A0A093HVL3_STRCA Loading...

Mediator of RNA polymerase II transcription subunit 7

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A093HVL3, Species STRCA (Struthio camelus australis), Gene n/a, Length 230 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.3	Very low	63.8	Low	242 Å²	242	142.2 Å²	142.2	100%	1.192	82%	0.824	S	S	*	*				0	105.4	0	-68.7	-64.8	-152.1	0	0	107
2	G	53.7	Low	65.3	Low	77 Å²	77	139.1 Å²	139.1	79%	0.794	81%	0.812	S	S	*	*			trans	-86.7	131.9	166.6	0	0	0	0	0	108
3	E	47.7	Very low	66.8	Low	187 Å²	187	134.2 Å²	134.2	87%	0.874	79%	0.788	S	S	*	*			trans	-64.4	142	175.5	-66.6	-172.6	112.7	0	0	110.2	Q5	E3-Q5 PolarHBondContact O-N 3.46Å
4	P	51.2	Low	68.3	Low	121 Å²	121	130.9 Å²	130.9	79%	0.786	77%	0.772	S	S	*	*			trans	-67.1	107.6	178.1	27.5	-33.1	0	0	0	109.2	Q6	P4-Q6 PolarHBondContact O-N 2.73Å
5	Q	60.8	Low	69.4	Low	178 Å²	178	128.7 Å²	128.7	83%	0.832	75%	0.753	S	S	*	*			trans	-59.7	112.5	178.6	-171.1	165.2	7.8	0	0	109.4	E3 V7	E3-Q5 PolarHBondContact O-N 3.46Å; Q5-V7 PolarHBondContact O-N 2.77Å
6	Q	63.3	Low	70.2	Confident	193 Å²	193	130.8 Å²	130.8	90%	0.902	75%	0.753	S	S	*	*			trans	-67.6	95.1	179.6	-71.3	-174.5	-7	0	0	109.8	P4 S8	P4-Q6 PolarHBondContact O-N 2.73Å; Q6-S8 PolarHBondContact O-N 2.87Å
7	V	65.7	Low	71	Confident	129 Å²	129	131.8 Å²	131.8	78%	0.782	74%	0.743	S	S	*	*			trans	-77.7	109.4	171.1	-175.4	0	0	0	0	107.9	Q5 A9	Q5-V7 PolarHBondContact O-N 2.77Å; V7-A9 PolarHBondContact O-N 3.47Å
8	S	71.3	Confident	71.8	Confident	87 Å²	87	129.1 Å²	129.1	61%	0.608	73%	0.725	S	S	*	*			trans	-59.4	132.9	170.1	-179.9	0	0	0	0	110	Q6 L10	Q6-S8 PolarHBondContact O-N 2.87Å; S8-L10 PolarHBondContact O-N 2.98Å; S8-L10 PolarHBondContact OG-N 2.85Å
9	A	80.4	Confident	72.5	Confident	107 Å²	107	129.8 Å²	129.8	88%	0.884	72%	0.72	S	S	*	*	S	Bend	trans	-74.3	-7	176.7	0	0	0	0	0	113.5	V7	V7-A9 PolarHBondContact O-N 3.47Å
10	L	84.6	Confident	73.1	Confident	131 Å²	131	127.9 Å²	127.9	69%	0.686	71%	0.705	S	S	*	*	S	Bend	trans	-100.1	143.5	178.3	-64.5	174.9	0	0	0	110.5	S8	S8-L10 PolarHBondContact O-N 2.98Å; S8-L10 PolarHBondContact OG-N 2.85Å
11	P	85	Confident	73.8	Confident	112 Å²	112	127.2 Å²	127.2	73%	0.727	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-58.9	140	176.7	25.8	-34.2	0	0	0	110.2
12	P	81.8	Confident	76.2	Confident	105 Å²	105	118.6 Å²	118.6	68%	0.682	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-60.2	145	173.7	27.7	-34.4	0	0	0	109.2
13	P	85.4	Confident	77.9	Confident	76 Å²	76	121.9 Å²	121.9	49%	0.494	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-65.5	157.8	-178	31.5	-38	0	0	0	110.5	M15 I18	P13-M15 WeakPolarHBondContact O-CG 3.41Å; P13-M15 PolarHBondContact O-N 2.68Å; P13-I18 HydrophobicContact CB-CD1 3.55Å; P13-I18 HydrophobicContact CG-CD1 3.45Å; P13-I18 VanDerWaalsContact CG-CD1 3.45Å
14	P	87.6	Confident	79.9	Confident	87 Å²	87	117.6 Å²	117.6	57%	0.565	63%	0.633	S	S	*	*			trans	-58.6	89.5	-175.5	-29.7	38.8	0	0	0	114.6	Q16 Y17 I18	P14-Q16 PolarHBondContact O-N 3.32Å; P14-Y17 HydrophobicContact CB-CD2 3.71Å; P14-Y17 HydrophobicContact CB-CE2 4.37Å; P14-Y17 PolarHBondContact O-N 3.28Å; P14-I18 PolarHBondContact O-N 3.12Å
15	M	84.7	Confident	81.6	Confident	98 Å²	98	113.5 Å²	113.5	48%	0.483	61%	0.605	S	S	.	*	H	α-helix	trans	-62.4	-16.5	-174.5	-69.1	-56.3	-59.9	0	0	114.5	P13 Y17 I18 K19	P13-M15 WeakPolarHBondContact O-CG 3.41Å; P13-M15 PolarHBondContact O-N 2.68Å; M15-Y17 VanDerWaalsContact C-N 3.34Å; M15-I18 HydrophobicContact SD-CD1 4.33Å; M15-K19 WeakPolarHBondContact O-CD 3.43Å; M15-K19 WeakPolarHBondContact O-CG 3.3Å
16	Q	82.6	Confident	82.9	Confident	163 Å²	163	109.6 Å²	109.6	76%	0.762	59%	0.588	S	S	*	*	H	α-helix	trans	-66.7	-35.1	171.7	-68.8	174.6	-11.6	0	0	112	P14	P14-Q16 PolarHBondContact O-N 3.32Å
17	Y	82.7	Confident	84.1	Confident	148 Å²	148	109.9 Å²	109.9	58%	0.58	58%	0.581	S	S	*	*	H	α-helix	trans	-87.6	-45.9	179.9	-63.6	-84.5	0	0	0	111.2	P14 M15 K19 E20 Y21	P14-Y17 HydrophobicContact CB-CD2 3.71Å; P14-Y17 HydrophobicContact CB-CE2 4.37Å; P14-Y17 PolarHBondContact O-N 3.28Å; M15-Y17 VanDerWaalsContact C-N 3.34Å; Y17-K19 PolarHBondContact O-N 3.26Å; Y17-K19 VanDerWaalsContact O-N 3.14Å; Y17-E20 WeakPolarHBondContact O-CB 3.39Å; Y17-E20 PolarHBondContact O-N 3.39Å; Y17-Y21 WeakPolarHBondContact O-CD2 3.31Å
18	I	85.6	Confident	85.3	Confident	83 Å²	83	109.3 Å²	109.3	43%	0.426	57%	0.568	S	S	.	*	H	α-helix	trans	-55.3	-38	-173.6	-72.8	168.2	0	0	0	113.1	P13 P14 M15 E20 Y21	P13-I18 HydrophobicContact CB-CD1 3.55Å; P13-I18 HydrophobicContact CG-CD1 3.45Å; P13-I18 VanDerWaalsContact CG-CD1 3.45Å; P14-I18 PolarHBondContact O-N 3.12Å; M15-I18 HydrophobicContact SD-CD1 4.33Å; I18-E20 PolarHBondContact O-N 3.43Å; I18-Y21 PolarHBondContact O-N 2.68Å; I18-Y21 VanDerWaalsContact O-N 3.15Å
19	K	85.5	Confident	86	Confident	142 Å²	142	108.3 Å²	108.3	62%	0.617	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-25.8	-179.8	-71.1	175.4	-178.5	-175.6	0	113.7	M15 Y17	M15-K19 WeakPolarHBondContact O-CD 3.43Å; M15-K19 WeakPolarHBondContact O-CG 3.3Å; Y17-K19 PolarHBondContact O-N 3.26Å; Y17-K19 VanDerWaalsContact O-N 3.14Å
20	E	84.3	Confident	86.3	Confident	91 Å²	91	108.7 Å²	108.7	43%	0.425	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	-20.4	-179.4	-55.7	-54.2	143.7	0	0	112.8	Y17 I18 T22 N25 P32	Y17-E20 WeakPolarHBondContact O-CB 3.39Å; Y17-E20 PolarHBondContact O-N 3.39Å; I18-E20 PolarHBondContact O-N 3.43Å; E20-T22 PolarHBondContact O-N 3.06Å; E20-N25 VanDerWaalsContact O-CB 3.24Å; E20-N25 WeakPolarHBondContact O-CB 3.44Å; E20-N25 PolarHBondContact O-ND2 2.97Å; E20-P32 HydrophobicContact CB-CG 3.95Å; E20-P32 HydrophobicContact CG-CG 4.41Å
21	Y	87	Confident	86.4	Confident	114 Å²	114	103.6 Å²	103.6	45%	0.447	54%	0.535	S	S	.	.			trans	-91.4	61.8	-179.3	-71.6	-97.7	0	0	0	111.9	Y17 I18 A31 P32	Y17-Y21 WeakPolarHBondContact O-CD2 3.31Å; I18-Y21 PolarHBondContact O-N 2.68Å; I18-Y21 VanDerWaalsContact O-N 3.15Å; Y21-A31 HydrophobicContact CD1-CB 4.3Å; Y21-A31 HydrophobicContact CE1-CB 4.4Å; Y21-P32 HydrophobicContact CE2-CG 4.04Å; Y21-P32 PolarHBondContact OH-O 3.05Å
22	T	89.1	Confident	86.4	Confident	61 Å²	61	100.7 Å²	100.7	37%	0.374	52%	0.516	S	S	.	.			trans	-91.6	153.5	168.5	64.9	0	0	0	0	111.1	E20 E24 N25 I26	E20-T22 PolarHBondContact O-N 3.06Å; T22-E24 PolarHBondContact O-N 2.96Å; T22-E24 VanDerWaalsContact O-N 3.14Å; T22-N25 PolarHBondContact O-N 3.29Å; T22-N25 WeakPolarHBondContact OG1-CB 2.99Å; T22-N25 VanDerWaalsContact OG1-CG 3.25Å; T22-N25 PolarHBondContact OG1-N 2.98Å; T22-N25 PolarHBondContact OG1-ND2 3.22Å; T22-I26 WeakPolarHBondContact O-CG1 3.09Å; T22-I26 PolarHBondContact O-N 2.95Å
23	D	89.3	Confident	86.5	Confident	147 Å²	147	104.8 Å²	104.8	79%	0.786	52%	0.523	S	S	*	.	H	α-helix	trans	-53.9	-35.7	176.4	-61.9	-35	0	0	0	112.4	R27	D23-R27 VanDerWaalsContact O-CB 3.26Å; D23-R27 WeakPolarHBondContact O-CB 3.23Å; D23-R27 PolarHBondContact O-N 3.02Å
24	E	90.2	Very high	86.4	Confident	97 Å²	97	106.2 Å²	106.2	45%	0.453	53%	0.533	S	S	.	.	H	α-helix	trans	-70.7	-42.8	177.5	-172.9	168.8	-163.1	0	0	112.5	T22 R27 K28	T22-E24 PolarHBondContact O-N 2.96Å; T22-E24 VanDerWaalsContact O-N 3.14Å; E24-R27 PolarHBondContact O-N 3.21Å; E24-K28 VanDerWaalsContact CD-NZ 3.33Å; E24-K28 HydrophobicContact CG-CD 4.04Å; E24-K28 WeakPolarHBondContact O-CB 3.32Å; E24-K28 VanDerWaalsContact O-CG 3.3Å; E24-K28 WeakPolarHBondContact O-CG 3.48Å; E24-K28 PolarHBondContact O-N 3.13Å; E24-K28 WeakPolarHBondContact OE1-CE 3.27Å; E24-K28 IonicContact OE1-NZ 3.62Å; E24-K28 PolarHBondContact OE1-NZ 2.77Å
25	N	87	Confident	86.2	Confident	35 Å²	35	107.5 Å²	107.5	19%	0.187	54%	0.541	C	S	.	.	H	α-helix	trans	-67	-37.8	176.1	-75.2	-5.6	0	0	0	112	E20 T22 K28 G29 L30 A31	E20-N25 VanDerWaalsContact O-CB 3.24Å; E20-N25 WeakPolarHBondContact O-CB 3.44Å; E20-N25 PolarHBondContact O-ND2 2.97Å; T22-N25 PolarHBondContact O-N 3.29Å; T22-N25 WeakPolarHBondContact OG1-CB 2.99Å; T22-N25 VanDerWaalsContact OG1-CG 3.25Å; T22-N25 PolarHBondContact OG1-N 2.98Å; T22-N25 PolarHBondContact OG1-ND2 3.22Å; N25-K28 CarbonylContact O-C 3.59Å; N25-K28 PolarHBondContact O-N 2.87Å; N25-G29 PolarHBondContact O-N 2.94Å; N25-L30 HydrophobicContact CB-CB 4.33Å; N25-L30 PolarHBondContact O-N 3.14Å; N25-A31 PolarHBondContact O-N 2.89Å
26	I	87.8	Confident	86.2	Confident	95 Å²	95	108.2 Å²	108.2	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-50.2	174.5	-67.1	165.7	0	0	0	109.7	T22 K28 G29 A31	T22-I26 WeakPolarHBondContact O-CG1 3.09Å; T22-I26 PolarHBondContact O-N 2.95Å; I26-K28 VanDerWaalsContact C-N 3.27Å; I26-K28 PolarHBondContact O-N 3.17Å; I26-G29 PolarHBondContact O-N 3.08Å; I26-A31 HydrophobicContact CG1-CB 4.15Å
27	R	89.3	Confident	86.2	Confident	199 Å²	199	106 Å²	106	75%	0.751	55%	0.552	S	S	*	*	H	α-helix	trans	-60.6	-33.7	177.2	-176.1	179.5	63.3	160	-2	113.1	D23 E24	D23-R27 VanDerWaalsContact O-CB 3.26Å; D23-R27 WeakPolarHBondContact O-CB 3.23Å; D23-R27 PolarHBondContact O-N 3.02Å; E24-R27 PolarHBondContact O-N 3.21Å
28	K	90.6	Very high	86.1	Confident	117 Å²	117	103.1 Å²	103.1	51%	0.509	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	-4.5	176.2	-69.9	176.3	-177.7	171.1	0	113.9	E24 N25 I26 L30	E24-K28 VanDerWaalsContact CD-NZ 3.33Å; E24-K28 HydrophobicContact CG-CD 4.04Å; E24-K28 WeakPolarHBondContact O-CB 3.32Å; E24-K28 VanDerWaalsContact O-CG 3.3Å; E24-K28 WeakPolarHBondContact O-CG 3.48Å; E24-K28 PolarHBondContact O-N 3.13Å; E24-K28 WeakPolarHBondContact OE1-CE 3.27Å; E24-K28 IonicContact OE1-NZ 3.62Å; E24-K28 PolarHBondContact OE1-NZ 2.77Å; N25-K28 CarbonylContact O-C 3.59Å; N25-K28 PolarHBondContact O-N 2.87Å; I26-K28 VanDerWaalsContact C-N 3.27Å; I26-K28 PolarHBondContact O-N 3.17Å; K28-L30 HydrophobicContact CB-CD1 3.91Å; K28-L30 HydrophobicContact CB-CG 3.86Å; K28-L30 HydrophobicContact CD-CD1 4.05Å; K28-L30 PolarHBondContact O-N 3.32Å
29	G	86.4	Confident	85.8	Confident	66 Å²	66	107 Å²	107	68%	0.68	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	67	18.3	-175.6	0	0	0	0	0	114.6	N25 I26	N25-G29 PolarHBondContact O-N 2.94Å; I26-G29 PolarHBondContact O-N 3.08Å
30	L	85.5	Confident	85.5	Confident	115 Å²	115	106 Å²	106	60%	0.602	57%	0.566	S	S	*	*			trans	-86.5	-14.5	-179.9	-63.3	175.5	0	0	0	113	N25 K28	N25-L30 HydrophobicContact CB-CB 4.33Å; N25-L30 PolarHBondContact O-N 3.14Å; K28-L30 HydrophobicContact CB-CD1 3.91Å; K28-L30 HydrophobicContact CB-CG 3.86Å; K28-L30 HydrophobicContact CD-CD1 4.05Å; K28-L30 PolarHBondContact O-N 3.32Å
31	A	87.1	Confident	85.5	Confident	24 Å²	24	103.6 Å²	103.6	20%	0.198	56%	0.559	C	S	.	*	S	Bend	trans	-58.1	129.3	175.8	0	0	0	0	0	110.5	Y21 N25 I26 K33	Y21-A31 HydrophobicContact CD1-CB 4.3Å; Y21-A31 HydrophobicContact CE1-CB 4.4Å; N25-A31 PolarHBondContact O-N 2.89Å; I26-A31 HydrophobicContact CG1-CB 4.15Å; A31-K33 PolarHBondContact O-N 2.99Å
32	P	84.9	Confident	85.4	Confident	51 Å²	51	102.7 Å²	102.7	33%	0.331	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-64.6	130.3	-175.1	25.3	-34	0	0	0	110.5	E20 Y21	E20-P32 HydrophobicContact CB-CG 3.95Å; E20-P32 HydrophobicContact CG-CG 4.41Å; Y21-P32 HydrophobicContact CE2-CG 4.04Å; Y21-P32 PolarHBondContact OH-O 3.05Å
33	K	83.6	Confident	85.2	Confident	191 Å²	191	105.8 Å²	105.8	83%	0.83	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-64.1	153.8	174.3	-66.6	-178.5	-178.9	178.2	0	110.3	A31	A31-K33 PolarHBondContact O-N 2.99Å
34	P	84.4	Confident	84.9	Confident	107 Å²	107	102 Å²	102	70%	0.695	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-51.1	143.9	171.9	-26.5	34.9	0	0	0	111.4
35	P	83.1	Confident	84.6	Confident	113 Å²	113	106.5 Å²	106.5	73%	0.734	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-58.6	146.6	176.2	26	-34.2	0	0	0	110.2
36	P	84.3	Confident	84.3	Confident	113 Å²	113	108 Å²	108	73%	0.734	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-60.4	148	176.2	27.1	-34.5	0	0	0	110.2	V38	P36-V38 PolarHBondContact O-N 3.12Å
37	P	82.1	Confident	84	Confident	116 Å²	116	107.9 Å²	107.9	75%	0.753	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-54.1	133.6	173.6	-25.5	34.5	0	0	0	111.2	K39	P37-K39 PolarHBondContact O-N 3.36Å
38	V	81.5	Confident	83.6	Confident	89 Å²	89	103.8 Å²	103.8	54%	0.539	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-63.4	129.5	172.2	-178.5	0	0	0	0	108.1	P36 S41 C51	P36-V38 PolarHBondContact O-N 3.12Å; V38-S41 WeakPolarHBondContact CG1-O 3.01Å; V38-C51 PolarHBondContact O-SG 3.49Å
39	K	78.5	Confident	83.1	Confident	164 Å²	164	101.1 Å²	101.1	71%	0.713	57%	0.566	S	S	*	*			trans	-102.4	-22.5	-177.3	-67.2	-172.5	176.8	-175	0	114.3	P37 C51	P37-K39 PolarHBondContact O-N 3.36Å; K39-C51 VanDerWaalsContact O-CB 3.31Å; K39-C51 WeakPolarHBondContact O-CB 3.25Å
40	D	80.5	Confident	82.8	Confident	121 Å²	121	102.7 Å²	102.7	65%	0.647	56%	0.555	S	S	*	*	S	Bend	trans	-98	-86	-169.5	-40.7	-48.7	0	0	0	109.9	Q50 C51	D40-Q50 WeakPolarHBondContact O-CA 3.33Å; D40-C51 PolarHBondContact O-N 2.91Å
41	S	82.9	Confident	82.1	Confident	40 Å²	40	99.9 Å²	99.9	28%	0.28	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	152.4	174.1	65.8	0	0	0	0	112.6	V38 Q48 F49	V38-S41 WeakPolarHBondContact CG1-O 3.01Å; S41-Q48 PolarHBondContact OG-NE2 3.33Å; S41-F49 CarbonylContact C-O 3.59Å; S41-F49 WeakPolarHBondContact CA-O 3.49Å; S41-F49 WeakPolarHBondContact CB-O 3.45Å
