeakPolarHBondContact O-CB 3.23Å; E235-R238 PolarHBondContact O-N 3.4Å; S236-R238 VanDerWaalsContact C-N 3.33Å; R238-K242 WeakPolarHBondContact O-CG 3.46Å
239	H	74.2	Confident	79.5	Confident	140 Å²	140	79.5 Å²	79.5	65%	0.648	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-70.8	-34.3	-178.3	-76.9	88.1	0	0	0	113.4	E237	E237-H239 PolarHBondContact O-N 3Å
240	Q	77.8	Confident	79.6	Confident	162 Å²	162	82.8 Å²	82.8	76%	0.757	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-32.5	-178.4	-60.8	179.7	13.8	0	0	111.6	E237	E237-Q240 PolarHBondContact O-N 2.6Å
241	L	76.6	Confident	79.2	Confident	53 Å²	53	80 Å²	80	28%	0.277	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	11.6	-175.8	-71.1	168.3	0	0	0	114.5	S203 L220 W222 V233 E237 T243	S203-L241 PolarHBondContact OG-O 3.23Å; L220-L241 HydrophobicContact CD1-CB 4.02Å; W222-L241 HydrophobicContact CH2-CB 4.36Å; W222-L241 HydrophobicContact CH2-CD2 4.35Å; V233-L241 HydrophobicContact CG1-CD1 3.68Å; V233-L241 HydrophobicContact CG2-CD1 3.94Å; E237-L241 HydrophobicContact CB-CD1 4.42Å; E237-L241 PolarHBondContact O-N 2.82Å; L241-T243 PolarHBondContact O-N 2.84Å
242	K	75.5	Confident	78.8	Confident	106 Å²	106	79.6 Å²	79.6	46%	0.461	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-37.7	176.1	-70.2	-173.3	177.6	177.9	0	112.7	S203 R238	S203-K242 PolarHBondContact N-O 3.16Å; S203-K242 WeakPolarHBondContact OG-CA 3.38Å; S203-K242 PolarHBondContact OG-O 2.92Å; R238-K242 WeakPolarHBondContact O-CG 3.46Å
243	T	79.6	Confident	78.1	Confident	79 Å²	79	83.3 Å²	83.3	49%	0.485	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.8	173.1	50.6	0	0	0	0	109.7	F201 L241	F201-T243 CarbonylContact O-C 3.07Å; F201-T243 VanDerWaalsContact O-CA 3.3Å; F201-T243 WeakPolarHBondContact O-CA 3.34Å; L241-T243 PolarHBondContact O-N 2.84Å
244	K	81.4	Confident	77.3	Confident	78 Å²	78	89.5 Å²	89.5	34%	0.339	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	119.6	179.3	-176.2	-176.8	178.1	-175.6	0	109.5	F201 W222 L228 V246	F201-K244 PolarHBondContact N-O 2.91Å; F201-K244 PolarHBondContact O-N 3.36Å; W222-K244 HydrophobicContact CE3-CB 4.23Å; W222-K244 HydrophobicContact CH2-CB 3.76Å; W222-K244 HydrophobicContact CH2-CD 3.7Å; W222-K244 HydrophobicContact CH2-CG 4.36Å; W222-K244 HydrophobicContact CZ2-CD 4.03Å; W222-K244 HydrophobicContact CZ3-CB 3.41Å; W222-K244 VanDerWaalsContact CZ3-CB 3.41Å; W222-K244 HydrophobicContact CZ3-CD 4.01Å; W222-K244 HydrophobicContact CZ3-CG 4.37Å; L228-K244 HydrophobicContact CD1-CD 4.35Å; K244-V246 HydrophobicContact CD-CG2 4.17Å; K244-V246 HydrophobicContact CG-CG2 3.95Å