42	Y	86.2	Confident	81.3	Confident	96 Å²	96	106.2 Å²	106.2	38%	0.376	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.6	154.2	177.2	70	-76.6	0	0	0	111.3	M44 F49	Y42-M44 HydrophobicContact CD2-CB 4.09Å; Y42-M44 HydrophobicContact CE2-CB 3.71Å; Y42-M44 HydrophobicContact CE2-CG 4.16Å; Y42-M44 HydrophobicContact CE2-SD 3.96Å; Y42-F49 HydrophobicContact CD1-CB 3.9Å; Y42-F49 HydrophobicContact CE1-CB 3.5Å; Y42-F49 VanDerWaalsContact CE1-CB 3.5Å; Y42-F49 HydrophobicContact CE1-CG 4.37Å; Y42-F49 HydrophobicContact CE2-CB 4.34Å; Y42-F49 HydrophobicContact CG-CB 4.46Å; Y42-F49 PolarHBondContact N-O 2.91Å; Y42-F49 PolarHBondContact O-N 3.13Å
43	M	85.1	Confident	80.4	Confident	126 Å²	126	106.9 Å²	106.9	62%	0.621	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.1	122.4	174.8	-70	-65.4	-72	0	0	109.8	G46 N47 Q48	M43-G46 VanDerWaalsContact CE-O 3.3Å; M43-G46 WeakPolarHBondContact CE-O 3.44Å; M43-N47 CarbonylContact C-O 3.58Å; M43-N47 WeakPolarHBondContact CA-O 3.38Å; M43-Q48 HydrophobicContact SD-CB 3.72Å; M43-Q48 HydrophobicContact SD-CG 4.18Å
44	M	82.2	Confident	79.5	Confident	67 Å²	67	103.9 Å²	103.9	33%	0.33	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.9	119	175.6	-160.5	179.1	64.5	0	0	109.4	Y42 G46 N47 F49	Y42-M44 HydrophobicContact CD2-CB 4.09Å; Y42-M44 HydrophobicContact CE2-CB 3.71Å; Y42-M44 HydrophobicContact CE2-CG 4.16Å; Y42-M44 HydrophobicContact CE2-SD 3.96Å; M44-G46 VanDerWaalsContact C-N 3.26Å; M44-G46 PolarHBondContact O-N 3.47Å; M44-N47 PolarHBondContact N-O 2.98Å; M44-N47 PolarHBondContact O-N 3.28Å; M44-F49 HydrophobicContact CB-CD2 3.67Å; M44-F49 HydrophobicContact CB-CE2 3.71Å; M44-F49 HydrophobicContact CE-CD2 4.36Å; M44-F49 HydrophobicContact CE-CE1 4.26Å; M44-F49 HydrophobicContact CE-CE2 3.74Å; M44-F49 HydrophobicContact CE-CZ 3.69Å
45	F	83.6	Confident	78.8	Confident	191 Å²	191	107.4 Å²	107.4	84%	0.838	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.9	43.7	-177.2	-49.2	-64.3	0	0	0	113.8	N47	F45-N47 VanDerWaalsContact C-N 3.26Å; F45-N47 PolarHBondContact O-N 3.5Å; F45-N47 PolarHBondContact O-ND2 2.97Å; F45-N47 VanDerWaalsContact O-ND2 3.13Å
46	G	81.7	Confident	78.4	Confident	66 Å²	66	103.9 Å²	103.9	68%	0.68	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.9	-0.9	-179.9	0	0	0	0	0	115.7	M43 M44	M43-G46 VanDerWaalsContact CE-O 3.3Å; M43-G46 WeakPolarHBondContact CE-O 3.44Å; M44-G46 VanDerWaalsContact C-N 3.26Å; M44-G46 PolarHBondContact O-N 3.47Å
47	N	79.6	Confident	77.9	Confident	94 Å²	94	102.1 Å²	102.1	50%	0.503	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.5	177	-67	-91.2	0	0	0	110.4	M43 M44 F45 F49	M43-N47 CarbonylContact C-O 3.58Å; M43-N47 WeakPolarHBondContact CA-O 3.38Å; M44-N47 PolarHBondContact N-O 2.98Å; M44-N47 PolarHBondContact O-N 3.28Å; F45-N47 VanDerWaalsContact C-N 3.26Å; F45-N47 PolarHBondContact O-N 3.5Å; F45-N47 PolarHBondContact O-ND2 2.97Å; F45-N47 VanDerWaalsContact O-ND2 3.13Å; N47-F49 HydrophobicContact CB-CD2 4.36Å; N47-F49 HydrophobicContact CB-CE2 3.76Å; N47-F49 WeakPolarHBondContact O-CD2 3.46Å
48	Q	82.6	Confident	77.6	Confident	113 Å²	113	98.9 Å²	98.9	53%	0.528	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	131.3	172.3	-166.2	172.9	11.8	0	0	110.2	S41 M43 R57	S41-Q48 PolarHBondContact OG-NE2 3.33Å; M43-Q48 HydrophobicContact SD-CB 3.72Å; M43-Q48 HydrophobicContact SD-CG 4.18Å; Q48-R57 PolarHBondContact O-NH2 3.37Å
49	F	78.7	Confident	77.4	Confident	61 Å²	61	94.6 Å²	94.6	27%	0.268	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.8	175.3	-75.5	-95.1	0	0	0	109.4	S41 Y42 M44 N47	S41-F49 CarbonylContact C-O 3.59Å; S41-F49 WeakPolarHBondContact CA-O 3.49Å; S41-F49 WeakPolarHBondContact CB-O 3.45Å; Y42-F49 HydrophobicContact CD1-CB 3.9Å; Y42-F49 HydrophobicContact CE1-CB 3.5Å; Y42-F49 VanDerWaalsContact CE1-CB 3.5Å; Y42-F49 HydrophobicContact CE1-CG 4.37Å; Y42-F49 HydrophobicContact CE2-CB 4.34Å; Y42-F49 HydrophobicContact CG-CB 4.46Å; Y42-F49 PolarHBondContact N-O 2.91Å; Y42-F49 PolarHBondContact O-N 3.13Å; M44-F49 HydrophobicContact CB-CD2 3.67Å; M44-F49 HydrophobicContact CB-CE2 3.71Å; M44-F49 HydrophobicContact CE-CD2 4.36Å; M44-F49 HydrophobicContact CE-CE1 4.26Å; M44-F49 HydrophobicContact CE-CE2 3.74Å; M44-F49 HydrophobicContact CE-CZ 3.69Å; N47-F49 HydrophobicContact CB-CD2 4.36Å; N47-F49 HydrophobicContact CB-CE2 3.76Å; N47-F49 WeakPolarHBondContact O-CD2 3.46Å
50	Q	80.4	Confident	77.2	Confident	99 Å²	99	91.2 Å²	91.2	46%	0.463	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	146	165	-57.6	-82	2.5	0	0	108.3	D40 D52 D53	D40-Q50 WeakPolarHBondContact O-CA 3.33Å; Q50-D52 VanDerWaalsContact C-N 3.33Å; Q50-D53 HydrophobicContact CB-CB 4.11Å
51	C	70.9	Confident	76.7	Confident	56 Å²	56	89.1 Å²	89.1	38%	0.378	47%	0.467	S	S	.	.	S	Bend	trans	-74.9	-24.6	175.7	-66	0	0	0	0	113.1	V38 K39 D40	V38-C51 PolarHBondContact O-SG 3.49Å; K39-C51 VanDerWaalsContact O-CB 3.31Å; K39-C51 WeakPolarHBondContact O-CB 3.25Å; D40-C51 PolarHBondContact O-N 2.91Å
52	D	69.8	Low	76.1	Confident	156 Å²	156	92.4 Å²	92.4	83%	0.834	48%	0.478	S	S	*	.	S	Bend	trans	-90.9	-4	177.9	-63.6	-34	0	0	0	113.7	Q50 L54	Q50-D52 VanDerWaalsContact C-N 3.33Å; D52-L54 PolarHBondContact O-N 3.49Å
53	D	66	Low	75.5	Confident	65 Å²	65	91.2 Å²	91.2	35%	0.348	50%	0.495	S	S	.	.	S	Bend	trans	-59.8	136.6	174.6	-93.5	-8.7	0	0	0	109.7	Q50 I55 R57	Q50-D53 HydrophobicContact CB-CB 4.11Å; D53-I55 PolarHBondContact O-N 3.45Å; D53-R57 IonicContact OD2-CZ 2.77Å; D53-R57 VanDerWaalsContact OD2-CZ 3.28Å; D53-R57 IonicContact OD2-NE 3.79Å; D53-R57 PolarHBondContact OD2-NE 2.95Å; D53-R57 IonicContact OD2-NH2 3.94Å; D53-R57 PolarHBondContact OD2-NH2 3.4Å
54	L	66.1	Low	75.2	Confident	128 Å²	128	87 Å²	87	67%	0.67	48%	0.475	S	S	*	.			trans	-53.1	134.2	162.8	-66.1	175	0	0	0	108.7	D52 I56	D52-L54 PolarHBondContact O-N 3.49Å; L54-I56 WeakPolarHBondContact CB-O 3.32Å; L54-I56 CarbonylContact O-C 3.59Å; L54-I56 PolarHBondContact O-N 3.46Å
55	I	69.5	Low	74.8	Confident	181 Å²	181	92.1 Å²	92.1	93%	0.928	50%	0.498	S	S	*	.	S	Bend	trans	-48.6	-27.8	178.4	-61.5	173.7	0	0	0	111.5	D53	D53-I55 PolarHBondContact O-N 3.45Å
56	I	74.4	Confident	74.6	Confident	40 Å²	40	86.3 Å²	86.3	21%	0.205	47%	0.471	C	S	.	.	S	Bend	trans	-116.3	106.5	175.6	-53.2	150.9	0	0	0	106.8	L54 N124 E125	L54-I56 WeakPolarHBondContact CB-O 3.32Å; L54-I56 CarbonylContact O-C 3.59Å; L54-I56 PolarHBondContact O-N 3.46Å; I56-N124 VanDerWaalsContact CD1-C 3.41Å; I56-N124 HydrophobicContact CD1-CB 4.32Å; I56-N124 WeakPolarHBondContact CD1-O 3.07Å; I56-N124 HydrophobicContact CG1-CB 4.14Å; I56-N124 HydrophobicContact CG2-CB 4.01Å; I56-E125 HydrophobicContact CG2-CG 4.36Å
57	R	73.5	Confident	74.4	Confident	75 Å²	75	86.8 Å²	86.8	28%	0.283	46%	0.457	S	S	.	.			trans	-65.9	133.8	177.2	-71.8	-174.5	175.7	158.7	2.9	110.7	Q48 D53 H121	Q48-R57 PolarHBondContact O-NH2 3.37Å; D53-R57 IonicContact OD2-CZ 2.77Å; D53-R57 VanDerWaalsContact OD2-CZ 3.28Å; D53-R57 IonicContact OD2-NE 3.79Å; D53-R57 PolarHBondContact OD2-NE 2.95Å; D53-R57 IonicContact OD2-NH2 3.94Å; D53-R57 PolarHBondContact OD2-NH2 3.4Å; R57-H121 PolarHBondContact O-CE1 3.28Å; R57-H121 PolarHBondContact O-ND1 2.96Å
58	P	75.6	Confident	74.3	Confident	48 Å²	48	82.8 Å²	82.8	31%	0.312	44%	0.435	S	S	.	.			trans	-58.9	145.8	174.4	-23.9	33.9	0	0	0	112.1	E60 S61	P58-E60 VanDerWaalsContact CB-OE2 3.26Å; P58-E60 WeakPolarHBondContact CB-OE2 3.4Å; P58-E60 PolarHBondContact O-N 3.24Å; P58-S61 WeakPolarHBondContact O-CB 3.23Å; P58-S61 PolarHBondContact O-N 3.22Å; P58-S61 PolarHBondContact O-OG 2.98Å
59	L	78.5	Confident	74.1	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-55.6	-37.1	178.7	-71.9	157.1	0	0	0	112.1	S61 Q62 G63 I64 R66 V117 H118 H121	L59-S61 VanDerWaalsContact C-N 3.31Å; L59-S61 PolarHBondContact O-N 3.47Å; L59-Q62 CarbonylContact O-C 3.19Å; L59-Q62 WeakPolarHBondContact O-CA 3.4Å; L59-Q62 WeakPolarHBondContact O-CB 3.41Å; L59-Q62 PolarHBondContact O-N 3.38Å; L59-G63 PolarHBondContact O-N 3.05Å; L59-I64 CarbonylContact C-O 3.3Å; L59-I64 VanDerWaalsContact C-O 3.3Å; L59-I64 HydrophobicContact CB-CB 4.24Å; L59-I64 HydrophobicContact CD2-CB 4.29Å; L59-I64 HydrophobicContact CD2-CD1 4.37Å; L59-I64 HydrophobicContact CD2-CG2 4.17Å; L59-I64 PolarHBondContact O-N 3.11Å; L59-R66 HydrophobicContact CD1-CG 4.48Å; L59-V117 HydrophobicContact CD2-CG1 4.09Å; L59-H118 VanDerWaalsContact CD1-ND1 3.26Å; L59-H118 WeakPolarHBondContact CD1-ND1 3.41Å; L59-H121 HydrophobicContact CD1-CB 4.25Å; L59-H121 HydrophobicContact CD2-CB 4Å; L59-H121 HydrophobicContact CG-CB 4.2Å
60	E	73.8	Confident	73.9	Confident	92 Å²	92	84 Å²	84	43%	0.43	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-62.8	-36.4	179.3	-58.2	81.9	178.2	0	0	112.3	P58 Q62 G63 R66	P58-E60 VanDerWaalsContact CB-OE2 3.26Å; P58-E60 WeakPolarHBondContact CB-OE2 3.4Å; P58-E60 PolarHBondContact O-N 3.24Å; E60-Q62 PolarHBondContact O-N 2.95Å; E60-G63 PolarHBondContact O-N 3.04Å; E60-R66 IonicContact OE1-CZ 3.37Å; E60-R66 IonicContact OE1-NE 2.85Å; E60-R66 PolarHBondContact OE1-NE 3.45Å; E60-R66 IonicContact OE1-NH2 2.98Å; E60-R66 PolarHBondContact OE1-NH2 3.02Å; E60-R66 IonicContact OE2-NH2 3.2Å; E60-R66 PolarHBondContact OE2-NH2 3.37Å; E60-R66 VanDerWaalsContact OE2-NH2 3.12Å
61	S	69.6	Low	73.8	Confident	77 Å²	77	88 Å²	88	54%	0.538	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-67.7	-15.2	176.4	73.9	0	0	0	0	113.2	P58 L59	P58-S61 WeakPolarHBondContact O-CB 3.23Å; P58-S61 PolarHBondContact O-N 3.22Å; P58-S61 PolarHBondContact O-OG 2.98Å; L59-S61 VanDerWaalsContact C-N 3.31Å; L59-S61 PolarHBondContact O-N 3.47Å
62	Q	69.9	Low	74.5	Confident	109 Å²	109	87.5 Å²	87.5	51%	0.509	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-102.3	4.7	176.2	-57.7	-176.1	-18.4	0	0	112.2	L59 E60 I64	L59-Q62 CarbonylContact O-C 3.19Å; L59-Q62 WeakPolarHBondContact O-CA 3.4Å; L59-Q62 WeakPolarHBondContact O-CB 3.41Å; L59-Q62 PolarHBondContact O-N 3.38Å; E60-Q62 PolarHBondContact O-N 2.95Å; Q62-I64 VanDerWaalsContact C-N 3.34Å; Q62-I64 HydrophobicContact CB-CD1 4.27Å; Q62-I64 HydrophobicContact CB-CG1 4.19Å
63	G	73.3	Confident	75.3	Confident	71 Å²	71	83.3 Å²	83.3	73%	0.732	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	19	-176.5	0	0	0	0	0	114.4	L59 E60	L59-G63 PolarHBondContact O-N 3.05Å; E60-G63 PolarHBondContact O-N 3.04Å
64	I	78.4	Confident	76.4	Confident	38 Å²	38	83 Å²	83	20%	0.195	44%	0.441	C	S	.	.			trans	-104.2	121.2	-177.8	-51.6	-178.3	0	0	0	109.4	L59 Q62 L114 V117	L59-I64 CarbonylContact C-O 3.3Å; L59-I64 VanDerWaalsContact C-O 3.3Å; L59-I64 HydrophobicContact CB-CB 4.24Å; L59-I64 HydrophobicContact CD2-CB 4.29Å; L59-I64 HydrophobicContact CD2-CD1 4.37Å; L59-I64 HydrophobicContact CD2-CG2 4.17Å; L59-I64 PolarHBondContact O-N 3.11Å; Q62-I64 VanDerWaalsContact C-N 3.34Å; Q62-I64 HydrophobicContact CB-CD1 4.27Å; Q62-I64 HydrophobicContact CB-CG1 4.19Å; I64-L114 HydrophobicContact CG2-CD1 3.56Å; I64-V117 HydrophobicContact CD1-CG1 3.72Å
65	E	75.1	Confident	77.5	Confident	174 Å²	174	83.6 Å²	83.6	81%	0.813	44%	0.438	S	S	*	.			trans	-67	136.8	176.7	-67.7	-167.8	161.9	0	0	111.8	L67 H118	E65-L67 PolarHBondContact O-N 3.06Å; E65-H118 PolarHBondContact O-CE1 2.79Å; E65-H118 PolarHBondContact O-NE2 3.36Å
66	R	78.4	Confident	78.6	Confident	70 Å²	70	81.8 Å²	81.8	26%	0.264	42%	0.423	S	S	.	.			trans	-78.8	118.5	-177	-168.5	-169.8	-69.9	-116.4	-3.1	111.4	L59 E60 H68	L59-R66 HydrophobicContact CD1-CG 4.48Å; E60-R66 IonicContact OE1-CZ 3.37Å; E60-R66 IonicContact OE1-NE 2.85Å; E60-R66 PolarHBondContact OE1-NE 3.45Å; E60-R66 IonicContact OE1-NH2 2.98Å; E60-R66 PolarHBondContact OE1-NH2 3.02Å; E60-R66 IonicContact OE2-NH2 3.2Å; E60-R66 PolarHBondContact OE2-NH2 3.37Å; E60-R66 VanDerWaalsContact OE2-NH2 3.12Å; R66-H68 WeakPolarHBondContact CD-NE2 3.32Å; R66-H68 WeakPolarHBondContact CD-O 3.32Å; R66-H68 VanDerWaalsContact CG-O 3.23Å; R66-H68 WeakPolarHBondContact CG-O 3.5Å; R66-H68 PolarHBondContact NH1-NE2 3.22Å; R66-H68 PolarHBondContact O-N 3.36Å
67	L	78.8	Confident	79.5	Confident	75 Å²	75	80.7 Å²	80.7	39%	0.393	42%	0.417	S	S	.	.	S	Bend	trans	-75.4	0	177.1	-61.3	-178.6	0	0	0	115.5	E65 L81 L115 H118	E65-L67 PolarHBondContact O-N 3.06Å; L67-L81 HydrophobicContact CD1-CD2 4.41Å; L67-L115 HydrophobicContact CD1-CD2 3.97Å; L67-H118 WeakPolarHBondContact CD1-CD2 3.42Å
68	H	76.1	Confident	80.4	Confident	10 Å²	10	80.1 Å²	80.1	5%	0.046	42%	0.42	C	S	.	.	S	Bend	trans	-134.5	150.6	-174.3	62.3	-98.7	0	0	0	111.5	R66 F72 E77	R66-H68 WeakPolarHBondContact CD-NE2 3.32Å; R66-H68 WeakPolarHBondContact CD-O 3.32Å; R66-H68 VanDerWaalsContact CG-O 3.23Å; R66-H68 WeakPolarHBondContact CG-O 3.5Å; R66-H68 PolarHBondContact NH1-NE2 3.22Å; R66-H68 PolarHBondContact O-N 3.36Å; H68-F72 AromaticContact CD2-CD1 3.62Å; H68-F72 AromaticContact CD2-CE1 3.39Å; H68-F72 WeakPolarHBondContact CD2-CE1 3.37Å; H68-F72 AromaticContact CD2-CZ 3.83Å; H68-F72 AromaticContact NE2-CE1 3.58Å; H68-F72 AromaticContact NE2-CZ 3.79Å; H68-E77 HydrophobicContact CB-CG 3.63Å
69	P	80.1	Confident	81.2	Confident	79 Å²	79	85.7 Å²	85.7	51%	0.513	43%	0.434	S	S	.	.			trans	-68.3	159.5	177.7	28.9	-34.5	0	0	0	111.7	Q71 F72	P69-Q71 VanDerWaalsContact C-N 3.31Å; P69-Q71 PolarHBondContact O-N 3.07Å; P69-F72 HydrophobicContact CG-CB 4.33Å; P69-F72 WeakPolarHBondContact O-CD1 3.31Å
70	V	73.3	Confident	82	Confident	122 Å²	122	91 Å²	91	74%	0.739	46%	0.458	S	S	*	.	S	Bend	trans	-63	-33.9	-176.1	-176.4	0	0	0	0	113
71	Q	79.2	Confident	82.9	Confident	181 Å²	181	86.9 Å²	86.9	85%	0.846	44%	0.439	S	S	*	.	S	Bend	trans	-106.6	121.5	171.5	-72.3	-177	-24.3	0	0	109.9	P69	P69-Q71 VanDerWaalsContact C-N 3.31Å; P69-Q71 PolarHBondContact O-N 3.07Å
72	F	84.6	Confident	84.1	Confident	46 Å²	46	87.7 Å²	87.7	20%	0.202	44%	0.437	C	S	.	.			trans	-159.3	159.1	-176.4	64.9	-79.1	0	0	0	112.3	H68 P69 H74 E77 L122	H68-F72 AromaticContact CD2-CD1 3.62Å; H68-F72 AromaticContact CD2-CE1 3.39Å; H68-F72 WeakPolarHBondContact CD2-CE1 3.37Å; H68-F72 AromaticContact CD2-CZ 3.83Å; H68-F72 AromaticContact NE2-CE1 3.58Å; H68-F72 AromaticContact NE2-CZ 3.79Å; P69-F72 HydrophobicContact CG-CB 4.33Å; P69-F72 WeakPolarHBondContact O-CD1 3.31Å; F72-H74 HydrophobicContact CE2-CB 4.24Å; F72-H74 AromaticContact CE2-CE1 3.79Å; F72-H74 AromaticContact CE2-CG 3.65Å; F72-H74 AromaticContact CE2-ND1 3.45Å; F72-H74 WeakPolarHBondContact CE2-ND1 3.28Å; F72-H74 AromaticContact CZ-CE1 3.69Å; F72-H74 AromaticContact CZ-ND1 3.84Å; F72-E77 HydrophobicContact CD2-CB 3.82Å; F72-E77 HydrophobicContact CD2-CG 4.34Å; F72-E77 HydrophobicContact CE2-CB 4.41Å; F72-L122 HydrophobicContact CD2-CD1 4.43Å; F72-L122 HydrophobicContact CE2-CD1 3.33Å; F72-L122 HydrophobicContact CE2-CG 4.32Å; F72-L122 HydrophobicContact CZ-CD1 3.5Å
73	D	87.9	Confident	85.4	Confident	69 Å²	69	87.8 Å²	87.8	37%	0.369	44%	0.438	S	S	.	.			trans	-85.4	110.2	169.9	173.6	-16	0	0	0	108.9	K75 K76 E77	D73-K75 PolarHBondContact O-N 3.03Å; D73-K75 VanDerWaalsContact O-N 3.13Å; D73-K75 VanDerWaalsContact OD1-CB 3.31Å; D73-K75 WeakPolarHBondContact OD1-CB 3.49Å; D73-K75 PolarHBondContact OD1-N 3.09Å; D73-K76 HydrophobicContact CB-CB 4.09Å; D73-K76 HydrophobicContact CB-CD 3.91Å; D73-K76 HydrophobicContact CB-CG 4.11Å; D73-K76 PolarHBondContact O-N 3.49Å; D73-K76 PolarHBondContact OD1-N 3.36Å; D73-K76 VanDerWaalsContact OD2-CD 3.25Å; D73-K76 WeakPolarHBondContact OD2-CD 3.47Å; D73-K76 WeakPolarHBondContact OD2-CE 3.48Å; D73-K76 WeakPolarHBondContact OD2-CG 3.26Å; D73-K76 IonicContact OD2-NZ 3.12Å; D73-K76 PolarHBondContact OD2-NZ 3.31Å; D73-E77 PolarHBondContact O-N 3.42Å
74	H	87.5	Confident	86.4	Confident	59 Å²	59	86.4 Å²	86.4	27%	0.273	42%	0.417	S	S	.	.	H	α-helix	trans	-52.9	-35.7	-178.1	-73.9	57.3	0	0	0	112.7	F72 L78 Y126	F72-H74 HydrophobicContact CE2-CB 4.24Å; F72-H74 AromaticContact CE2-CE1 3.79Å; F72-H74 AromaticContact CE2-CG 3.65Å; F72-H74 AromaticContact CE2-ND1 3.45Å; F72-H74 WeakPolarHBondContact CE2-ND1 3.28Å; F72-H74 AromaticContact CZ-CE1 3.69Å; F72-H74 AromaticContact CZ-ND1 3.84Å; H74-L78 WeakPolarHBondContact O-CB 3.43Å; H74-L78 PolarHBondContact O-N 3.01Å; H74-Y126 HydrophobicContact CB-CD2 4.2Å; H74-Y126 HydrophobicContact CB-CE2 4.46Å; H74-Y126 AromaticContact CD2-CD2 3.91Å
75	K	90.6	Very high	87.3	Confident	139 Å²	139	85.6 Å²	85.6	60%	0.604	41%	0.414	S	S	*	.	H	α-helix	trans	-73.1	-35.4	-179.3	-178.1	-177.6	179.5	179	0	111.8	D73 R79	D73-K75 PolarHBondContact O-N 3.03Å; D73-K75 VanDerWaalsContact O-N 3.13Å; D73-K75 VanDerWaalsContact OD1-CB 3.31Å; D73-K75 WeakPolarHBondContact OD1-CB 3.49Å; D73-K75 PolarHBondContact OD1-N 3.09Å; K75-R79 WeakPolarHBondContact O-CD 3.45Å; K75-R79 VanDerWaalsContact O-CG 3.23Å; K75-R79 WeakPolarHBondContact O-CG 3.49Å; K75-R79 PolarHBondContact O-N 2.98Å
76	K	92.6	Very high	88.3	Confident	144 Å²	144	81.3 Å²	81.3	63%	0.626	40%	0.396	S	S	*	.	H	α-helix	trans	-71.6	-45	174.8	-71.9	175.5	-167.5	139.8	0	111	D73 R79 K80	D73-K76 HydrophobicContact CB-CB 4.09Å; D73-K76 HydrophobicContact CB-CD 3.91Å; D73-K76 HydrophobicContact CB-CG 4.11Å; D73-K76 PolarHBondContact O-N 3.49Å; D73-K76 PolarHBondContact OD1-N 3.36Å; D73-K76 VanDerWaalsContact OD2-CD 3.25Å; D73-K76 WeakPolarHBondContact OD2-CD 3.47Å; D73-K76 WeakPolarHBondContact OD2-CE 3.48Å; D73-K76 WeakPolarHBondContact OD2-CG 3.26Å; D73-K76 IonicContact OD2-NZ 3.12Å; D73-K76 PolarHBondContact OD2-NZ 3.31Å; K76-R79 WeakPolarHBondContact O-CB 3.34Å; K76-R79 PolarHBondContact O-N 3.45Å; K76-K80 PolarHBondContact O-N 3.34Å
77	E	91.8	Very high	89.1	Confident	17 Å²	17	81.9 Å²	81.9	8%	0.079	41%	0.407	C	S	.	.	H	α-helix	trans	-69.5	-39.4	-177.2	-161.1	61	-157.1	0	0	111.8	H68 F72 D73 R79 K80 L81 L122	H68-E77 HydrophobicContact CB-CG 3.63Å; F72-E77 HydrophobicContact CD2-CB 3.82Å; F72-E77 HydrophobicContact CD2-CG 4.34Å; F72-E77 HydrophobicContact CE2-CB 4.41Å; D73-E77 PolarHBondContact O-N 3.42Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.21Å; E77-K80 PolarHBondContact O-N 3Å; E77-K80 VanDerWaalsContact O-N 3.17Å; E77-K80 WeakPolarHBondContact OE1-CE 3.45Å; E77-K80 IonicContact OE1-NZ 2.83Å; E77-K80 PolarHBondContact OE1-NZ 3.39Å; E77-K80 WeakPolarHBondContact OE2-CD 3.4Å; E77-K80 IonicContact OE2-NZ 3.46Å; E77-K80 PolarHBondContact OE2-NZ 3.26Å; E77-L81 WeakPolarHBondContact O-CG 3.26Å; E77-L81 PolarHBondContact O-N 3.07Å; E77-L122 HydrophobicContact CB-CD2 4.07Å; E77-L122 HydrophobicContact CG-CD2 4.35Å
78	L	92.6	Very high	89.9	Confident	63 Å²	63	79.1 Å²	79.1	33%	0.33	39%	0.393	S	S	.	.	H	α-helix	trans	-60.2	-37.3	172.6	-173.4	62.5	0	0	0	112.3	H74 N82 V119 L122 I123	H74-L78 WeakPolarHBondContact O-CB 3.43Å; H74-L78 PolarHBondContact O-N 3.01Å; L78-N82 VanDerWaalsContact O-CB 3.3Å; L78-N82 WeakPolarHBondContact O-CB 3.41Å; L78-N82 PolarHBondContact O-N 3.42Å; L78-V119 HydrophobicContact CD1-CG1 3.93Å; L78-V119 HydrophobicContact CD1-CG2 4.37Å; L78-L122 HydrophobicContact CB-CD2 3.85Å; L78-L122 HydrophobicContact CD1-CD2 4.35Å; L78-I123 HydrophobicContact CD1-CD1 4.46Å; L78-I123 HydrophobicContact CD1-CG1 4.22Å
79	R	94.3	Very high	90.9	Very high	164 Å²	164	83.5 Å²	83.5	62%	0.619	41%	0.412	S	S	*	.	H	α-helix	trans	-67.8	-42.9	174.5	-76.6	172.3	173.4	-150.4	-6	112	K75 K76 E77 N82 M83	K75-R79 WeakPolarHBondContact O-CD 3.45Å; K75-R79 VanDerWaalsContact O-CG 3.23Å; K75-R79 WeakPolarHBondContact O-CG 3.49Å; K75-R79 PolarHBondContact O-N 2.98Å; K76-R79 WeakPolarHBondContact O-CB 3.34Å; K76-R79 PolarHBondContact O-N 3.45Å; E77-R79 VanDerWaalsContact C-N 3.28Å; E77-R79 PolarHBondContact O-N 3.21Å; R79-N82 PolarHBondContact O-N 3.32Å; R79-M83 WeakPolarHBondContact O-CG 3.5Å; R79-M83 PolarHBondContact O-N 3.22Å
80	K	94.2	Very high	91.6	Very high	113 Å²	113	84.4 Å²	84.4	49%	0.491	41%	0.412	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176.6	176.4	-176.4	155.2	-142	0	111.3	K76 E77 M83 S84	K76-K80 PolarHBondContact O-N 3.34Å; E77-K80 PolarHBondContact O-N 3Å; E77-K80 VanDerWaalsContact O-N 3.17Å; E77-K80 WeakPolarHBondContact OE1-CE 3.45Å; E77-K80 IonicContact OE1-NZ 2.83Å; E77-K80 PolarHBondContact OE1-NZ 3.39Å; E77-K80 WeakPolarHBondContact OE2-CD 3.4Å; E77-K80 IonicContact OE2-NZ 3.46Å; E77-K80 PolarHBondContact OE2-NZ 3.26Å; K80-M83 PolarHBondContact O-N 3.37Å; K80-S84 WeakPolarHBondContact O-CB 3.31Å; K80-S84 PolarHBondContact O-N 3.01Å
81	L	93.5	Very high	92.6	Very high	5 Å²	5	81.7 Å²	81.7	3%	0.026	39%	0.393	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.4	-69.6	174.9	0	0	0	112	L67 E77 M83 S84 I85 L115 H118 V119 L122	L67-L81 HydrophobicContact CD1-CD2 4.41Å; E77-L81 WeakPolarHBondContact O-CG 3.26Å; E77-L81 PolarHBondContact O-N 3.07Å; L81-M83 PolarHBondContact O-N 3.4Å; L81-S84 WeakPolarHBondContact O-CB 3.41Å; L81-S84 PolarHBondContact O-N 3.46Å; L81-S84 VanDerWaalsContact O-N 3.14Å; L81-I85 WeakPolarHBondContact O-CG1 3.48Å; L81-I85 PolarHBondContact O-N 3.04Å; L81-L115 HydrophobicContact CD2-CD2 3.9Å; L81-H118 HydrophobicContact CD1-CB 4.02Å; L81-H118 HydrophobicContact CD2-CB 4.42Å; L81-V119 HydrophobicContact CB-CG2 3.65Å; L81-V119 HydrophobicContact CD1-CG2 3.97Å; L81-V119 HydrophobicContact CG-CG2 4.43Å; L81-L122 HydrophobicContact CD1-CD2 4.14Å
82	N	94.8	Very high	93.3	Very high	94 Å²	94	74 Å²	74	50%	0.503	36%	0.357	S	S	.	.	H	α-helix	trans	-61.5	-44	176.7	-169.7	-14.8	0	0	0	112.1	L78 R79 S84 I85 L86	L78-N82 VanDerWaalsContact O-CB 3.3Å; L78-N82 WeakPolarHBondContact O-CB 3.41Å; L78-N82 PolarHBondContact O-N 3.42Å; R79-N82 PolarHBondContact O-N 3.32Å; N82-S84 VanDerWaalsContact C-N 3.34Å; N82-S84 PolarHBondContact O-N 3.1Å; N82-I85 PolarHBondContact O-N 3.44Å; N82-L86 PolarHBondContact O-N 3.5Å
83	M	96.2	Very high	93.7	Very high	110 Å²	110	75.1 Å²	75.1	54%	0.542	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-38.5	172.2	-66.6	-64.7	103.6	0	0	112.3	R79 K80 L81 I85 L86 V87	R79-M83 WeakPolarHBondContact O-CG 3.5Å; R79-M83 PolarHBondContact O-N 3.22Å; K80-M83 PolarHBondContact O-N 3.37Å; L81-M83 PolarHBondContact O-N 3.4Å; M83-I85 PolarHBondContact O-N 3.05Å; M83-L86 PolarHBondContact O-N 2.99Å; M83-V87 WeakPolarHBondContact O-CG2 3.28Å; M83-V87 PolarHBondContact O-N 3.39Å
84	S	95.6	Very high	94	Very high	42 Å²	42	75.2 Å²	75.2	29%	0.294	37%	0.366	S	S	.	.	H	α-helix	trans	-63.3	-39	176	-168	0	0	0	0	112.7	K80 L81 N82 N88	K80-S84 WeakPolarHBondContact O-CB 3.31Å; K80-S84 PolarHBondContact O-N 3.01Å; L81-S84 WeakPolarHBondContact O-CB 3.41Å; L81-S84 PolarHBondContact O-N 3.46Å; L81-S84 VanDerWaalsContact O-N 3.14Å; N82-S84 VanDerWaalsContact C-N 3.34Å; N82-S84 PolarHBondContact O-N 3.1Å; S84-N88 WeakPolarHBondContact O-CB 3.48Å; S84-N88 PolarHBondContact O-N 2.96Å; S84-N88 PolarHBondContact O-ND2 3.41Å
85	I	95.8	Very high	94.2	Very high	22 Å²	22	73.7 Å²	73.7	11%	0.113	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-45.6	173.6	-69.9	167.1	0	0	0	110.4	L81 N82 M83 V87 N88 F89 L112 L115 F116 V119	L81-I85 WeakPolarHBondContact O-CG1 3.48Å; L81-I85 PolarHBondContact O-N 3.04Å; N82-I85 PolarHBondContact O-N 3.44Å; M83-I85 PolarHBondContact O-N 3.05Å; I85-V87 PolarHBondContact O-N 3.02Å; I85-N88 PolarHBondContact O-N 2.59Å; I85-F89 WeakPolarHBondContact O-CB 3.41Å; I85-F89 PolarHBondContact O-N 2.95Å; I85-L112 HydrophobicContact CG2-CD1 4.19Å; I85-L115 HydrophobicContact CD1-CB 4.19Å; I85-L115 HydrophobicContact CG1-CB 3.62Å; I85-L115 HydrophobicContact CG1-CD1 4.03Å; I85-L115 HydrophobicContact CG1-CG 4.38Å; I85-F116 HydrophobicContact CD1-CD1 4.13Å; I85-F116 HydrophobicContact CD1-CE1 4.05Å; I85-F116 HydrophobicContact CD1-CG 4.49Å; I85-F116 HydrophobicContact CD1-CZ 4.36Å; I85-F116 HydrophobicContact CG2-CE2 4.17Å; I85-F116 HydrophobicContact CG2-CZ 3.87Å; I85-V119 HydrophobicContact CD1-CG2 3.79Å
86	L	96.6	Very high	94.3	Very high	84 Å²	84	70.1 Å²	70.1	44%	0.44	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-45.4	178.3	179.2	62	0	0	0	111.9	N82 M83 F89 L90	N82-L86 PolarHBondContact O-N 3.5Å; M83-L86 PolarHBondContact O-N 2.99Å; L86-F89 PolarHBondContact O-N 3.28Å; L86-L90 HydrophobicContact CG-CD1 4.43Å; L86-L90 WeakPolarHBondContact O-CG 3.23Å; L86-L90 PolarHBondContact O-N 2.89Å; L86-L90 VanDerWaalsContact O-N 3.07Å
87	V	96.3	Very high	94.4	Very high	82 Å²	82	70 Å²	70	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-45.8	177.3	174.3	0	0	0	0	111	M83 I85 F89 L90 D91	M83-V87 WeakPolarHBondContact O-CG2 3.28Å; M83-V87 PolarHBondContact O-N 3.39Å; I85-V87 PolarHBondContact O-N 3.02Å; V87-F89 VanDerWaalsContact C-N 3.29Å; V87-F89 PolarHBondContact O-N 2.99Å; V87-L90 PolarHBondContact O-N 3.18Å; V87-L90 VanDerWaalsContact O-N 3.13Å; V87-D91 PolarHBondContact O-N 3.31Å
88	N	95.1	Very high	94.4	Very high	17 Å²	17	78.1 Å²	78.1	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-62.1	-35.1	176.7	-87	-77.2	0	0	0	113.3	S84 I85 L92 K108 L112 L115	S84-N88 WeakPolarHBondContact O-CB 3.48Å; S84-N88 PolarHBondContact O-N 2.96Å; S84-N88 PolarHBondContact O-ND2 3.41Å; I85-N88 PolarHBondContact O-N 2.59Å; N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.48Å; N88-K108 WeakPolarHBondContact OD1-CD 3.18Å; N88-K108 PolarHBondContact OD1-NZ 3.01Å; N88-L112 HydrophobicContact CB-CD1 4.15Å; N88-L115 HydrophobicContact CB-CD1 4.32Å
89	F	95.8	Very high	94.1	Very high	102 Å²	102	78 Å²	78	45%	0.447	39%	0.385	S	S	.	.	H	α-helix	trans	-66.4	-39.9	174.2	-177.8	-105.4	0	0	0	112.1	I85 L86 V87 L92 L93	I85-F89 WeakPolarHBondContact O-CB 3.41Å; I85-F89 PolarHBondContact O-N 2.95Å; L86-F89 PolarHBondContact O-N 3.28Å; V87-F89 VanDerWaalsContact C-N 3.29Å; V87-F89 PolarHBondContact O-N 2.99Å; F89-L92 PolarHBondContact O-N 3.45Å; F89-L93 HydrophobicContact CD1-CD1 4.08Å; F89-L93 HydrophobicContact CE1-CD1 3.59Å; F89-L93 HydrophobicContact CE1-CG 4.18Å; F89-L93 HydrophobicContact CZ-CD1 4.05Å; F89-L93 HydrophobicContact CZ-CD2 4.32Å; F89-L93 HydrophobicContact CZ-CG 4.26Å; F89-L93 WeakPolarHBondContact O-CG 3.4Å; F89-L93 PolarHBondContact O-N 3.37Å
90	L	95.6	Very high	93.6	Very high	98 Å²	98	73.9 Å²	73.9	51%	0.513	38%	0.38	S	S	.	.	H	α-helix	trans	-67.1	-41.8	175	-68	170.9	0	0	0	112	L86 V87 L92 L93 D94	L86-L90 HydrophobicContact CG-CD1 4.43Å; L86-L90 WeakPolarHBondContact O-CG 3.23Å; L86-L90 PolarHBondContact O-N 2.89Å; L86-L90 VanDerWaalsContact O-N 3.07Å; V87-L90 PolarHBondContact O-N 3.18Å; V87-L90 VanDerWaalsContact O-N 3.13Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.14Å; L90-L93 PolarHBondContact O-N 3.36Å; L90-D94 PolarHBondContact O-N 2.97Å