245	V	82	Confident	76.6	Confident	89 Å²	89	88.8 Å²	88.8	54%	0.539	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124	177.1	-174	0	0	0	0	108.7	S198 V199 V200	S198-V245 VanDerWaalsContact CB-CG1 3.49Å; V199-V245 WeakPolarHBondContact O-CA 3.42Å; V200-V245 HydrophobicContact CG1-CG2 4.49Å; V200-V245 HydrophobicContact CG2-CG1 4.44Å; V200-V245 HydrophobicContact CG2-CG2 4.05Å
246	V	80.9	Confident	76	Confident	19 Å²	19	86.2 Å²	86.2	12%	0.115	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.8	-179.1	-172.5	0	0	0	0	109.9	S198 V199 F201 L228 K244 K250 L251	S198-V246 CarbonylContact C-O 3.55Å; S198-V246 VanDerWaalsContact CA-O 3.26Å; S198-V246 WeakPolarHBondContact CA-O 3.43Å; S198-V246 WeakPolarHBondContact CB-O 3.41Å; V199-V246 PolarHBondContact N-O 2.91Å; V199-V246 PolarHBondContact O-N 2.86Å; F201-V246 HydrophobicContact CD2-CB 4.37Å; F201-V246 HydrophobicContact CD2-CG2 3.98Å; F201-V246 HydrophobicContact CE2-CB 4.02Å; F201-V246 HydrophobicContact CE2-CG2 4.06Å; L228-V246 HydrophobicContact CD1-CG2 4.43Å; K244-V246 HydrophobicContact CD-CG2 4.17Å; K244-V246 HydrophobicContact CG-CG2 3.95Å; V246-K250 HydrophobicContact CG1-CB 4.07Å; V246-L251 HydrophobicContact CB-CD2 4.15Å; V246-L251 HydrophobicContact CG1-CD2 3.82Å
247	H	79.1	Confident	75.5	Confident	81 Å²	81	85.2 Å²	85.2	38%	0.375	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	139.1	176.3	-170.7	-98.3	0	0	0	111	H197 S249 K250	H197-H247 PolarHBondContact O-CD2 2.94Å; H247-S249 PolarHBondContact CE1-OG 3.48Å; H247-S249 PolarHBondContact ND1-N 2.85Å; H247-S249 PolarHBondContact ND1-OG 2.83Å; H247-S249 PolarHBondContact O-N 3.11Å; H247-S249 VanDerWaalsContact O-N 3.1Å; H247-K250 PolarHBondContact O-N 3.45Å
248	L	75.8	Confident	75.2	Confident	75 Å²	75	87.1 Å²	87.1	39%	0.393	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-53.8	-38.3	-174.2	-90.7	77.8	0	0	0	112.9	H197 V199 K250 L251	H197-L248 VanDerWaalsContact O-CD1 3.27Å; H197-L248 WeakPolarHBondContact O-CD1 3.47Å; H197-L248 PolarHBondContact O-N 3.46Å; V199-L248 HydrophobicContact CG2-CD1 3.78Å; V199-L248 HydrophobicContact CG2-CG 4.21Å; L248-K250 PolarHBondContact O-N 2.78Å; L248-K250 VanDerWaalsContact O-N 3.15Å; L248-L251 HydrophobicContact CG-CD1 4.49Å; L248-L251 PolarHBondContact O-N 2.93Å
249	S	76.2	Confident	74.8	Confident	97 Å²	97	86.3 Å²	86.3	68%	0.678	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-69.1	-7.4	178.9	72.8	0	0	0	0	115.6	H247	H247-S249 PolarHBondContact CE1-OG 3.48Å; H247-S249 PolarHBondContact ND1-N 2.85Å; H247-S249 PolarHBondContact ND1-OG 2.83Å; H247-S249 PolarHBondContact O-N 3.11Å; H247-S249 VanDerWaalsContact O-N 3.1Å
250	K	79.6	Confident	74.4	Confident	167 Å²	167	81.3 Å²	81.3	73%	0.726	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-105.3	1.7	177.2	-62.8	-170.8	178.5	-175.8	0	113	V246 H247 L248	V246-K250 HydrophobicContact CG1-CB 4.07Å; H247-K250 PolarHBondContact O-N 3.45Å; L248-K250 PolarHBondContact O-N 2.78Å; L248-K250 VanDerWaalsContact O-N 3.15Å
251	L	75.6	Confident	73.9	Confident	13 Å²	13	78 Å²	78	7%	0.068	41%	0.414	C	S	.	.	S	Bend	trans	-74.1	148.5	173.3	-62.2	176.5	0	0	0	110.3	V199 F201 I227 V246 L248 K253 L259	V199-L251 HydrophobicContact CG2-CD1 3.97Å; F201-L251 HydrophobicContact CE2-CD2 3.94Å; F201-L251 HydrophobicContact CZ-CD2 3.9Å; I227-L251 HydrophobicContact CG2-CD1 4.4Å; I227-L251 HydrophobicContact CG2-CD2 3.95Å; V246-L251 HydrophobicContact CB-CD2 4.15Å; V246-L251 HydrophobicContact CG1-CD2 3.82Å; L248-L251 HydrophobicContact CG-CD1 4.49Å; L248-L251 PolarHBondContact O-N 2.93Å; L251-K253 PolarHBondContact O-N 3.4Å; L251-L259 HydrophobicContact CD1-CD1 4.08Å
252	P	77.3	Confident	73.4	Confident	54 Å²	54	78.3 Å²	78.3	35%	0.351	42%	0.416	S	S	.	.			trans	-59.1	131.3	171.3	-16.8	29.8	0	0	0	109.5	D254 T255 A256	P252-D254 PolarHBondContact O-N 2.89Å; P252-T255 WeakPolarHBondContact CB-OG1 3.43Å; P252-T255 PolarHBondContact O-N 2.97Å; P252-T255 PolarHBondContact O-OG1 3.4Å; P252-A256 VanDerWaalsContact O-CB 3.28Å; P252-A256 WeakPolarHBondContact O-CB 3.42Å; P252-A256 PolarHBondContact O-N 2.96Å
253	K	70.4	Confident	73	Confident	179 Å²	179	77.6 Å²	77.6	78%	0.778	42%	0.416	S	S	*	.	H	α-helix	trans	-63.4	-34.2	-174.1	-68.4	-177.5	178.8	179.3	0	112.5	L251	L251-K253 PolarHBondContact O-N 3.4Å
254	D	68.6	Low	72	Confident	137 Å²	137	81.1 Å²	81.1	73%	0.733	42%	0.422	S	S	*	.	H	α-helix	trans	-72.3	-41.9	-175.5	-45.3	-39.1	0	0	0	111	P252	P252-D254 PolarHBondContact O-N 2.89Å
255	T	68.8	Low	70.8	Confident	35 Å²	35	85 Å²	85	22%	0.215	43%	0.434	C	S	.	.	H	α-helix	trans	-79.9	-23.1	175.9	63.9	0	0	0	0	112.9	D226 I227 P252 L257 L258	D226-T255 WeakPolarHBondContact O-CB 3.41Å; D226-T255 VanDerWaalsContact O-CG2 3.28Å; D226-T255 WeakPolarHBondContact O-CG2 3.12Å; I227-T255 PolarHBondContact O-OG1 2.63Å; P252-T255 WeakPolarHBondContact CB-OG1 3.43Å; P252-T255 PolarHBondContact O-N 2.97Å; P252-T255 PolarHBondContact O-OG1 3.4Å; T255-L257 PolarHBondContact O-N 3.03Å; T255-L258 WeakPolarHBondContact O-CB 3.37Å; T255-L258 PolarHBondContact O-N 3.24Å