91	D	93.4	Very high	93.2	Very high	64 Å²	64	72.2 Å²	72.2	34%	0.342	40%	0.395	S	S	.	.	H	α-helix	trans	-58.5	-44.9	172.8	-70.6	-12.3	0	0	0	111.2	V87 L93 D94 I95 K108	V87-D91 PolarHBondContact O-N 3.31Å; D91-L93 VanDerWaalsContact C-N 3.32Å; D91-L93 PolarHBondContact O-N 3.03Å; D91-D94 PolarHBondContact O-N 2.88Å; D91-I95 WeakPolarHBondContact O-CD1 3.37Å; D91-I95 WeakPolarHBondContact O-CG1 3.3Å; D91-I95 PolarHBondContact O-N 3.14Å; D91-K108 HydrophobicContact CB-CD 4.42Å; D91-K108 VanDerWaalsContact OD2-CE 3.31Å; D91-K108 WeakPolarHBondContact OD2-CE 3.21Å; D91-K108 IonicContact OD2-NZ 2.73Å; D91-K108 PolarHBondContact OD2-NZ 3Å
92	L	93.9	Very high	93.1	Very high	20 Å²	20	73.8 Å²	73.8	11%	0.105	41%	0.407	C	S	.	.	H	α-helix	trans	-61.9	-39.4	177.7	179.1	61.7	0	0	0	111.6	N88 F89 L90 I95 L96 R105 K108	N88-L92 WeakPolarHBondContact O-CB 3.31Å; N88-L92 PolarHBondContact O-N 3.48Å; F89-L92 PolarHBondContact O-N 3.45Å; L90-L92 VanDerWaalsContact C-N 3.33Å; L90-L92 PolarHBondContact O-N 3.14Å; L92-I95 PolarHBondContact O-N 3.08Å; L92-L96 HydrophobicContact CD1-CD1 4.46Å; L92-L96 HydrophobicContact CD1-CG 4.44Å; L92-L96 HydrophobicContact CG-CD1 4.22Å; L92-L96 WeakPolarHBondContact O-CB 3.36Å; L92-L96 VanDerWaalsContact O-CG 3.25Å; L92-L96 WeakPolarHBondContact O-CG 3.25Å; L92-L96 PolarHBondContact O-N 3Å; L92-R105 HydrophobicContact CD1-CG 3.9Å; L92-K108 HydrophobicContact CB-CB 4.44Å; L92-K108 HydrophobicContact CD1-CB 4.16Å
93	L	93.9	Very high	92.9	Very high	69 Å²	69	75.6 Å²	75.6	36%	0.361	42%	0.415	S	S	.	.	H	α-helix	trans	-64.4	-43.9	174.4	-71.9	177.3	0	0	0	112.4	F89 L90 D91 I95 L96 I97	F89-L93 HydrophobicContact CD1-CD1 4.08Å; F89-L93 HydrophobicContact CE1-CD1 3.59Å; F89-L93 HydrophobicContact CE1-CG 4.18Å; F89-L93 HydrophobicContact CZ-CD1 4.05Å; F89-L93 HydrophobicContact CZ-CD2 4.32Å; F89-L93 HydrophobicContact CZ-CG 4.26Å; F89-L93 WeakPolarHBondContact O-CG 3.4Å; F89-L93 PolarHBondContact O-N 3.37Å; L90-L93 PolarHBondContact O-N 3.36Å; D91-L93 VanDerWaalsContact C-N 3.32Å; D91-L93 PolarHBondContact O-N 3.03Å; L93-I95 VanDerWaalsContact C-N 3.33Å; L93-I95 PolarHBondContact O-N 2.93Å; L93-L96 PolarHBondContact O-N 3.45Å; L93-I97 VanDerWaalsContact O-CG1 3.28Å; L93-I97 WeakPolarHBondContact O-CG1 3.43Å; L93-I97 PolarHBondContact O-N 3.06Å
94	D	93.6	Very high	92.6	Very high	71 Å²	71	76.3 Å²	76.3	38%	0.38	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-38.4	176.6	-173.5	63	0	0	0	111.5	L90 D91 I97 R98	L90-D94 PolarHBondContact O-N 2.97Å; D91-D94 PolarHBondContact O-N 2.88Å; D94-I97 PolarHBondContact O-N 3.33Å; D94-R98 WeakPolarHBondContact O-CB 3.47Å; D94-R98 VanDerWaalsContact O-CG 3.3Å; D94-R98 WeakPolarHBondContact O-CG 3.45Å; D94-R98 PolarHBondContact O-N 2.91Å; D94-R98 IonicContact OD1-CZ 3.52Å; D94-R98 IonicContact OD1-NE 2.87Å; D94-R98 PolarHBondContact OD1-NE 3.46Å; D94-R98 IonicContact OD1-NH2 3.47Å; D94-R98 PolarHBondContact OD1-NH2 3Å; D94-R98 IonicContact OD2-CZ 2.59Å; D94-R98 IonicContact OD2-NE 2.77Å; D94-R98 PolarHBondContact OD2-NE 2.62Å; D94-R98 IonicContact OD2-NH2 3.28Å; D94-R98 PolarHBondContact OD2-NH2 3.37Å
95	I	92.7	Very high	92.4	Very high	27 Å²	27	79.7 Å²	79.7	14%	0.138	42%	0.421	C	S	.	.	H	α-helix	trans	-61.9	-44.8	172	-68.7	161	0	0	0	111.3	D91 L92 L93 I97 R98 S99 K104 R105 K108	D91-I95 WeakPolarHBondContact O-CD1 3.37Å; D91-I95 WeakPolarHBondContact O-CG1 3.3Å; D91-I95 PolarHBondContact O-N 3.14Å; L92-I95 PolarHBondContact O-N 3.08Å; L93-I95 VanDerWaalsContact C-N 3.33Å; L93-I95 PolarHBondContact O-N 2.93Å; I95-I97 VanDerWaalsContact C-N 3.33Å; I95-I97 PolarHBondContact O-N 3.07Å; I95-R98 PolarHBondContact O-N 3.01Å; I95-S99 CarbonylContact O-C 3.39Å; I95-S99 WeakPolarHBondContact O-CA 3.4Å; I95-S99 PolarHBondContact O-N 3.39Å; I95-K104 HydrophobicContact CD1-CB 4.04Å; I95-K104 HydrophobicContact CG2-CB 4.35Å; I95-R105 HydrophobicContact CG2-CB 4.17Å; I95-K108 HydrophobicContact CD1-CG 3.68Å
96	L	92	Very high	92.2	Very high	65 Å²	65	83.2 Å²	83.2	34%	0.34	44%	0.437	S	S	.	.	H	α-helix	trans	-65.7	-33.9	178.9	-73	171.1	0	0	0	112.8	L92 L93 P100 R105	L92-L96 HydrophobicContact CD1-CD1 4.46Å; L92-L96 HydrophobicContact CD1-CG 4.44Å; L92-L96 HydrophobicContact CG-CD1 4.22Å; L92-L96 WeakPolarHBondContact O-CB 3.36Å; L92-L96 VanDerWaalsContact O-CG 3.25Å; L92-L96 WeakPolarHBondContact O-CG 3.25Å; L92-L96 PolarHBondContact O-N 3Å; L93-L96 PolarHBondContact O-N 3.45Å; L96-P100 HydrophobicContact CD2-CB 4.24Å; L96-P100 WeakPolarHBondContact O-CD 3.31Å; L96-R105 HydrophobicContact CD2-CG 4.08Å
97	I	93.9	Very high	92	Very high	140 Å²	140	84.2 Å²	84.2	72%	0.718	44%	0.44	S	S	*	.	H	α-helix	trans	-71	-41.6	175.4	-68.6	163.4	0	0	0	111.1	L93 D94 I95	L93-I97 VanDerWaalsContact O-CG1 3.28Å; L93-I97 WeakPolarHBondContact O-CG1 3.43Å; L93-I97 PolarHBondContact O-N 3.06Å; D94-I97 PolarHBondContact O-N 3.33Å; I95-I97 VanDerWaalsContact C-N 3.33Å; I95-I97 PolarHBondContact O-N 3.07Å
98	R	91.9	Very high	91.8	Very high	189 Å²	189	82.3 Å²	82.3	71%	0.713	42%	0.424	S	S	*	.	H	α-helix	trans	-84.9	-41.3	-175.3	-67.1	178.2	-166.8	-97.8	-5	114.4	D94 I95	D94-R98 WeakPolarHBondContact O-CB 3.47Å; D94-R98 VanDerWaalsContact O-CG 3.3Å; D94-R98 WeakPolarHBondContact O-CG 3.45Å; D94-R98 PolarHBondContact O-N 2.91Å; D94-R98 IonicContact OD1-CZ 3.52Å; D94-R98 IonicContact OD1-NE 2.87Å; D94-R98 PolarHBondContact OD1-NE 3.46Å; D94-R98 IonicContact OD1-NH2 3.47Å; D94-R98 PolarHBondContact OD1-NH2 3Å; D94-R98 IonicContact OD2-CZ 2.59Å; D94-R98 IonicContact OD2-NE 2.77Å; D94-R98 PolarHBondContact OD2-NE 2.62Å; D94-R98 IonicContact OD2-NH2 3.28Å; D94-R98 PolarHBondContact OD2-NH2 3.37Å; I95-R98 PolarHBondContact O-N 3.01Å
99	S	87.9	Confident	91.7	Very high	60 Å²	60	84 Å²	84	42%	0.42	43%	0.434	S	S	.	.			trans	-159.5	77.3	-171.3	-162.2	0	0	0	0	111.5	I95 G101 S102	I95-S99 CarbonylContact O-C 3.39Å; I95-S99 WeakPolarHBondContact O-CA 3.4Å; I95-S99 PolarHBondContact O-N 3.39Å; S99-G101 PolarHBondContact O-N 3.11Å; S99-G101 VanDerWaalsContact O-N 3.11Å; S99-S102 VanDerWaalsContact O-CB 3.31Å; S99-S102 WeakPolarHBondContact O-CB 3.46Å; S99-S102 PolarHBondContact O-N 3.49Å
100	P	83.7	Confident	91.5	Very high	77 Å²	77	83.6 Å²	83.6	50%	0.5	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.2	-173.2	25.4	-34.6	0	0	0	114.9	L96 R105	L96-P100 HydrophobicContact CD2-CB 4.24Å; L96-P100 WeakPolarHBondContact O-CD 3.31Å; P100-R105 WeakPolarHBondContact O-CD 3.49Å
101	G	86.2	Confident	91.3	Very high	79 Å²	79	82.3 Å²	82.3	81%	0.814	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	7.7	174.4	0	0	0	0	0	114.8	S99	S99-G101 PolarHBondContact O-N 3.11Å; S99-G101 VanDerWaalsContact O-N 3.11Å
102	S	89.6	Confident	91.3	Very high	38 Å²	38	80.5 Å²	80.5	27%	0.266	42%	0.417	S	S	.	.	S	Bend	trans	-75.3	141.7	180	-168.8	0	0	0	0	112.2	S99 K104 R105	S99-S102 VanDerWaalsContact O-CB 3.31Å; S99-S102 WeakPolarHBondContact O-CB 3.46Å; S99-S102 PolarHBondContact O-N 3.49Å; S102-K104 PolarHBondContact O-N 3.14Å; S102-K104 VanDerWaalsContact O-N 3.12Å; S102-K104 PolarHBondContact OG-N 3.18Å; S102-R105 VanDerWaalsContact O-CB 3.23Å; S102-R105 WeakPolarHBondContact O-CB 3.45Å; S102-R105 PolarHBondContact O-N 3.42Å
103	I	91.7	Very high	91.3	Very high	131 Å²	131	84.1 Å²	84.1	67%	0.672	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-31.1	171	-71.2	167.9	0	0	0	111.8	R105 E106 E107	I103-R105 PolarHBondContact O-N 3.44Å; I103-E106 WeakPolarHBondContact O-CB 3.48Å; I103-E106 PolarHBondContact O-N 3.02Å; I103-E107 HydrophobicContact CG2-CG 4.21Å; I103-E107 PolarHBondContact O-N 3.1Å; I103-E107 VanDerWaalsContact O-N 3.14Å
104	K	89.5	Confident	91.1	Very high	126 Å²	126	84 Å²	84	55%	0.548	43%	0.431	S	S	.	.	H	α-helix	trans	-55.3	-25.3	175.5	-63.6	-172.2	174.3	-170.2	0	114.3	I95 S102 E107 K108	I95-K104 HydrophobicContact CD1-CB 4.04Å; I95-K104 HydrophobicContact CG2-CB 4.35Å; S102-K104 PolarHBondContact O-N 3.14Å; S102-K104 VanDerWaalsContact O-N 3.12Å; S102-K104 PolarHBondContact OG-N 3.18Å; K104-E107 WeakPolarHBondContact CA-OE2 3.36Å; K104-K108 WeakPolarHBondContact O-CB 3.42Å; K104-K108 WeakPolarHBondContact O-CG 3.47Å; K104-K108 PolarHBondContact O-N 2.88Å; K104-K108 VanDerWaalsContact O-N 3.08Å
105	R	92.3	Very high	91.1	Very high	112 Å²	112	81.1 Å²	81.1	42%	0.423	42%	0.415	S	S	.	.	H	α-helix	trans	-65.9	-43.1	173.7	-179.3	-166.5	161.3	-156.3	-11.1	111.3	L92 I95 L96 P100 S102 I103 L109	L92-R105 HydrophobicContact CD1-CG 3.9Å; I95-R105 HydrophobicContact CG2-CB 4.17Å; L96-R105 HydrophobicContact CD2-CG 4.08Å; P100-R105 WeakPolarHBondContact O-CD 3.49Å; S102-R105 VanDerWaalsContact O-CB 3.23Å; S102-R105 WeakPolarHBondContact O-CB 3.45Å; S102-R105 PolarHBondContact O-N 3.42Å; I103-R105 PolarHBondContact O-N 3.44Å; R105-L109 WeakPolarHBondContact O-CB 3.49Å; R105-L109 PolarHBondContact O-N 3.35Å; R105-L109 VanDerWaalsContact O-N 3.08Å
106	E	91.3	Very high	91.1	Very high	96 Å²	96	84.1 Å²	84.1	45%	0.449	43%	0.428	S	S	.	.	H	α-helix	trans	-72.4	-43.3	-179.1	-151.3	67.8	-147	0	0	110.1	I103 K108 L109 E110	I103-E106 WeakPolarHBondContact O-CB 3.48Å; I103-E106 PolarHBondContact O-N 3.02Å; E106-K108 PolarHBondContact O-N 3.46Å; E106-L109 WeakPolarHBondContact O-CA 3.33Å; E106-L109 WeakPolarHBondContact O-CB 3.26Å; E106-L109 PolarHBondContact O-N 3.29Å; E106-E110 PolarHBondContact O-N 3.38Å
107	E	92	Very high	91	Very high	106 Å²	106	83.8 Å²	83.8	50%	0.495	43%	0.428	S	S	.	.	H	α-helix	trans	-52.4	-52.2	172.3	-65.2	171.6	167	0	0	111.2	I103 K104 L109 E110 D111	I103-E107 HydrophobicContact CG2-CG 4.21Å; I103-E107 PolarHBondContact O-N 3.1Å; I103-E107 VanDerWaalsContact O-N 3.14Å; K104-E107 WeakPolarHBondContact CA-OE2 3.36Å; E107-L109 VanDerWaalsContact C-N 3.25Å; E107-L109 PolarHBondContact O-N 3.17Å; E107-E110 PolarHBondContact O-N 3.48Å; E107-D111 PolarHBondContact O-N 3.48Å
108	K	91.7	Very high	90.8	Very high	41 Å²	41	77.1 Å²	77.1	18%	0.178	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-24	176.9	-76.5	-59.2	-163.4	173.4	0	114.3	N88 D91 L92 I95 K104 E106 L112	N88-K108 WeakPolarHBondContact OD1-CD 3.18Å; N88-K108 PolarHBondContact OD1-NZ 3.01Å; D91-K108 HydrophobicContact CB-CD 4.42Å; D91-K108 VanDerWaalsContact OD2-CE 3.31Å; D91-K108 WeakPolarHBondContact OD2-CE 3.21Å; D91-K108 IonicContact OD2-NZ 2.73Å; D91-K108 PolarHBondContact OD2-NZ 3Å; L92-K108 HydrophobicContact CB-CB 4.44Å; L92-K108 HydrophobicContact CD1-CB 4.16Å; I95-K108 HydrophobicContact CD1-CG 3.68Å; K104-K108 WeakPolarHBondContact O-CB 3.42Å; K104-K108 WeakPolarHBondContact O-CG 3.47Å; K104-K108 PolarHBondContact O-N 2.88Å; K104-K108 VanDerWaalsContact O-N 3.08Å; E106-K108 PolarHBondContact O-N 3.46Å; K108-L112 WeakPolarHBondContact O-CB 3.29Å; K108-L112 PolarHBondContact O-N 3.02Å; K108-L112 VanDerWaalsContact O-N 3.14Å
109	L	92.4	Very high	90.8	Very high	54 Å²	54	69.1 Å²	69.1	28%	0.283	37%	0.366	S	S	.	.	H	α-helix	trans	-76.4	-37.5	175.1	-172.4	64	0	0	0	111.3	R105 E106 E107 L112 K113	R105-L109 WeakPolarHBondContact O-CB 3.49Å; R105-L109 PolarHBondContact O-N 3.35Å; R105-L109 VanDerWaalsContact O-N 3.08Å; E106-L109 WeakPolarHBondContact O-CA 3.33Å; E106-L109 WeakPolarHBondContact O-CB 3.26Å; E106-L109 PolarHBondContact O-N 3.29Å; E107-L109 VanDerWaalsContact C-N 3.25Å; E107-L109 PolarHBondContact O-N 3.17Å; L109-L112 PolarHBondContact O-N 3.41Å; L109-K113 VanDerWaalsContact O-CG 3.29Å; L109-K113 WeakPolarHBondContact O-CG 3.22Å; L109-K113 PolarHBondContact O-N 2.93Å
110	E	92.5	Very high	90.9	Very high	93 Å²	93	71.8 Å²	71.8	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-67.2	-43.7	171.4	-63.8	-50.5	138.3	0	0	112	E106 E107 L112 K113 L114	E106-E110 PolarHBondContact O-N 3.38Å; E107-E110 PolarHBondContact O-N 3.48Å; E110-L112 VanDerWaalsContact C-N 3.26Å; E110-L112 PolarHBondContact O-N 3.35Å; E110-K113 WeakPolarHBondContact O-CB 3.14Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 2.75Å; E110-K113 PolarHBondContact OE1-NZ 2.99Å; E110-K113 VanDerWaalsContact OE2-CD 3.31Å; E110-K113 WeakPolarHBondContact OE2-CD 3.49Å; E110-K113 IonicContact OE2-NZ 3.45Å; E110-L114 WeakPolarHBondContact O-CB 3.4Å; E110-L114 PolarHBondContact O-N 2.9Å
111	D	92.2	Very high	91.1	Very high	71 Å²	71	68.8 Å²	68.8	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-53.7	-45.2	172	-74.9	-18.4	0	0	0	111.3	E107 L114 L115	E107-D111 PolarHBondContact O-N 3.48Å; D111-L114 PolarHBondContact O-N 2.93Å; D111-L115 VanDerWaalsContact O-CG 3.28Å; D111-L115 WeakPolarHBondContact O-CG 3.28Å; D111-L115 PolarHBondContact O-N 3.19Å