256	A	68.4	Low	69.3	Low	23 Å²	23	87.4 Å²	87.4	19%	0.19	44%	0.443	C	S	.	.	H	α-helix	trans	-62.7	-20.4	173.2	0	0	0	0	0	113.4	P252 L258 L259 I263	P252-A256 VanDerWaalsContact O-CB 3.28Å; P252-A256 WeakPolarHBondContact O-CB 3.42Å; P252-A256 PolarHBondContact O-N 2.96Å; A256-L258 VanDerWaalsContact C-N 3.31Å; A256-L259 HydrophobicContact CB-CD1 4.24Å; A256-L259 WeakPolarHBondContact O-CB 3.21Å; A256-I263 WeakPolarHBondContact O-CD1 3.48Å
257	L	67.8	Low	67.6	Low	79 Å²	79	95.8 Å²	95.8	41%	0.414	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-20.1	173	-61	-177.7	0	0	0	113.2	T255 L259 I263	T255-L257 PolarHBondContact O-N 3.03Å; L257-L259 VanDerWaalsContact C-N 3.27Å; L257-L259 PolarHBondContact O-N 3.4Å; L257-I263 HydrophobicContact CD2-CG2 3.85Å
258	L	68.5	Low	65.6	Low	116 Å²	116	102.6 Å²	102.6	61%	0.607	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.5	176.7	-54.9	175.6	0	0	0	112.5	D226 T255 A256	D226-L258 HydrophobicContact CB-CD1 3.91Å; T255-L258 WeakPolarHBondContact O-CB 3.37Å; T255-L258 PolarHBondContact O-N 3.24Å; A256-L258 VanDerWaalsContact C-N 3.31Å
259	L	67.3	Low	65.1	Low	31 Å²	31	104 Å²	104	16%	0.162	53%	0.527	C	S	.	.	S	Bend	trans	-64.4	-39	-179.4	-72.6	166.6	0	0	0	113	F184 I227 L251 A256 L257 I263	F184-L259 HydrophobicContact CE2-CB 3.86Å; F184-L259 HydrophobicContact CE2-CD2 3.8Å; F184-L259 HydrophobicContact CE2-CG 4.39Å; F184-L259 HydrophobicContact CZ-CB 4.29Å; F184-L259 HydrophobicContact CZ-CD2 4.19Å; I227-L259 HydrophobicContact CD1-CD2 3.4Å; I227-L259 HydrophobicContact CD1-CG 4.4Å; I227-L259 HydrophobicContact CG1-CD2 3.81Å; I227-L259 HydrophobicContact CG1-CG 4.31Å; L251-L259 HydrophobicContact CD1-CD1 4.08Å; A256-L259 HydrophobicContact CB-CD1 4.24Å; A256-L259 WeakPolarHBondContact O-CB 3.21Å; L257-L259 VanDerWaalsContact C-N 3.27Å; L257-L259 PolarHBondContact O-N 3.4Å; L259-I263 HydrophobicContact CB-CD1 3.71Å
260	D	66.3	Low	64.5	Low	35 Å²	35	104.3 Å²	104.3	19%	0.187	52%	0.519	C	S	.	.			trans	-158.2	128	172.8	180	-48.3	0	0	0	109.6	N262 I263	D260-N262 PolarHBondContact O-N 3.27Å; D260-N262 WeakPolarHBondContact OD1-CA 3.39Å; D260-N262 VanDerWaalsContact OD1-CB 3.24Å; D260-N262 WeakPolarHBondContact OD1-CB 3.37Å; D260-N262 PolarHBondContact OD1-N 3.31Å; D260-N262 PolarHBondContact OD1-ND2 3.49Å; D260-I263 HydrophobicContact CB-CD1 3.96Å; D260-I263 HydrophobicContact CB-CG1 4.02Å; D260-I263 WeakPolarHBondContact O-CB 3.48Å; D260-I263 WeakPolarHBondContact O-CG1 3.38Å; D260-I263 PolarHBondContact O-N 2.94Å
261	P	65.9	Low	63.7	Low	93 Å²	93	100.8 Å²	100.8	60%	0.604	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	10.3	-177.9	31.3	-38.1	0	0	0	115	R265	P261-R265 WeakPolarHBondContact O-CG 3.36Å; P261-R265 PolarHBondContact O-NE 3.29Å
262	N	66.1	Low	63	Low	59 Å²	59	106 Å²	106	32%	0.316	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-1.6	172.4	-44.8	-79.1	0	0	0	112.3	R180 D260 Y264 R265	R180-N262 VanDerWaalsContact NH1-CG 3.34Å; R180-N262 PolarHBondContact NH1-ND2 2.72Å; R180-N262 PolarHBondContact NH1-OD1 3.48Å; D260-N262 PolarHBondContact O-N 3.27Å; D260-N262 WeakPolarHBondContact OD1-CA 3.39Å; D260-N262 VanDerWaalsContact OD1-CB 3.24Å; D260-N262 WeakPolarHBondContact OD1-CB 3.37Å; D260-N262 PolarHBondContact OD1-N 3.31Å; D260-N262 PolarHBondContact OD1-ND2 3.49Å; N262-Y264 VanDerWaalsContact C-N 3.3Å; N262-R265 PolarHBondContact OD1-NE 2.94Å; N262-R265 PolarHBondContact OD1-NH2 2.79Å
263	I	67.2	Low	62.1	Low	90 Å²	90	109.3 Å²	109.3	46%	0.462	54%	0.544	S	S	.	.	S	Bend	trans	-62.3	-41.1	172.4	-70.4	167.4	0	0	0	110.5	A256 L257 L259 D260	A256-I263 WeakPolarHBondContact O-CD1 3.48Å; L257-I263 HydrophobicContact CD2-CG2 3.85Å; L259-I263 HydrophobicContact CB-CD1 3.71Å; D260-I263 HydrophobicContact CB-CD1 3.96Å; D260-I263 HydrophobicContact CB-CG1 4.02Å; D260-I263 WeakPolarHBondContact O-CB 3.48Å; D260-I263 WeakPolarHBondContact O-CG1 3.38Å; D260-I263 PolarHBondContact O-N 2.94Å
264	Y	58	Low	61.5	Low	154 Å²	154	104.6 Å²	104.6	60%	0.604	53%	0.529	S	S	*	.			trans	-150.7	119.7	171.8	-160.7	-107.3	0	0	0	109.3	N262 L266	N262-Y264 VanDerWaalsContact C-N 3.3Å; Y264-L266 HydrophobicContact CD1-CG 4.4Å; Y264-L266 HydrophobicContact CE1-CD2 3.99Å; Y264-L266 HydrophobicContact CE1-CG 3.94Å
265	R	57.8	Low	61	Low	159 Å²	159	102.3 Å²	102.3	60%	0.6	51%	0.514	S	S	*	.			trans	-108.7	126.9	163.9	-68.8	-171.1	-175.6	-174.8	4	108.3	P261 N262 E267	P261-R265 WeakPolarHBondContact O-CG 3.36Å; P261-R265 PolarHBondContact O-NE 3.29Å; N262-R265 PolarHBondContact OD1-NE 2.94Å; N262-R265 PolarHBondContact OD1-NH2 2.79Å; R265-E267 PolarHBondContact O-N 3.3Å
266	L	49.2	Very low	60.4	Low	140 Å²	140	107.5 Å²	107.5	73%	0.733	54%	0.537	S	S	*	.			trans	-74.3	102.5	156.1	-74.3	159.4	0	0	0	106.2	Y264 N268	Y264-L266 HydrophobicContact CD1-CG 4.4Å; Y264-L266 HydrophobicContact CE1-CD2 3.99Å; Y264-L266 HydrophobicContact CE1-CG 3.94Å; L266-N268 PolarHBondContact O-N 2.92Å
267	E	45.2	Very low	59.7	Low	194 Å²	194	114.5 Å²	114.5	91%	0.907	57%	0.566	S	S	*	*			trans	-67.6	123.8	162.5	-66.9	-173.2	148.4	0	0	107.4	R265	R265-E267 PolarHBondContact O-N 3.3Å
268	N	37.7	Very low	59	Low	224 Å²	224	117.7 Å²	117.7	100%	1.198	58%	0.58	S	S	*	*			trans	-138.6	0	-171	-156.4	75.1	0	0	0	108.9	L266	L266-N268 PolarHBondContact O-N 2.92Å

Retrieved 268 of 268 residues in 42.7 ms (Link to these results)

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