112	L	93.4	Very high	91.3	Very high	25 Å²	25	65.3 Å²	65.3	13%	0.131	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-44.8	179	-161.5	90	0	0	0	111.8	I85 N88 K108 L109 E110 L114 L115 F116	I85-L112 HydrophobicContact CG2-CD1 4.19Å; N88-L112 HydrophobicContact CB-CD1 4.15Å; K108-L112 WeakPolarHBondContact O-CB 3.29Å; K108-L112 PolarHBondContact O-N 3.02Å; K108-L112 VanDerWaalsContact O-N 3.14Å; L109-L112 PolarHBondContact O-N 3.41Å; E110-L112 VanDerWaalsContact C-N 3.26Å; E110-L112 PolarHBondContact O-N 3.35Å; L112-L114 VanDerWaalsContact C-N 3.35Å; L112-L114 PolarHBondContact O-N 3.02Å; L112-L115 PolarHBondContact O-N 3.31Å; L112-F116 HydrophobicContact CD1-CE2 4.45Å; L112-F116 HydrophobicContact CD2-CD2 4.42Å; L112-F116 HydrophobicContact CD2-CE2 3.93Å; L112-F116 HydrophobicContact CG-CD2 4.1Å; L112-F116 HydrophobicContact CG-CE2 3.83Å; L112-F116 WeakPolarHBondContact O-CD2 3.49Å; L112-F116 PolarHBondContact O-N 2.85Å
113	K	92.4	Very high	91.4	Very high	96 Å²	96	66.7 Å²	66.7	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-57.9	-47.7	175.3	-74.6	164.6	-178	171.6	0	110.8	L109 E110 F116 V117	L109-K113 VanDerWaalsContact O-CG 3.29Å; L109-K113 WeakPolarHBondContact O-CG 3.22Å; L109-K113 PolarHBondContact O-N 2.93Å; E110-K113 WeakPolarHBondContact O-CB 3.14Å; E110-K113 PolarHBondContact O-N 3.19Å; E110-K113 IonicContact OE1-NZ 2.75Å; E110-K113 PolarHBondContact OE1-NZ 2.99Å; E110-K113 VanDerWaalsContact OE2-CD 3.31Å; E110-K113 WeakPolarHBondContact OE2-CD 3.49Å; E110-K113 IonicContact OE2-NZ 3.45Å; K113-F116 PolarHBondContact O-N 2.83Å; K113-V117 WeakPolarHBondContact O-CG2 3.27Å; K113-V117 PolarHBondContact O-N 3.3Å
114	L	90.8	Very high	91.3	Very high	67 Å²	67	63.4 Å²	63.4	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-58.2	-50.1	178.5	-177.7	62.5	0	0	0	111	I64 E110 D111 L112 F116 V117 H118	I64-L114 HydrophobicContact CG2-CD1 3.56Å; E110-L114 WeakPolarHBondContact O-CB 3.4Å; E110-L114 PolarHBondContact O-N 2.9Å; D111-L114 PolarHBondContact O-N 2.93Å; L112-L114 VanDerWaalsContact C-N 3.35Å; L112-L114 PolarHBondContact O-N 3.02Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 2.88Å; L114-V117 PolarHBondContact O-N 2.81Å; L114-V117 VanDerWaalsContact O-N 3.1Å; L114-H118 VanDerWaalsContact CD1-NE2 3.32Å; L114-H118 WeakPolarHBondContact CD1-NE2 3.3Å; L114-H118 PolarHBondContact O-CD2 3.36Å; L114-H118 PolarHBondContact O-N 3.09Å
115	L	92.4	Very high	91.2	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-57	-40.9	176.7	-72.2	169.3	0	0	0	112.8	L67 L81 I85 N88 D111 L112 H118 V119	L67-L115 HydrophobicContact CD1-CD2 3.97Å; L81-L115 HydrophobicContact CD2-CD2 3.9Å; I85-L115 HydrophobicContact CD1-CB 4.19Å; I85-L115 HydrophobicContact CG1-CB 3.62Å; I85-L115 HydrophobicContact CG1-CD1 4.03Å; I85-L115 HydrophobicContact CG1-CG 4.38Å; N88-L115 HydrophobicContact CB-CD1 4.32Å; D111-L115 VanDerWaalsContact O-CG 3.28Å; D111-L115 WeakPolarHBondContact O-CG 3.28Å; D111-L115 PolarHBondContact O-N 3.19Å; L112-L115 PolarHBondContact O-N 3.31Å; L115-H118 PolarHBondContact O-N 2.99Å; L115-V119 WeakPolarHBondContact O-CG2 3.38Å; L115-V119 PolarHBondContact O-N 3.41Å
116	F	93.3	Very high	91.1	Very high	91 Å²	91	60.1 Å²	60.1	40%	0.399	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-40.3	175.1	-83.5	-65.2	0	0	0	112.8	I85 L112 K113 L114 H118 V119 H120	I85-F116 HydrophobicContact CD1-CD1 4.13Å; I85-F116 HydrophobicContact CD1-CE1 4.05Å; I85-F116 HydrophobicContact CD1-CG 4.49Å; I85-F116 HydrophobicContact CD1-CZ 4.36Å; I85-F116 HydrophobicContact CG2-CE2 4.17Å; I85-F116 HydrophobicContact CG2-CZ 3.87Å; L112-F116 HydrophobicContact CD1-CE2 4.45Å; L112-F116 HydrophobicContact CD2-CD2 4.42Å; L112-F116 HydrophobicContact CD2-CE2 3.93Å; L112-F116 HydrophobicContact CG-CD2 4.1Å; L112-F116 HydrophobicContact CG-CE2 3.83Å; L112-F116 WeakPolarHBondContact O-CD2 3.49Å; L112-F116 PolarHBondContact O-N 2.85Å; K113-F116 PolarHBondContact O-N 2.83Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 2.88Å; F116-H118 VanDerWaalsContact C-N 3.34Å; F116-H118 PolarHBondContact O-N 3.16Å; F116-V119 PolarHBondContact O-N 3.49Å; F116-H120 PolarHBondContact O-CD2 3.48Å; F116-H120 PolarHBondContact O-N 3.41Å
117	V	90.4	Very high	91.2	Very high	58 Å²	58	61.8 Å²	61.8	35%	0.352	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-43.7	175	174.7	0	0	0	0	111	L59 I64 K113 L114 H120 H121	L59-V117 HydrophobicContact CD2-CG1 4.09Å; I64-V117 HydrophobicContact CD1-CG1 3.72Å; K113-V117 WeakPolarHBondContact O-CG2 3.27Å; K113-V117 PolarHBondContact O-N 3.3Å; L114-V117 PolarHBondContact O-N 2.81Å; L114-V117 VanDerWaalsContact O-N 3.1Å; V117-H120 PolarHBondContact O-N 3.28Å; V117-H121 PolarHBondContact O-N 3.16Å
118	H	88.7	Confident	91.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-41.4	175.2	-70.6	-65	0	0	0	113	L59 E65 L67 L81 L114 L115 F116 H121 L122	L59-H118 VanDerWaalsContact CD1-ND1 3.26Å; L59-H118 WeakPolarHBondContact CD1-ND1 3.41Å; E65-H118 PolarHBondContact O-CE1 2.79Å; E65-H118 PolarHBondContact O-NE2 3.36Å; L67-H118 WeakPolarHBondContact CD1-CD2 3.42Å; L81-H118 HydrophobicContact CD1-CB 4.02Å; L81-H118 HydrophobicContact CD2-CB 4.42Å; L114-H118 VanDerWaalsContact CD1-NE2 3.32Å; L114-H118 WeakPolarHBondContact CD1-NE2 3.3Å; L114-H118 PolarHBondContact O-CD2 3.36Å; L114-H118 PolarHBondContact O-N 3.09Å; L115-H118 PolarHBondContact O-N 2.99Å; F116-H118 VanDerWaalsContact C-N 3.34Å; F116-H118 PolarHBondContact O-N 3.16Å; H118-H121 PolarHBondContact O-N 3.06Å; H118-L122 WeakPolarHBondContact O-CB 3.47Å; H118-L122 PolarHBondContact O-N 3.38Å
119	V	91.4	Very high	91.1	Very high	20 Å²	20	61 Å²	61	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-43.5	174.6	166.2	0	0	0	0	111.4	L78 L81 I85 L115 F116 L122 I123	L78-V119 HydrophobicContact CD1-CG1 3.93Å; L78-V119 HydrophobicContact CD1-CG2 4.37Å; L81-V119 HydrophobicContact CB-CG2 3.65Å; L81-V119 HydrophobicContact CD1-CG2 3.97Å; L81-V119 HydrophobicContact CG-CG2 4.43Å; I85-V119 HydrophobicContact CD1-CG2 3.79Å; L115-V119 WeakPolarHBondContact O-CG2 3.38Å; L115-V119 PolarHBondContact O-N 3.41Å; F116-V119 PolarHBondContact O-N 3.49Å; V119-L122 PolarHBondContact O-N 2.9Å; V119-I123 HydrophobicContact CG1-CD1 3.72Å; V119-I123 VanDerWaalsContact O-CG1 3.28Å; V119-I123 WeakPolarHBondContact O-CG1 3.22Å; V119-I123 PolarHBondContact O-N 3.12Å
120	H	90.9	Very high	91.2	Very high	117 Å²	117	63 Å²	63	54%	0.542	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-42.8	176.5	-84.6	-69.3	0	0	0	112.4	F116 V117 I123 N124	F116-H120 PolarHBondContact O-CD2 3.48Å; F116-H120 PolarHBondContact O-N 3.41Å; V117-H120 PolarHBondContact O-N 3.28Å; H120-I123 PolarHBondContact O-N 3.28Å; H120-N124 WeakPolarHBondContact O-CB 3.22Å; H120-N124 PolarHBondContact O-N 3.45Å; H120-N124 PolarHBondContact O-ND2 3.08Å
121	H	88.8	Confident	91.3	Very high	14 Å²	14	61.5 Å²	61.5	7%	0.065	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-49.2	175.2	-173.2	79.9	0	0	0	111.4	R57 L59 V117 H118 I123 N124 E125	R57-H121 PolarHBondContact O-CE1 3.28Å; R57-H121 PolarHBondContact O-ND1 2.96Å; L59-H121 HydrophobicContact CD1-CB 4.25Å; L59-H121 HydrophobicContact CD2-CB 4Å; L59-H121 HydrophobicContact CG-CB 4.2Å; V117-H121 PolarHBondContact O-N 3.16Å; H118-H121 PolarHBondContact O-N 3.06Å; H121-I123 VanDerWaalsContact C-N 3.34Å; H121-I123 PolarHBondContact O-N 2.92Å; H121-N124 CarbonylContact O-C 3.45Å; H121-N124 WeakPolarHBondContact O-CA 3.42Å; H121-N124 WeakPolarHBondContact O-CB 3.42Å; H121-N124 PolarHBondContact O-N 3.21Å; H121-E125 IonicContact CD2-OE2 3.2Å; H121-E125 PolarHBondContact CD2-OE2 3.31Å; H121-E125 IonicContact NE2-OE1 3.78Å; H121-E125 IonicContact NE2-OE2 2.88Å; H121-E125 PolarHBondContact O-N 3.48Å
122	L	89.8	Confident	91.5	Very high	5 Å²	5	65.3 Å²	65.3	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-37.5	-179.1	-150.4	68.4	0	0	0	113.4	F72 E77 L78 L81 H118 V119 N124 Y126	F72-L122 HydrophobicContact CD2-CD1 4.43Å; F72-L122 HydrophobicContact CE2-CD1 3.33Å; F72-L122 HydrophobicContact CE2-CG 4.32Å; F72-L122 HydrophobicContact CZ-CD1 3.5Å; E77-L122 HydrophobicContact CB-CD2 4.07Å; E77-L122 HydrophobicContact CG-CD2 4.35Å; L78-L122 HydrophobicContact CB-CD2 3.85Å; L78-L122 HydrophobicContact CD1-CD2 4.35Å; L81-L122 HydrophobicContact CD1-CD2 4.14Å; H118-L122 WeakPolarHBondContact O-CB 3.47Å; H118-L122 PolarHBondContact O-N 3.38Å; V119-L122 PolarHBondContact O-N 2.9Å; L122-N124 VanDerWaalsContact C-N 3.34Å; L122-Y126 PolarHBondContact O-N 2.97Å
123	I	91.4	Very high	91.7	Very high	67 Å²	67	67.1 Å²	67.1	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-68.1	-37.9	173.7	-70.4	167.5	0	0	0	110.5	L78 V119 H120 H121 Y126	L78-I123 HydrophobicContact CD1-CD1 4.46Å; L78-I123 HydrophobicContact CD1-CG1 4.22Å; V119-I123 HydrophobicContact CG1-CD1 3.72Å; V119-I123 VanDerWaalsContact O-CG1 3.28Å; V119-I123 WeakPolarHBondContact O-CG1 3.22Å; V119-I123 PolarHBondContact O-N 3.12Å; H120-I123 PolarHBondContact O-N 3.28Å; H121-I123 VanDerWaalsContact C-N 3.34Å; H121-I123 PolarHBondContact O-N 2.92Å; I123-Y126 PolarHBondContact O-N 3.41Å
124	N	89.9	Confident	92	Very high	62 Å²	62	66.7 Å²	66.7	33%	0.332	33%	0.326	S	S	.	.	H	α-helix	trans	-66.5	-45.6	177.1	-73.4	-20.4	0	0	0	111.2	I56 H120 H121 L122 Y126 R127	I56-N124 VanDerWaalsContact CD1-C 3.41Å; I56-N124 HydrophobicContact CD1-CB 4.32Å; I56-N124 WeakPolarHBondContact CD1-O 3.07Å; I56-N124 HydrophobicContact CG1-CB 4.14Å; I56-N124 HydrophobicContact CG2-CB 4.01Å; H120-N124 WeakPolarHBondContact O-CB 3.22Å; H120-N124 PolarHBondContact O-N 3.45Å; H120-N124 PolarHBondContact O-ND2 3.08Å; H121-N124 CarbonylContact O-C 3.45Å; H121-N124 WeakPolarHBondContact O-CA 3.42Å; H121-N124 WeakPolarHBondContact O-CB 3.42Å; H121-N124 PolarHBondContact O-N 3.21Å; L122-N124 VanDerWaalsContact C-N 3.34Å; N124-Y126 PolarHBondContact O-N 2.75Å; N124-Y126 VanDerWaalsContact O-N 3.12Å; N124-R127 WeakPolarHBondContact O-CB 3.31Å; N124-R127 WeakPolarHBondContact O-CG 3.44Å; N124-R127 PolarHBondContact O-N 2.77Å
125	E	88.1	Confident	92.3	Very high	57 Å²	57	67.7 Å²	67.7	27%	0.266	33%	0.331	S	S	.	.	H	α-helix	trans	-54.5	-30.3	174.3	-71.4	-178.3	120.5	0	0	112.8	I56 H121 P128	I56-E125 HydrophobicContact CG2-CG 4.36Å; H121-E125 IonicContact CD2-OE2 3.2Å; H121-E125 PolarHBondContact CD2-OE2 3.31Å; H121-E125 IonicContact NE2-OE1 3.78Å; H121-E125 IonicContact NE2-OE2 2.88Å; H121-E125 PolarHBondContact O-N 3.48Å; E125-P128 VanDerWaalsContact O-CD 3.26Å; E125-P128 WeakPolarHBondContact O-CD 3.39Å
126	Y	89.8	Confident	92.6	Very high	112 Å²	112	73.3 Å²	73.3	44%	0.439	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-10.8	176.8	-149.7	-101.5	0	0	0	114.8	H74 L122 I123 N124 H129 Q130	H74-Y126 HydrophobicContact CB-CD2 4.2Å; H74-Y126 HydrophobicContact CB-CE2 4.46Å; H74-Y126 AromaticContact CD2-CD2 3.91Å; L122-Y126 PolarHBondContact O-N 2.97Å; I123-Y126 PolarHBondContact O-N 3.41Å; N124-Y126 PolarHBondContact O-N 2.75Å; N124-Y126 VanDerWaalsContact O-N 3.12Å; Y126-H129 AromaticContact CE1-ND1 3.89Å; Y126-H129 AromaticContact CZ-ND1 3.78Å; Y126-H129 WeakPolarHBondContact O-CB 3.4Å; Y126-H129 PolarHBondContact O-N 3.21Å; Y126-Q130 PolarHBondContact O-N 3.32Å
127	R	92.3	Very high	92.9	Very high	132 Å²	132	72.8 Å²	72.8	50%	0.498	36%	0.356	S	S	.	.	H	α-helix	trans	-59.1	-44.2	-178.8	-65	-73.5	-168.3	-174.7	5.5	114	N124 H129 Q130 A131	N124-R127 WeakPolarHBondContact O-CB 3.31Å; N124-R127 WeakPolarHBondContact O-CG 3.44Å; N124-R127 PolarHBondContact O-N 2.77Å; R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.42Å; R127-Q130 WeakPolarHBondContact O-CB 3.05Å; R127-Q130 PolarHBondContact O-N 3.22Å; R127-A131 PolarHBondContact O-N 2.88Å
128	P	91.1	Very high	93.2	Very high	60 Å²	60	74.6 Å²	74.6	39%	0.39	36%	0.362	S	S	.	.	H	α-helix	trans	-64.9	-35.3	179	-21	35.1	0	0	0	112.1	E125 A131 R132	E125-P128 VanDerWaalsContact O-CD 3.26Å; E125-P128 WeakPolarHBondContact O-CD 3.39Å; P128-A131 PolarHBondContact O-N 2.85Å; P128-R132 WeakPolarHBondContact O-CG 3.3Å; P128-R132 PolarHBondContact O-N 2.86Å; P128-R132 VanDerWaalsContact O-N 3.16Å
129	H	91.3	Very high	93.7	Very high	69 Å²	69	79.5 Å²	79.5	32%	0.319	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-48.6	171.9	-176	-66.7	0	0	0	110.9	Y126 R127 A131 R132 E133	Y126-H129 AromaticContact CE1-ND1 3.89Å; Y126-H129 AromaticContact CZ-ND1 3.78Å; Y126-H129 WeakPolarHBondContact O-CB 3.4Å; Y126-H129 PolarHBondContact O-N 3.21Å; R127-H129 VanDerWaalsContact C-N 3.3Å; R127-H129 PolarHBondContact O-N 3.42Å; H129-A131 VanDerWaalsContact C-N 3.28Å; H129-A131 PolarHBondContact O-N 3.13Å; H129-R132 PolarHBondContact O-N 2.97Å; H129-E133 VanDerWaalsContact CE1-CG 3.49Å; H129-E133 WeakPolarHBondContact CE1-CG 3.47Å; H129-E133 PolarHBondContact O-N 3.21Å; H129-E133 VanDerWaalsContact O-N 3.08Å
130	Q	93.4	Very high	94	Very high	97 Å²	97	83.9 Å²	83.9	45%	0.453	41%	0.405	S	S	.	.	H	α-helix	trans	-56	-41.8	176.7	-173.6	-175.5	8.5	0	0	112.4	Y126 R127 E133 T134	Y126-Q130 PolarHBondContact O-N 3.32Å; R127-Q130 WeakPolarHBondContact O-CB 3.05Å; R127-Q130 PolarHBondContact O-N 3.22Å; Q130-E133 PolarHBondContact O-N 3.3Å; Q130-T134 WeakPolarHBondContact O-CB 3.47Å; Q130-T134 PolarHBondContact O-N 3.19Å; Q130-T134 PolarHBondContact O-OG1 3.34Å
131	A	95.6	Very high	94.3	Very high	61 Å²	61	80.8 Å²	80.8	50%	0.504	39%	0.394	S	S	.	.	H	α-helix	trans	-63.4	-43.3	178.3	0	0	0	0	0	112.2	R127 P128 H129 T134 L135	R127-A131 PolarHBondContact O-N 2.88Å; P128-A131 PolarHBondContact O-N 2.85Å; H129-A131 VanDerWaalsContact C-N 3.28Å; H129-A131 PolarHBondContact O-N 3.13Å; A131-T134 PolarHBondContact O-N 3.01Å; A131-L135 WeakPolarHBondContact O-CB 3.45Å; A131-L135 PolarHBondContact O-N 2.96Å
132	R	97.1	Very high	94.8	Very high	151 Å²	151	84 Å²	84	57%	0.57	41%	0.41	S	S	*	.	H	α-helix	trans	-62.1	-45.4	176.3	-70.9	-173.7	-61.4	-101.2	10.2	112.4	P128 H129 T134 L135 R136	P128-R132 WeakPolarHBondContact O-CG 3.3Å; P128-R132 PolarHBondContact O-N 2.86Å; P128-R132 VanDerWaalsContact O-N 3.16Å; H129-R132 PolarHBondContact O-N 2.97Å; R132-T134 VanDerWaalsContact C-N 3.34Å; R132-T134 PolarHBondContact O-N 3.11Å; R132-L135 PolarHBondContact O-N 3.32Å; R132-R136 PolarHBondContact O-N 3.5Å
133	E	97.1	Very high	95.2	Very high	64 Å²	64	90.7 Å²	90.7	30%	0.299	44%	0.438	S	S	.	.	H	α-helix	trans	-66	-37.5	177.7	-65	-55.6	107.6	0	0	112.1	H129 Q130 L135 R136 V137	H129-E133 VanDerWaalsContact CE1-CG 3.49Å; H129-E133 WeakPolarHBondContact CE1-CG 3.47Å; H129-E133 PolarHBondContact O-N 3.21Å; H129-E133 VanDerWaalsContact O-N 3.08Å; Q130-E133 PolarHBondContact O-N 3.3Å; E133-L135 VanDerWaalsContact C-N 3.35Å; E133-L135 PolarHBondContact O-N 2.92Å; E133-R136 PolarHBondContact O-N 3.28Å; E133-R136 IonicContact OE1-CZ 2.68Å; E133-R136 IonicContact OE1-NH1 3.72Å; E133-R136 PolarHBondContact OE1-NH1 3.36Å; E133-R136 IonicContact OE1-NH2 2.98Å; E133-R136 PolarHBondContact OE1-NH2 3.35Å; E133-R136 IonicContact OE2-CZ 2.68Å; E133-R136 IonicContact OE2-NH1 3.42Å; E133-R136 PolarHBondContact OE2-NH1 2.97Å; E133-V137 WeakPolarHBondContact O-CG2 3.42Å; E133-V137 PolarHBondContact O-N 3.37Å
134	T	97.9	Very high	95.5	Very high	87 Å²	87	93.6 Å²	93.6	53%	0.534	45%	0.445	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175	-57.3	0	0	0	0	111.1	Q130 A131 R132 M138	Q130-T134 WeakPolarHBondContact O-CB 3.47Å; Q130-T134 PolarHBondContact O-N 3.19Å; Q130-T134 PolarHBondContact O-OG1 3.34Å; A131-T134 PolarHBondContact O-N 3.01Å; R132-T134 VanDerWaalsContact C-N 3.34Å; R132-T134 PolarHBondContact O-N 3.11Å; T134-M138 WeakPolarHBondContact O-CB 3.41Å; T134-M138 PolarHBondContact O-N 2.87Å
135	L	98.3	Very high	95.9	Very high	87 Å²	87	95.6 Å²	95.6	46%	0.455	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-43	175	177.3	57.9	0	0	0	111.8	A131 R132 E133 M138 M139	A131-L135 WeakPolarHBondContact O-CB 3.45Å; A131-L135 PolarHBondContact O-N 2.96Å; R132-L135 PolarHBondContact O-N 3.32Å; E133-L135 VanDerWaalsContact C-N 3.35Å; E133-L135 PolarHBondContact O-N 2.92Å; L135-M138 HydrophobicContact CD1-CE 3.5Å; L135-M138 VanDerWaalsContact CD1-CE 3.5Å; L135-M138 PolarHBondContact O-N 3.33Å; L135-M139 HydrophobicContact CD1-CG 4.19Å; L135-M139 HydrophobicContact CD1-SD 4.27Å; L135-M139 HydrophobicContact CG-CE 4.07Å; L135-M139 HydrophobicContact CG-SD 4.4Å; L135-M139 WeakPolarHBondContact O-CG 3.37Å; L135-M139 PolarHBondContact O-N 3.03Å
136	R	98.2	Very high	96.4	Very high	128 Å²	128	101.7 Å²	101.7	48%	0.483	47%	0.473	S	S	.	.	H	α-helix	trans	-55.7	-55.1	174.8	-178.4	-174.7	-70.1	149.7	0.9	111.2	R132 E133 M138 M139 E140	R132-R136 PolarHBondContact O-N 3.5Å; E133-R136 PolarHBondContact O-N 3.28Å; E133-R136 IonicContact OE1-CZ 2.68Å; E133-R136 IonicContact OE1-NH1 3.72Å; E133-R136 PolarHBondContact OE1-NH1 3.36Å; E133-R136 IonicContact OE1-NH2 2.98Å; E133-R136 PolarHBondContact OE1-NH2 3.35Å; E133-R136 IonicContact OE2-CZ 2.68Å; E133-R136 IonicContact OE2-NH1 3.42Å; E133-R136 PolarHBondContact OE2-NH1 2.97Å; R136-M138 VanDerWaalsContact C-N 3.3Å; R136-M138 PolarHBondContact O-N 2.96Å; R136-M139 PolarHBondContact O-N 2.75Å; R136-M139 VanDerWaalsContact O-N 3.11Å; R136-E140 WeakPolarHBondContact CG-OE1 3.38Å; R136-E140 WeakPolarHBondContact O-CG 3.48Å; R136-E140 PolarHBondContact O-N 3.48Å
137	V	98.4	Very high	96.8	Very high	81 Å²	81	101.6 Å²	101.6	49%	0.491	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-39.4	179.5	174	0	0	0	0	111.5	E133 M139 E140 V141	E133-V137 WeakPolarHBondContact O-CG2 3.42Å; E133-V137 PolarHBondContact O-N 3.37Å; V137-M139 PolarHBondContact O-N 3.38Å; V137-E140 PolarHBondContact O-N 3.02Å; V137-V141 WeakPolarHBondContact O-CG2 3.4Å; V137-V141 PolarHBondContact O-N 3.36Å
138	M	97.8	Very high	97.1	Very high	96 Å²	96	98.5 Å²	98.5	47%	0.473	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-43.4	175.3	-178	176.2	62.1	0	0	112.2	T134 L135 R136 V141 Q142	T134-M138 WeakPolarHBondContact O-CB 3.41Å; T134-M138 PolarHBondContact O-N 2.87Å; L135-M138 HydrophobicContact CD1-CE 3.5Å; L135-M138 VanDerWaalsContact CD1-CE 3.5Å; L135-M138 PolarHBondContact O-N 3.33Å; R136-M138 VanDerWaalsContact C-N 3.3Å; R136-M138 PolarHBondContact O-N 2.96Å; M138-V141 PolarHBondContact O-N 2.97Å; M138-Q142 WeakPolarHBondContact O-CG 3.42Å; M138-Q142 PolarHBondContact O-N 3.49Å
139	M	98.3	Very high	97.4	Very high	102 Å²	102	98.9 Å²	98.9	50%	0.502	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-36.8	177.6	-68.7	-174.4	-58.5	0	0	112.4	L135 R136 V137 Q142 K143	L135-M139 HydrophobicContact CD1-CG 4.19Å; L135-M139 HydrophobicContact CD1-SD 4.27Å; L135-M139 HydrophobicContact CG-CE 4.07Å; L135-M139 HydrophobicContact CG-SD 4.4Å; L135-M139 WeakPolarHBondContact O-CG 3.37Å; L135-M139 PolarHBondContact O-N 3.03Å; R136-M139 PolarHBondContact O-N 2.75Å; R136-M139 VanDerWaalsContact O-N 3.11Å; V137-M139 PolarHBondContact O-N 3.38Å; M139-Q142 PolarHBondContact O-N 3.31Å; M139-K143 WeakPolarHBondContact O-CB 3.39Å; M139-K143 PolarHBondContact O-N 2.99Å
140	E	98.3	Very high	97.7	Very high	113 Å²	113	98.4 Å²	98.4	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-43.5	173	-72.6	171.3	-171	0	0	112	R136 V137 K143 R144	R136-E140 WeakPolarHBondContact CG-OE1 3.38Å; R136-E140 WeakPolarHBondContact O-CG 3.48Å; R136-E140 PolarHBondContact O-N 3.48Å; V137-E140 PolarHBondContact O-N 3.02Å; E140-K143 PolarHBondContact O-N 3.2Å; E140-R144 WeakPolarHBondContact O-CB 3.42Å; E140-R144 PolarHBondContact O-N 2.93Å
141	V	98.3	Very high	97.9	Very high	51 Å²	51	98.7 Å²	98.7	31%	0.309	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174.5	171.1	0	0	0	0	111.2	V137 M138 R144 Q145	V137-V141 WeakPolarHBondContact O-CG2 3.4Å; V137-V141 PolarHBondContact O-N 3.36Å; M138-V141 PolarHBondContact O-N 2.97Å; V141-R144 PolarHBondContact O-N 2.91Å; V141-Q145 HydrophobicContact CG1-CG 4.46Å; V141-Q145 WeakPolarHBondContact O-CG 3.4Å; V141-Q145 PolarHBondContact O-N 3.18Å
142	Q	98.1	Very high	98	Very high	83 Å²	83	103.9 Å²	103.9	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-62.8	-43	176.4	-70.5	179.5	22.8	0	0	112.3	M138 M139 Q145 R146	M138-Q142 WeakPolarHBondContact O-CG 3.42Å; M138-Q142 PolarHBondContact O-N 3.49Å; M139-Q142 PolarHBondContact O-N 3.31Å; Q142-Q145 PolarHBondContact O-N 3.08Å; Q142-R146 WeakPolarHBondContact O-CG 3.48Å; Q142-R146 PolarHBondContact O-N 3.37Å
143	K	98.3	Very high	98.1	Very high	144 Å²	144	103.8 Å²	103.8	63%	0.626	49%	0.492	S	S	*	.	H	α-helix	trans	-58.5	-48.6	175	178.5	-178.3	176.7	-179	0	110.8	M139 E140 R146 L147	M139-K143 WeakPolarHBondContact O-CB 3.39Å; M139-K143 PolarHBondContact O-N 2.99Å; E140-K143 PolarHBondContact O-N 3.2Å; K143-R146 PolarHBondContact O-N 3.32Å; K143-L147 HydrophobicContact CG-CD1 4.21Å; K143-L147 WeakPolarHBondContact O-CG 3.42Å; K143-L147 PolarHBondContact O-N 2.9Å; K143-L147 VanDerWaalsContact O-N 3.08Å
144	R	98.3	Very high	98.1	Very high	129 Å²	129	105.3 Å²	105.3	49%	0.487	50%	0.499	S	S	.	.	H	α-helix	trans	-60.5	-47.5	178.5	179.2	172.1	61.7	83.1	-4.3	111.8	E140 V141 R146 L147 E148	E140-R144 WeakPolarHBondContact O-CB 3.42Å; E140-R144 PolarHBondContact O-N 2.93Å; V141-R144 PolarHBondContact O-N 2.91Å; R144-R146 VanDerWaalsContact C-N 3.32Å; R144-R146 PolarHBondContact O-N 3.04Å; R144-L147 PolarHBondContact O-N 3.43Å; R144-E148 WeakPolarHBondContact CD-OE1 3.39Å; R144-E148 HydrophobicContact CG-CG 4.3Å; R144-E148 WeakPolarHBondContact CG-OE1 3.34Å; R144-E148 IonicContact CZ-OE1 2.71Å; R144-E148 IonicContact NE-OE1 3.51Å; R144-E148 IonicContact NH1-OE1 2.59Å; R144-E148 PolarHBondContact NH1-OE1 2.59Å; R144-E148 IonicContact NH1-OE2 3.7Å; R144-E148 WeakPolarHBondContact O-CG 3.38Å; R144-E148 PolarHBondContact O-N 3.28Å
145	Q	98.3	Very high	98.1	Very high	103 Å²	103	106.1 Å²	106.1	48%	0.481	50%	0.495	S	S	.	.	H	α-helix	trans	-59	-40.6	177.2	-74.8	173.9	-11	0	0	112.7	V141 Q142 T149	V141-Q145 HydrophobicContact CG1-CG 4.46Å; V141-Q145 WeakPolarHBondContact O-CG 3.4Å; V141-Q145 PolarHBondContact O-N 3.18Å; Q142-Q145 PolarHBondContact O-N 3.08Å; Q145-T149 VanDerWaalsContact O-CB 3.27Å; Q145-T149 WeakPolarHBondContact O-CB 3.14Å; Q145-T149 PolarHBondContact O-N 2.82Å; Q145-T149 PolarHBondContact O-OG1 2.92Å
146	R	98	Very high	98	Very high	186 Å²	186	107 Å²	107	70%	0.702	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-43.1	175.5	-72.7	178.8	-176.7	-171.2	3	112.1	Q142 K143 R144 T149 A150	Q142-R146 WeakPolarHBondContact O-CG 3.48Å; Q142-R146 PolarHBondContact O-N 3.37Å; K143-R146 PolarHBondContact O-N 3.32Å; R144-R146 VanDerWaalsContact C-N 3.32Å; R144-R146 PolarHBondContact O-N 3.04Å; R146-T149 PolarHBondContact O-N 3.13Å; R146-A150 WeakPolarHBondContact O-CB 3.49Å; R146-A150 PolarHBondContact O-N 2.94Å
147	L	98.3	Very high	98	Very high	110 Å²	110	105.7 Å²	105.7	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-48.3	177.5	-68.8	171.3	0	0	0	111.9	K143 R144 T149 A150 E151	K143-L147 HydrophobicContact CG-CD1 4.21Å; K143-L147 WeakPolarHBondContact O-CG 3.42Å; K143-L147 PolarHBondContact O-N 2.9Å; K143-L147 VanDerWaalsContact O-N 3.08Å; R144-L147 PolarHBondContact O-N 3.43Å; L147-T149 PolarHBondContact O-N 2.93Å; L147-A150 PolarHBondContact O-N 3.35Å; L147-E151 WeakPolarHBondContact O-CB 3.43Å; L147-E151 PolarHBondContact O-N 2.71Å
148	E	98.2	Very high	97.9	Very high	66 Å²	66	106 Å²	106	31%	0.308	50%	0.495	S	S	.	.	H	α-helix	trans	-58	-36.1	175	-72.2	174.4	-162.5	0	0	111.9	R144 R152	R144-E148 WeakPolarHBondContact CD-OE1 3.39Å; R144-E148 HydrophobicContact CG-CG 4.3Å; R144-E148 WeakPolarHBondContact CG-OE1 3.34Å; R144-E148 IonicContact CZ-OE1 2.71Å; R144-E148 IonicContact NE-OE1 3.51Å; R144-E148 IonicContact NH1-OE1 2.59Å; R144-E148 PolarHBondContact NH1-OE1 2.59Å; R144-E148 IonicContact NH1-OE2 3.7Å; R144-E148 WeakPolarHBondContact O-CG 3.38Å; R144-E148 PolarHBondContact O-N 3.28Å; E148-R152 VanDerWaalsContact O-CG 3.24Å; E148-R152 WeakPolarHBondContact O-CG 3.34Å; E148-R152 PolarHBondContact O-N 3.09Å; E148-R152 VanDerWaalsContact O-N 3.09Å
149	T	97.5	Very high	97.9	Very high	69 Å²	69	107.6 Å²	107.6	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-70.8	-44.8	177.3	-60.3	0	0	0	0	111.5	Q145 R146 L147 R152 F153	Q145-T149 VanDerWaalsContact O-CB 3.27Å; Q145-T149 WeakPolarHBondContact O-CB 3.14Å; Q145-T149 PolarHBondContact O-N 2.82Å; Q145-T149 PolarHBondContact O-OG1 2.92Å; R146-T149 PolarHBondContact O-N 3.13Å; L147-T149 PolarHBondContact O-N 2.93Å; T149-R152 PolarHBondContact O-N 3.22Å; T149-F153 HydrophobicContact CG2-CD2 3.81Å; T149-F153 HydrophobicContact CG2-CE2 3.57Å; T149-F153 VanDerWaalsContact O-CD2 3.23Å; T149-F153 WeakPolarHBondContact O-CD2 3.31Å; T149-F153 PolarHBondContact O-N 3.46Å
150	A	97.9	Very high	97.8	Very high	59 Å²	59	106.5 Å²	106.5	49%	0.488	49%	0.494	S	S	.	.	H	α-helix	trans	-61.9	-42.4	175.8	0	0	0	0	0	112	R146 L147 R152 F153 Q154	R146-A150 WeakPolarHBondContact O-CB 3.49Å; R146-A150 PolarHBondContact O-N 2.94Å; L147-A150 PolarHBondContact O-N 3.35Å; A150-R152 VanDerWaalsContact C-N 3.35Å; A150-R152 PolarHBondContact O-N 2.97Å; A150-F153 PolarHBondContact O-N 3.28Å; A150-Q154 PolarHBondContact O-N 2.71Å
151	E	98.1	Very high	97.7	Very high	102 Å²	102	104.1 Å²	104.1	48%	0.477	49%	0.488	S	S	.	.	H	α-helix	trans	-61.9	-40.5	175.2	-167.2	-163.8	160.5	0	0	112	L147 Q154 K155	L147-E151 WeakPolarHBondContact O-CB 3.43Å; L147-E151 PolarHBondContact O-N 2.71Å; E151-Q154 PolarHBondContact O-N 3.38Å; E151-K155 HydrophobicContact CG-CD 4.41Å; E151-K155 WeakPolarHBondContact O-CG 3.23Å; E151-K155 PolarHBondContact O-N 2.98Å; E151-K155 VanDerWaalsContact OE1-CE 3.31Å; E151-K155 WeakPolarHBondContact OE1-CE 3.27Å; E151-K155 IonicContact OE1-NZ 2.67Å; E151-K155 PolarHBondContact OE1-NZ 2.8Å
152	R	97.9	Very high	97.6	Very high	170 Å²	170	106.8 Å²	106.8	64%	0.642	50%	0.497	S	S	*	.	H	α-helix	trans	-63.2	-43.6	173.4	-73.8	171.5	-170.3	-144.8	5.4	111.9	E148 T149 A150 K155 H156	E148-R152 VanDerWaalsContact O-CG 3.24Å; E148-R152 WeakPolarHBondContact O-CG 3.34Å; E148-R152 PolarHBondContact O-N 3.09Å; E148-R152 VanDerWaalsContact O-N 3.09Å; T149-R152 PolarHBondContact O-N 3.22Å; A150-R152 VanDerWaalsContact C-N 3.35Å; A150-R152 PolarHBondContact O-N 2.97Å; R152-K155 PolarHBondContact O-N 3Å; R152-H156 PolarHBondContact O-CD2 3.31Å; R152-H156 PolarHBondContact O-N 3.37Å
153	F	97.7	Very high	97.5	Very high	150 Å²	150	108.9 Å²	108.9	66%	0.658	51%	0.508	S	S	*	.	H	α-helix	trans	-61.4	-43.1	175.6	-83.4	-64.8	0	0	0	111.9	T149 A150 H156 L157	T149-F153 HydrophobicContact CG2-CD2 3.81Å; T149-F153 HydrophobicContact CG2-CE2 3.57Å; T149-F153 VanDerWaalsContact O-CD2 3.23Å; T149-F153 WeakPolarHBondContact O-CD2 3.31Å; T149-F153 PolarHBondContact O-N 3.46Å; A150-F153 PolarHBondContact O-N 3.28Å; F153-H156 WeakPolarHBondContact O-CB 3.39Å; F153-H156 PolarHBondContact O-N 2.92Å; F153-H156 VanDerWaalsContact O-N 3.11Å; F153-L157 PolarHBondContact O-N 3.35Å
154	Q	97.2	Very high	97.3	Very high	96 Å²	96	106.6 Å²	106.6	45%	0.449	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-48.4	176.6	-175.7	58.1	32.8	0	0	111.7	A150 E151 H156 L157 E158	A150-Q154 PolarHBondContact O-N 2.71Å; E151-Q154 PolarHBondContact O-N 3.38Å; Q154-H156 PolarHBondContact O-N 2.94Å; Q154-L157 WeakPolarHBondContact O-CB 3.24Å; Q154-L157 PolarHBondContact O-N 3.32Å; Q154-L157 VanDerWaalsContact O-N 3.12Å; Q154-E158 WeakPolarHBondContact CG-OE1 3.42Å; Q154-E158 PolarHBondContact NE2-OE1 2.94Å; Q154-E158 WeakPolarHBondContact O-CG 3.4Å; Q154-E158 PolarHBondContact O-N 3.11Å
155	K	97.9	Very high	97.1	Very high	103 Å²	103	106 Å²	106	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-18.8	174.7	-72.2	172.7	173.5	174.1	0	114.6	E151 R152 R159	E151-K155 HydrophobicContact CG-CD 4.41Å; E151-K155 WeakPolarHBondContact O-CG 3.23Å; E151-K155 PolarHBondContact O-N 2.98Å; E151-K155 VanDerWaalsContact OE1-CE 3.31Å; E151-K155 WeakPolarHBondContact OE1-CE 3.27Å; E151-K155 IonicContact OE1-NZ 2.67Å; E151-K155 PolarHBondContact OE1-NZ 2.8Å; R152-K155 PolarHBondContact O-N 3Å; K155-R159 PolarHBondContact O-NE 3.4Å; K155-R159 VanDerWaalsContact O-NE 3.08Å
156	H	97.4	Very high	96.9	Very high	105 Å²	105	106.4 Å²	106.4	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-83.1	-42.4	171.9	-81.4	-134.4	0	0	0	110.6	R152 F153 Q154 R159 V160	R152-H156 PolarHBondContact O-CD2 3.31Å; R152-H156 PolarHBondContact O-N 3.37Å; F153-H156 WeakPolarHBondContact O-CB 3.39Å; F153-H156 PolarHBondContact O-N 2.92Å; F153-H156 VanDerWaalsContact O-N 3.11Å; Q154-H156 PolarHBondContact O-N 2.94Å; H156-R159 PolarHBondContact CD2-NH2 2.74Å; H156-R159 PolarHBondContact NE2-NH2 3.32Å; H156-R159 PolarHBondContact O-N 3.04Å; H156-V160 WeakPolarHBondContact O-CG2 3.37Å; H156-V160 PolarHBondContact O-N 3.12Å; H156-V160 VanDerWaalsContact O-N 3.09Å
157	L	97.1	Very high	96.6	Very high	102 Å²	102	101.3 Å²	101.3	53%	0.534	50%	0.502	S	S	.	.	H	α-helix	trans	-59.1	-49.3	175.3	-171.5	80.8	0	0	0	111.1	F153 Q154 R159 V160 V161	F153-L157 PolarHBondContact O-N 3.35Å; Q154-L157 WeakPolarHBondContact O-CB 3.24Å; Q154-L157 PolarHBondContact O-N 3.32Å; Q154-L157 VanDerWaalsContact O-N 3.12Å; L157-R159 PolarHBondContact O-N 2.67Å; L157-V160 PolarHBondContact O-N 2.95Å; L157-V160 VanDerWaalsContact O-N 3.09Å; L157-V161 WeakPolarHBondContact O-CG2 3.49Å; L157-V161 PolarHBondContact O-N 3.02Å
158	E	97	Very high	96.2	Very high	88 Å²	88	101.5 Å²	101.5	41%	0.411	50%	0.503	S	S	.	.	H	α-helix	trans	-55.4	-49.7	179.4	-74.2	160.6	-177	0	0	111.6	Q154 V160 V161 E162	Q154-E158 WeakPolarHBondContact CG-OE1 3.42Å; Q154-E158 PolarHBondContact NE2-OE1 2.94Å; Q154-E158 WeakPolarHBondContact O-CG 3.4Å; Q154-E158 PolarHBondContact O-N 3.11Å; E158-V160 VanDerWaalsContact C-N 3.33Å; E158-V160 PolarHBondContact O-N 2.9Å; E158-V161 PolarHBondContact O-N 3.41Å; E158-E162 WeakPolarHBondContact O-CG 3.33Å; E158-E162 PolarHBondContact O-N 3.08Å
159	R	97	Very high	95.7	Very high	129 Å²	129	102.5 Å²	102.5	49%	0.487	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-36.8	175.3	-82.2	-175.7	-71.1	134.4	-10	113.7	K155 H156 L157 M163	K155-R159 PolarHBondContact O-NE 3.4Å; K155-R159 VanDerWaalsContact O-NE 3.08Å; H156-R159 PolarHBondContact CD2-NH2 2.74Å; H156-R159 PolarHBondContact NE2-NH2 3.32Å; H156-R159 PolarHBondContact O-N 3.04Å; L157-R159 PolarHBondContact O-N 2.67Å; R159-M163 WeakPolarHBondContact O-CB 3.42Å; R159-M163 VanDerWaalsContact O-CG 3.24Å; R159-M163 WeakPolarHBondContact O-CG 3.41Å; R159-M163 PolarHBondContact O-N 3.49Å
160	V	97.4	Very high	95.2	Very high	78 Å²	78	103.5 Å²	103.5	47%	0.473	53%	0.532	S	S	.	.	H	α-helix	trans	-67.9	-40.4	176.2	170.1	0	0	0	0	110.7	H156 L157 E158 M163 I164	H156-V160 WeakPolarHBondContact O-CG2 3.37Å; H156-V160 PolarHBondContact O-N 3.12Å; H156-V160 VanDerWaalsContact O-N 3.09Å; L157-V160 PolarHBondContact O-N 2.95Å; L157-V160 VanDerWaalsContact O-N 3.09Å; E158-V160 VanDerWaalsContact C-N 3.33Å; E158-V160 PolarHBondContact O-N 2.9Å; V160-M163 PolarHBondContact O-N 3.21Å; V160-I164 HydrophobicContact CG1-CD1 3.86Å; V160-I164 VanDerWaalsContact O-CG1 3.28Å; V160-I164 WeakPolarHBondContact O-CG1 3.43Å; V160-I164 PolarHBondContact O-N 3.11Å
161	V	96.2	Very high	94.4	Very high	64 Å²	64	106.3 Å²	106.3	39%	0.388	54%	0.538	S	S	.	.	H	α-helix	trans	-63.5	-46.7	175.1	172.1	0	0	0	0	111	L157 E158 M163 I164 Q165	L157-V161 WeakPolarHBondContact O-CG2 3.49Å; L157-V161 PolarHBondContact O-N 3.02Å; E158-V161 PolarHBondContact O-N 3.41Å; V161-M163 PolarHBondContact O-N 3.06Å; V161-I164 PolarHBondContact O-N 3Å; V161-Q165 HydrophobicContact CG1-CG 4.44Å; V161-Q165 WeakPolarHBondContact O-CB 3.24Å; V161-Q165 WeakPolarHBondContact O-CG 3.47Å; V161-Q165 PolarHBondContact O-N 2.93Å
162	E	96	Very high	93.2	Very high	107 Å²	107	106.5 Å²	106.5	50%	0.5	55%	0.548	S	S	.	.	H	α-helix	trans	-58.1	-45.6	174.1	-72.8	173.7	173.9	0	0	111.8	E158 I164 Q165 N166	E158-E162 WeakPolarHBondContact O-CG 3.33Å; E158-E162 PolarHBondContact O-N 3.08Å; E162-I164 PolarHBondContact O-N 3.03Å; E162-Q165 PolarHBondContact O-N 3.01Å; E162-N166 WeakPolarHBondContact O-CB 3.33Å; E162-N166 PolarHBondContact O-N 3.33Å; E162-N166 PolarHBondContact O-ND2 2.85Å
163	M	95.3	Very high	91.5	Very high	126 Å²	126	106.3 Å²	106.3	62%	0.621	56%	0.56	S	S	*	*	H	α-helix	trans	-59.6	-44.9	176.2	-77.1	177.4	64.9	0	0	112	R159 V160 V161 N166 C167	R159-M163 WeakPolarHBondContact O-CB 3.42Å; R159-M163 VanDerWaalsContact O-CG 3.24Å; R159-M163 WeakPolarHBondContact O-CG 3.41Å; R159-M163 PolarHBondContact O-N 3.49Å; V160-M163 PolarHBondContact O-N 3.21Å; V161-M163 PolarHBondContact O-N 3.06Å; M163-N166 PolarHBondContact O-N 3.39Å; M163-C167 WeakPolarHBondContact O-CB 3.45Å; M163-C167 PolarHBondContact O-N 3Å; M163-C167 PolarHBondContact O-SG 2.93Å
164	I	95	Very high	89.3	Confident	97 Å²	97	106.5 Å²	106.5	50%	0.497	57%	0.568	S	S	.	*	H	α-helix	trans	-64.1	-44.6	178	-69.1	165.3	0	0	0	110.8	V160 V161 E162 C167 L168	V160-I164 HydrophobicContact CG1-CD1 3.86Å; V160-I164 VanDerWaalsContact O-CG1 3.28Å; V160-I164 WeakPolarHBondContact O-CG1 3.43Å; V160-I164 PolarHBondContact O-N 3.11Å; V161-I164 PolarHBondContact O-N 3Å; E162-I164 PolarHBondContact O-N 3.03Å; I164-C167 PolarHBondContact O-N 3.2Å; I164-L168 HydrophobicContact CG2-CD1 3.98Å; I164-L168 HydrophobicContact CG2-CG 4.47Å; I164-L168 WeakPolarHBondContact O-CG 3.49Å; I164-L168 PolarHBondContact O-N 3.44Å
165	Q	93.6	Very high	87.2	Confident	117 Å²	117	108.9 Å²	108.9	55%	0.547	58%	0.583	S	S	.	*	H	α-helix	trans	-61.6	-43.7	177.3	-72.9	175.2	0	0	0	111.9	V161 E162 L168 A169	V161-Q165 HydrophobicContact CG1-CG 4.44Å; V161-Q165 WeakPolarHBondContact O-CB 3.24Å; V161-Q165 WeakPolarHBondContact O-CG 3.47Å; V161-Q165 PolarHBondContact O-N 2.93Å; E162-Q165 PolarHBondContact O-N 3.01Å; Q165-L168 PolarHBondContact O-N 2.87Å; Q165-A169 WeakPolarHBondContact O-CB 3.41Å; Q165-A169 PolarHBondContact O-N 2.91Å
166	N	93.6	Very high	84.7	Confident	111 Å²	111	109.5 Å²	109.5	59%	0.594	60%	0.598	S	S	*	*	H	α-helix	trans	-64.1	-41.6	176.4	-71.7	-33.5	0	0	0	112	E162 M163 A169 S170	E162-N166 WeakPolarHBondContact O-CB 3.33Å; E162-N166 PolarHBondContact O-N 3.33Å; E162-N166 PolarHBondContact O-ND2 2.85Å; M163-N166 PolarHBondContact O-N 3.39Å; N166-A169 PolarHBondContact O-N 3.26Å; N166-S170 WeakPolarHBondContact O-CB 3.32Å; N166-S170 PolarHBondContact O-N 3.15Å; N166-S170 VanDerWaalsContact O-N 3.08Å; N166-S170 PolarHBondContact O-OG 3.21Å
167	C	92.3	Very high	82.3	Confident	79 Å²	79	113.7 Å²	113.7	53%	0.534	62%	0.617	S	S	.	*	H	α-helix	trans	-61.6	-45.8	173.9	-73.6	0	0	0	0	111.8	M163 I164 A169 S170 L171	M163-C167 WeakPolarHBondContact O-CB 3.45Å; M163-C167 PolarHBondContact O-N 3Å; M163-C167 PolarHBondContact O-SG 2.93Å; I164-C167 PolarHBondContact O-N 3.2Å; C167-A169 PolarHBondContact O-N 3.47Å; C167-S170 PolarHBondContact O-N 3.14Å; C167-S170 VanDerWaalsContact O-N 3.14Å; C167-S170 PolarHBondContact O-OG 3.32Å; C167-L171 PolarHBondContact O-N 2.89Å
168	L	90.1	Very high	79.6	Confident	113 Å²	113	114.1 Å²	114.1	59%	0.592	63%	0.629	S	S	*	*	H	α-helix	trans	-61	-42.5	177.1	-72.5	169.5	0	0	0	112.2	I164 Q165 S170 L171	I164-L168 HydrophobicContact CG2-CD1 3.98Å; I164-L168 HydrophobicContact CG2-CG 4.47Å; I164-L168 WeakPolarHBondContact O-CG 3.49Å; I164-L168 PolarHBondContact O-N 3.44Å; Q165-L168 PolarHBondContact O-N 2.87Å; L168-S170 PolarHBondContact O-N 3.02Å; L168-L171 HydrophobicContact CD2-CD1 4.35Å; L168-L171 PolarHBondContact O-N 3.18Å
169	A	88.3	Confident	77	Confident	87 Å²	87	119.2 Å²	119.2	72%	0.719	65%	0.652	S	S	*	*	H	α-helix	trans	-69.6	-17.2	176.9	0	0	0	0	0	114	Q165 N166 C167	Q165-A169 WeakPolarHBondContact O-CB 3.41Å; Q165-A169 PolarHBondContact O-N 2.91Å; N166-A169 PolarHBondContact O-N 3.26Å; C167-A169 PolarHBondContact O-N 3.47Å
170	S	85.5	Confident	74.5	Confident	91 Å²	91	116 Å²	116	64%	0.636	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-6.8	178.2	72.5	0	0	0	0	114.4	N166 C167 L168	N166-S170 WeakPolarHBondContact O-CB 3.32Å; N166-S170 PolarHBondContact O-N 3.15Å; N166-S170 VanDerWaalsContact O-N 3.08Å; N166-S170 PolarHBondContact O-OG 3.21Å; C167-S170 PolarHBondContact O-N 3.14Å; C167-S170 VanDerWaalsContact O-N 3.14Å; C167-S170 PolarHBondContact O-OG 3.32Å; L168-S170 PolarHBondContact O-N 3.02Å
171	L	82.4	Confident	71.8	Confident	118 Å²	118	116.2 Å²	116.2	62%	0.618	68%	0.678	S	S	*	*	S	Bend	trans	-75.7	136	175	-70.2	167	0	0	0	110	C167 L168	C167-L171 PolarHBondContact O-N 2.89Å; L168-L171 HydrophobicContact CD2-CD1 4.35Å; L168-L171 PolarHBondContact O-N 3.18Å
172	P	72.4	Confident	69.4	Low	105 Å²	105	120.8 Å²	120.8	68%	0.682	70%	0.699	S	S	*	*			trans	-69.3	141.4	176.6	28.5	-33.7	0	0	0	111.3	D174	P172-D174 PolarHBondContact O-N 2.97Å
173	D	61.6	Low	66.8	Low	166 Å²	166	127 Å²	127	89%	0.888	72%	0.718	S	S	*	*	S	Bend	trans	-75.8	16.2	-174.9	-155.1	26.1	0	0	0	113.9	L175	D173-L175 VanDerWaalsContact C-N 3.31Å; D173-L175 PolarHBondContact O-N 3.39Å; D173-L175 VanDerWaalsContact O-N 3.08Å
174	D	53	Low	64.4	Low	155 Å²	155	127.2 Å²	127.2	83%	0.829	73%	0.726	S	S	*	*			trans	-87.1	66.2	-178.2	-78.2	-45.3	0	0	0	111.8	P172	P172-D174 PolarHBondContact O-N 2.97Å
175	L	53	Low	61.8	Low	146 Å²	146	130.1 Å²	130.1	76%	0.764	74%	0.735	S	S	*	*	S	Bend	trans	-117	124.8	159.4	-85.6	157.9	0	0	0	108.7	D173 H177	D173-L175 VanDerWaalsContact C-N 3.31Å; D173-L175 PolarHBondContact O-N 3.39Å; D173-L175 VanDerWaalsContact O-N 3.08Å; L175-H177 PolarHBondContact O-N 3.42Å
176	P	44.3	Very low	59.6	Low	116 Å²	116	129.2 Å²	129.2	75%	0.753	75%	0.748	S	S	*	*			trans	-61	135.9	179.7	26.3	-33.8	0	0	0	109.6	S178	P176-S178 PolarHBondContact O-N 3.09Å
177	H	46.8	Very low	56.9	Low	193 Å²	193	130.2 Å²	130.2	89%	0.894	75%	0.749	S	S	*	*			trans	-55.9	104.4	-172.3	-68.6	21.1	0	0	0	111.7	L175	L175-H177 PolarHBondContact O-N 3.42Å
178	S	40.8	Very low	54.5	Low	111 Å²	111	131.7 Å²	131.7	78%	0.776	76%	0.758	S	S	*	*			trans	-106.4	102.7	165.8	-175.5	0	0	0	0	107.5	P176 G180	P176-S178 PolarHBondContact O-N 3.09Å; S178-G180 PolarHBondContact O-N 3.09Å
179	E	42.4	Very low	52.1	Low	194 Å²	194	134.6 Å²	134.6	91%	0.907	77%	0.77	S	S	*	*	S	Bend	trans	-43.5	107	176.1	-75.8	-80.7	117.9	0	0	111.3
180	G	43.5	Very low	49.7	Very low	63 Å²	63	137.9 Å²	137.9	65%	0.649	78%	0.776	S	S	*	*			trans	175.6	56.5	-169.7	0	0	0	0	0	112.7	S178 L182	S178-G180 PolarHBondContact O-N 3.09Å; G180-L182 PolarHBondContact O-N 3.49Å
181	G	42.6	Very low	48	Very low	82 Å²	82	139 Å²	139	85%	0.845	78%	0.779	S	S	*	*			trans	-60.7	90	-174.1	0	0	0	0	0	114	R183	G181-R183 PolarHBondContact O-N 3.37Å
182	L	44	Very low	46.2	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	79%	0.789	S	S	*	*			trans	-77.3	70.8	175.9	-161.5	74.3	0	0	0	110.7	G180 V184	G180-L182 PolarHBondContact O-N 3.49Å; L182-V184 PolarHBondContact O-N 2.89Å
183	R	41.8	Very low	44.6	Very low	237 Å²	237	143.1 Å²	143.1	89%	0.894	80%	0.796	S	S	*	*			trans	-60.9	107.1	163.4	-90	-173.7	167.2	-166.3	-3.4	108.4	G181 K185	G181-R183 PolarHBondContact O-N 3.37Å; R183-K185 VanDerWaalsContact C-N 3.29Å; R183-K185 PolarHBondContact O-N 3.34Å
184	V	44.7	Very low	43.7	Very low	132 Å²	132	137.9 Å²	137.9	80%	0.8	78%	0.781	S	S	*	*			trans	-63.5	96.1	163.5	179.6	0	0	0	0	107.3	L182 A186	L182-V184 PolarHBondContact O-N 2.89Å; V184-A186 PolarHBondContact O-N 3.46Å; V184-A186 VanDerWaalsContact O-N 3.11Å
185	K	41.7	Very low	42.6	Very low	157 Å²	157	136.9 Å²	136.9	68%	0.683	79%	0.786	S	S	*	*			trans	-62.7	109.4	163.9	-89.2	179	144.8	-157.3	0	107.2	R183 E187	R183-K185 VanDerWaalsContact C-N 3.29Å; R183-K185 PolarHBondContact O-N 3.34Å; K185-E187 HydrophobicContact CB-CG 3.85Å; K185-E187 HydrophobicContact CD-CG 4.19Å; K185-E187 WeakPolarHBondContact CD-OE1 3.28Å; K185-E187 WeakPolarHBondContact CE-OE1 3.37Å; K185-E187 IonicContact NZ-OE1 2.63Å; K185-E187 PolarHBondContact NZ-OE1 2.93Å; K185-E187 PolarHBondContact O-N 3.06Å
186	A	46.1	Very low	41.7	Very low	99 Å²	99	137 Å²	137	82%	0.818	79%	0.788	S	S	*	*			trans	-70.3	82.8	156.5	0	0	0	0	0	107.5	V184	V184-A186 PolarHBondContact O-N 3.46Å; V184-A186 VanDerWaalsContact O-N 3.11Å
187	E	37.6	Very low	40.8	Very low	132 Å²	132	137 Å²	137	62%	0.617	79%	0.789	S	S	*	*			trans	-74.1	134.5	166.5	-57	-147.3	140	0	0	107.9	K185	K185-E187 HydrophobicContact CB-CG 3.85Å; K185-E187 HydrophobicContact CD-CG 4.19Å; K185-E187 WeakPolarHBondContact CD-OE1 3.28Å; K185-E187 WeakPolarHBondContact CE-OE1 3.37Å; K185-E187 IonicContact NZ-OE1 2.63Å; K185-E187 PolarHBondContact NZ-OE1 2.93Å; K185-E187 PolarHBondContact O-N 3.06Å
188	P	42.9	Very low	40.2	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	79%	0.785	S	S	*	*			trans	-61.7	143.6	174.1	28.2	-33.9	0	0	0	109	D190	P188-D190 VanDerWaalsContact C-N 3.25Å; P188-D190 PolarHBondContact O-N 3.3Å
189	M	39.7	Very low	39.5	Very low	174 Å²	174	132.1 Å²	132.1	86%	0.857	78%	0.781	S	S	*	*			trans	-73	79.2	-179	-172	178.4	175.7	0	0	110.3	T191	M189-T191 HydrophobicContact CE-CG2 4.05Å; M189-T191 HydrophobicContact CG-CG2 4.22Å; M189-T191 PolarHBondContact O-N 2.88Å; M189-T191 VanDerWaalsContact O-N 3.13Å
190	D	37.8	Very low	38.9	Very low	155 Å²	155	132.1 Å²	132.1	83%	0.829	78%	0.781	S	S	*	*			trans	-64.8	108.3	166.3	-94.5	-40.4	0	0	0	108.6	P188	P188-D190 VanDerWaalsContact C-N 3.25Å; P188-D190 PolarHBondContact O-N 3.3Å
191	T	49	Very low	38.2	Very low	114 Å²	114	134.5 Å²	134.5	70%	0.699	79%	0.788	S	S	*	*			trans	-91.4	93.2	172.8	49.2	0	0	0	0	109.6	M189	M189-T191 HydrophobicContact CE-CG2 4.05Å; M189-T191 HydrophobicContact CG-CG2 4.22Å; M189-T191 PolarHBondContact O-N 2.88Å; M189-T191 VanDerWaalsContact O-N 3.13Å
192	D	44.5	Very low	37.8	Very low	156 Å²	156	137.2 Å²	137.2	83%	0.834	78%	0.779	S	S	*	*			trans	-154	160.9	155.4	-149.5	6.2	0	0	0	114.1
193	D	39.1	Very low	37.3	Very low	154 Å²	154	137.3 Å²	137.3	82%	0.824	77%	0.772	S	S	*	*			trans	71.4	129.3	175.8	-136.3	39.5	0	0	0	116.5
194	G	41.4	Very low	36.8	Very low	56 Å²	56	134.6 Å²	134.6	58%	0.577	77%	0.77	S	S	*	*			cis	143.3	105.2	0.1	0	0	0	0	0	110.5	N196	G194-N196 PolarHBondContact O-N 3.4Å
195	S	30.5	Very low	36.6	Very low	135 Å²	135	139.8 Å²	139.8	94%	0.944	78%	0.775	S	S	*	*			trans	-86.2	103.4	175.9	-168.4	0	0	0	0	109.9
196	N	34.8	Very low	36.3	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	78%	0.784	S	S	*	*			trans	-92.6	131.5	-176.1	-162.7	6.6	0	0	0	111.3	G194	G194-N196 PolarHBondContact O-N 3.4Å
197	C	25.4	Very low	35.8	Very low	116 Å²	116	146.1 Å²	146.1	78%	0.784	78%	0.781	S	S	*	*			trans	-99.9	95.4	169.9	-170.7	0	0	0	0	110
198	V	33.3	Very low	35.7	Very low	134 Å²	134	145.4 Å²	145.4	81%	0.812	79%	0.791	S	S	*	*	S	Bend	trans	49	113.3	154.4	-171.3	0	0	0	0	118.3
199	G	27.6	Very low	35.5	Very low	67 Å²	67	142.9 Å²	142.9	69%	0.691	79%	0.785	S	S	*	*			trans	146.2	96.9	150.8	0	0	0	0	0	116.7
200	Q	29.4	Very low	35.5	Very low	194 Å²	194	137.5 Å²	137.5	91%	0.907	76%	0.763	S	S	*	*			trans	-57.1	149.1	159.4	-64.6	164.8	-9.2	0	0	109.7
201	S	28.5	Very low	35.7	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	76%	0.756	S	S	*	*			cis	-160.9	-178.3	3.1	-105.2	0	0	0	0	107.3
202	E	34.8	Very low	35.4	Very low	140 Å²	140	142.1 Å²	142.1	65%	0.654	76%	0.761	S	S	*	*			cis	-156.4	170.5	16.9	-147.2	-156.2	155.9	0	0	110.9
203	K	33.1	Very low	35.5	Very low	161 Å²	161	140.2 Å²	140.2	70%	0.7	75%	0.75	S	S	*	*			trans	66	138.5	154.8	-80.1	168	-177.4	131.5	0	122.7
204	Q	31.9	Very low	36.2	Very low	180 Å²	180	136.9 Å²	136.9	84%	0.841	73%	0.73	S	S	*	*			trans	83.1	87	155.2	-114.5	157.6	-22.3	0	0	120.4
205	R	39.6	Very low	36.7	Very low	240 Å²	240	138.2 Å²	138.2	91%	0.906	73%	0.727	S	S	*	*			trans	-39.8	136.5	144.4	-82.2	172.2	161.4	170.2	-6.5	111.5
206	E	35.5	Very low	38.1	Very low	185 Å²	185	137.4 Å²	137.4	86%	0.864	71%	0.711	S	S	*	*			trans	152.2	65.3	148	-87.3	172.4	-156.3	0	0	112.2
207	R	34.8	Very low	39.8	Very low	205 Å²	205	136 Å²	136	77%	0.774	70%	0.704	S	S	*	*			trans	-161.4	20.3	173.6	-126.8	171.6	-176.5	-152.8	-1.8	120.9
208	S	36.4	Very low	42.1	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	69%	0.694	S	S	*	*	S	Bend	trans	-77.3	-31.4	-175.4	47.9	0	0	0	0	115.6
209	G	37.7	Very low	43.9	Very low	57 Å²	57	135.3 Å²	135.3	59%	0.588	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-34.1	-177.8	0	0	0	0	0	114.9	K211	G209-K211 VanDerWaalsContact C-N 3.3Å; G209-K211 PolarHBondContact O-N 2.63Å
210	C	39.5	Very low	46.2	Very low	60 Å²	60	134.6 Å²	134.6	41%	0.405	67%	0.669	S	S	.	*	H	α-helix	trans	-71.2	-18.4	-167.6	-162.6	0	0	0	0	114.6	Q214	C210-Q214 WeakPolarHBondContact O-CB 3.36Å; C210-Q214 VanDerWaalsContact O-CG 3.22Å; C210-Q214 WeakPolarHBondContact O-CG 3.41Å; C210-Q214 PolarHBondContact O-N 2.95Å; C210-Q214 PolarHBondContact SG-NE2 3.05Å
211	K	43.8	Very low	48.2	Very low	157 Å²	157	127.8 Å²	127.8	68%	0.683	65%	0.646	S	S	*	*	H	α-helix	trans	-75.2	-26.6	-174.7	-75	-176.1	176.8	179.2	0	114.4	G209 V215	G209-K211 VanDerWaalsContact C-N 3.3Å; G209-K211 PolarHBondContact O-N 2.63Å; K211-V215 WeakPolarHBondContact O-CG2 3.24Å
212	R	41.7	Very low	50.4	Low	210 Å²	210	128.2 Å²	128.2	79%	0.792	64%	0.637	S	S	*	*	H	α-helix	trans	-82.2	-41.3	-173.7	-158	173.8	-74.8	171.1	-3	111.4	V215	R212-V215 PolarHBondContact O-N 3.19Å
213	D	46.6	Very low	52.2	Low	115 Å²	115	125.1 Å²	125.1	62%	0.615	63%	0.63	S	S	*	*	H	α-helix	trans	-66.6	-39.7	173.7	-58.6	-32.1	0	0	0	111.7	V215 L216 D217	D213-V215 PolarHBondContact O-N 3.44Å; D213-V215 VanDerWaalsContact O-N 3.09Å; D213-L216 PolarHBondContact O-N 2.96Å; D213-L216 VanDerWaalsContact O-N 3.16Å; D213-D217 WeakPolarHBondContact O-CB 3.4Å; D213-D217 PolarHBondContact O-N 2.89Å
214	Q	53.5	Low	54.1	Low	84 Å²	84	120.8 Å²	120.8	39%	0.393	62%	0.62	S	S	.	*	H	α-helix	trans	-61.9	-14.7	175	-81.1	-177	19.3	0	0	115.4	C210 K218	C210-Q214 WeakPolarHBondContact O-CB 3.36Å; C210-Q214 VanDerWaalsContact O-CG 3.22Å; C210-Q214 WeakPolarHBondContact O-CG 3.41Å; C210-Q214 PolarHBondContact O-N 2.95Å; C210-Q214 PolarHBondContact SG-NE2 3.05Å; Q214-K218 VanDerWaalsContact O-CD 3.27Å; Q214-K218 WeakPolarHBondContact O-CD 3.15Å; Q214-K218 WeakPolarHBondContact O-CE 3.26Å; Q214-K218 VanDerWaalsContact O-CG 3.3Å; Q214-K218 WeakPolarHBondContact O-CG 3.37Å
215	V	53.4	Low	56.3	Low	85 Å²	85	117 Å²	117	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-86.4	-43.5	174.3	170.7	0	0	0	0	110.1	K211 R212 D213 D217 K218 D219	K211-V215 WeakPolarHBondContact O-CG2 3.24Å; R212-V215 PolarHBondContact O-N 3.19Å; D213-V215 PolarHBondContact O-N 3.44Å; D213-V215 VanDerWaalsContact O-N 3.09Å; V215-D217 VanDerWaalsContact C-N 3.35Å; V215-D217 PolarHBondContact O-N 3.14Å; V215-K218 PolarHBondContact O-N 3.05Å; V215-D219 PolarHBondContact O-N 2.88Å
216	L	59.7	Low	57.9	Low	117 Å²	117	110.5 Å²	110.5	61%	0.613	59%	0.587	S	S	*	*	H	α-helix	trans	-65.3	-37.9	177	-64.2	171.3	0	0	0	112.2	D213 K218 D219 A220	D213-L216 PolarHBondContact O-N 2.96Å; D213-L216 VanDerWaalsContact O-N 3.16Å; L216-K218 VanDerWaalsContact C-N 3.3Å; L216-K218 PolarHBondContact O-N 2.81Å; L216-D219 PolarHBondContact O-N 3.47Å; L216-A220 PolarHBondContact O-N 3.42Å
217	D	69.4	Low	59.6	Low	118 Å²	118	107.3 Å²	107.3	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-64.3	-32.7	178.8	-164.3	43.2	0	0	0	112.6	D213 V215 A221	D213-D217 WeakPolarHBondContact O-CB 3.4Å; D213-D217 PolarHBondContact O-N 2.89Å; V215-D217 VanDerWaalsContact C-N 3.35Å; V215-D217 PolarHBondContact O-N 3.14Å; D217-A221 WeakPolarHBondContact O-CB 3.3Å; D217-A221 PolarHBondContact O-N 2.89Å
218	K	73.7	Confident	61.3	Low	132 Å²	132	105.6 Å²	105.6	57%	0.574	58%	0.577	S	S	*	*	H	α-helix	trans	-74.1	-37.7	177	-72	172.5	-172.7	175.5	0	112.9	Q214 V215 L216 A220 A221 M222	Q214-K218 VanDerWaalsContact O-CD 3.27Å; Q214-K218 WeakPolarHBondContact O-CD 3.15Å; Q214-K218 WeakPolarHBondContact O-CE 3.26Å; Q214-K218 VanDerWaalsContact O-CG 3.3Å; Q214-K218 WeakPolarHBondContact O-CG 3.37Å; V215-K218 PolarHBondContact O-N 3.05Å; L216-K218 VanDerWaalsContact C-N 3.3Å; L216-K218 PolarHBondContact O-N 2.81Å; K218-A220 VanDerWaalsContact C-N 3.33Å; K218-A221 PolarHBondContact O-N 2.94Å; K218-M222 PolarHBondContact O-N 3.33Å
219	D	70.7	Confident	62.3	Low	104 Å²	104	107.8 Å²	107.8	56%	0.556	58%	0.576	S	S	*	*	H	α-helix	trans	-67.4	-38.1	174.8	-71.7	-7.7	0	0	0	110.5	V215 L216 M222 C223	V215-D219 PolarHBondContact O-N 2.88Å; L216-D219 PolarHBondContact O-N 3.47Å; D219-M222 PolarHBondContact O-N 2.93Å; D219-C223 PolarHBondContact O-N 2.94Å
220	A	76.3	Confident	62.6	Low	53 Å²	53	113.4 Å²	113.4	44%	0.438	60%	0.599	S	S	.	*	H	α-helix	trans	-63.8	-45.8	173.2	0	0	0	0	0	112.5	L216 K218 M222 C223 S224	L216-A220 PolarHBondContact O-N 3.42Å; K218-A220 VanDerWaalsContact C-N 3.33Å; A220-M222 VanDerWaalsContact C-N 3.32Å; A220-M222 PolarHBondContact O-N 3.32Å; A220-C223 WeakPolarHBondContact O-CB 3.33Å; A220-C223 PolarHBondContact O-N 3.43Å; A220-C223 VanDerWaalsContact O-N 3.14Å; A220-S224 PolarHBondContact O-N 3.43Å; A220-S224 VanDerWaalsContact O-N 3.11Å
221	A	72.7	Confident	63.8	Low	51 Å²	51	116.1 Å²	116.1	42%	0.421	61%	0.609	S	S	.	*	H	α-helix	trans	-61.7	-37.9	176.4	0	0	0	0	0	112.8	D217 K218 C223 S224 I225	D217-A221 WeakPolarHBondContact O-CB 3.3Å; D217-A221 PolarHBondContact O-N 2.89Å; K218-A221 PolarHBondContact O-N 2.94Å; A221-C223 VanDerWaalsContact C-N 3.34Å; A221-C223 PolarHBondContact O-N 3.08Å; A221-S224 PolarHBondContact O-N 3.32Å; A221-I225 VanDerWaalsContact O-CG1 3.31Å; A221-I225 WeakPolarHBondContact O-CG1 3.42Å; A221-I225 PolarHBondContact O-N 3.39Å; A221-I225 VanDerWaalsContact O-N 3.09Å
222	M	72.9	Confident	64.9	Low	121 Å²	121	113.9 Å²	113.9	60%	0.596	61%	0.605	S	S	*	*	H	α-helix	trans	-60.6	-39.8	172.6	-88	-86.3	-71.4	0	0	112.6	K218 D219 A220 I226	K218-M222 PolarHBondContact O-N 3.33Å; D219-M222 PolarHBondContact O-N 2.93Å; A220-M222 VanDerWaalsContact C-N 3.32Å; A220-M222 PolarHBondContact O-N 3.32Å; M222-I226 WeakPolarHBondContact O-CD1 3.48Å; M222-I226 WeakPolarHBondContact O-CG1 3.43Å; M222-I226 PolarHBondContact O-N 2.72Å
223	C	73.6	Confident	66.1	Low	76 Å²	76	108.6 Å²	108.6	51%	0.514	59%	0.594	S	S	.	*	H	α-helix	trans	-65.1	-47.2	175.2	-71.5	0	0	0	0	112	D219 A220 A221 I225 I226 D227	D219-C223 PolarHBondContact O-N 2.94Å; A220-C223 WeakPolarHBondContact O-CB 3.33Å; A220-C223 PolarHBondContact O-N 3.43Å; A220-C223 VanDerWaalsContact O-N 3.14Å; A221-C223 VanDerWaalsContact C-N 3.34Å; A221-C223 PolarHBondContact O-N 3.08Å; C223-I225 VanDerWaalsContact C-N 3.32Å; C223-I225 PolarHBondContact O-N 3.45Å; C223-I226 PolarHBondContact O-N 3.14Å; C223-I226 VanDerWaalsContact O-N 3.1Å; C223-D227 PolarHBondContact O-N 3.37Å
224	S	73.5	Confident	67.3	Low	70 Å²	70	108.2 Å²	108.2	49%	0.49	59%	0.593	S	S	.	*	H	α-helix	trans	-61.3	-38	179.5	-61.1	0	0	0	0	113.2	A220 A221 I226 D227 E228	A220-S224 PolarHBondContact O-N 3.43Å; A220-S224 VanDerWaalsContact O-N 3.11Å; A221-S224 PolarHBondContact O-N 3.32Å; S224-I226 VanDerWaalsContact C-N 3.31Å; S224-I226 PolarHBondContact O-N 3Å; S224-D227 PolarHBondContact O-N 3Å; S224-E228 PolarHBondContact O-N 3.08Å
225	I	77.1	Confident	68.2	Low	101 Å²	101	109.8 Å²	109.8	52%	0.518	61%	0.606	S	S	.	*	H	α-helix	trans	-64.6	-36.1	175.8	-68	164.7	0	0	0	111.4	A221 C223 M229	A221-I225 VanDerWaalsContact O-CG1 3.31Å; A221-I225 WeakPolarHBondContact O-CG1 3.42Å; A221-I225 PolarHBondContact O-N 3.39Å; A221-I225 VanDerWaalsContact O-N 3.09Å; C223-I225 VanDerWaalsContact C-N 3.32Å; C223-I225 PolarHBondContact O-N 3.45Å; I225-M229 WeakPolarHBondContact O-CG 3.34Å; I225-M229 PolarHBondContact O-N 3.34Å
226	I	74.1	Confident	69.1	Low	102 Å²	102	111.4 Å²	111.4	52%	0.523	61%	0.612	S	S	.	*	H	α-helix	trans	-71.2	-38.8	177.7	-68.9	167.5	0	0	0	111	M222 C223 S224 M229 T230	M222-I226 WeakPolarHBondContact O-CD1 3.48Å; M222-I226 WeakPolarHBondContact O-CG1 3.43Å; M222-I226 PolarHBondContact O-N 2.72Å; C223-I226 PolarHBondContact O-N 3.14Å; C223-I226 VanDerWaalsContact O-N 3.1Å; S224-I226 VanDerWaalsContact C-N 3.31Å; S224-I226 PolarHBondContact O-N 3Å; I226-M229 PolarHBondContact O-N 3.01Å; I226-T230 PolarHBondContact O-OG1 2.9Å
227	D	71.1	Confident	69.8	Low	118 Å²	118	111 Å²	111	63%	0.631	61%	0.612	S	S	*	*	H	α-helix	trans	-69.8	-30.1	178.1	-69.5	-23	0	0	0	112.5	C223 S224 M229	C223-D227 PolarHBondContact O-N 3.37Å; S224-D227 PolarHBondContact O-N 3Å; D227-M229 VanDerWaalsContact C-N 3.32Å
228	E	69.9	Low	69.8	Low	170 Å²	170	110.5 Å²	110.5	79%	0.794	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-11	173.9	-75	-172.3	165	0	0	114.5	S224	S224-E228 PolarHBondContact O-N 3.08Å
229	M	58.3	Low	69.5	Low	162 Å²	162	108.7 Å²	108.7	80%	0.798	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	11.5	178.8	-68.1	-170.2	97.5	0	0	114.1	I225 I226 D227	I225-M229 WeakPolarHBondContact O-CG 3.34Å; I225-M229 PolarHBondContact O-N 3.34Å; I226-M229 PolarHBondContact O-N 3.01Å; D227-M229 VanDerWaalsContact C-N 3.32Å
230	T	44.3	Very low	69.4	Low	176 Å²	176	109.1 Å²	109.1	100%	1.08	62%	0.618	S	S	*	*			trans	-118.8	0	-177.9	-51.7	0	0	0	0	112.4	I226	I226-T230 PolarHBondContact O-OG1 2.9Å

Retrieved 230 of 230 residues in 108.9 ms (Link to these results)

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