A0A087YQF1_POEFO Loading...

STING ER exit protein

Molecular adapter that stimulates membrane curvature formation and subsequent endoplasmic reticulum exit site (ERES) establishment by recruiting PI3K complex I, leading to COPII vesicle-mediated transport. Promotes endoplasmic reticulum (ER) exit of cGAMP-activated STING1 oligomers.

AlphaFold DB , UniProt , Accession A0A087YQF1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 225 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.8	Low	52.8	Low	238 Å²	238	149.4 Å²	149.4	100%	1.172	83%	0.834	S	S	*	*				0	117.2	0	-74.9	175.2	153.8	0	0	108.4
2	P	46.8	Very low	52.4	Low	127 Å²	127	144.7 Å²	144.7	83%	0.825	82%	0.818	S	S	*	*			trans	-77.2	130.5	177.3	30.3	-27.1	0	0	0	109.2	V4	P2-V4 PolarHBondContact O-N 3.48Å
3	K	49.9	Very low	51.8	Low	200 Å²	200	142 Å²	142	87%	0.87	80%	0.801	S	S	*	*			trans	-72.8	112.7	179.6	-76.7	179.7	175.9	170.9	0	109.4	V5	K3-V5 PolarHBondContact O-N 3.22Å
4	V	61	Low	52	Low	138 Å²	138	140.6 Å²	140.6	84%	0.836	80%	0.797	S	S	*	*			trans	-73.2	119	168.8	171.6	0	0	0	0	108	P2	P2-V4 PolarHBondContact O-N 3.48Å
5	V	51.3	Low	52	Low	117 Å²	117	144.2 Å²	144.2	71%	0.709	79%	0.793	S	S	*	*			trans	-109.4	105.7	171.5	-173.8	0	0	0	0	107.4	K3 R7	K3-V5 PolarHBondContact O-N 3.22Å; V5-R7 PolarHBondContact O-N 3.33Å
6	S	51.3	Low	51.4	Low	111 Å²	111	143.8 Å²	143.8	78%	0.776	79%	0.789	S	S	*	*			trans	-77.2	111.6	173	52.8	0	0	0	0	109.4
7	R	58.5	Low	51.2	Low	228 Å²	228	148.9 Å²	148.9	86%	0.86	79%	0.794	S	S	*	*			trans	-89.9	111.1	166.8	-73.9	-178.4	160.1	-172.1	-5.7	108.3	V5 V9	V5-R7 PolarHBondContact O-N 3.33Å; R7-V9 PolarHBondContact O-N 3.45Å
8	S	50.4	Low	51.3	Low	112 Å²	112	149.4 Å²	149.4	78%	0.783	79%	0.791	S	S	*	*			trans	-70.7	111.4	168.1	51.9	0	0	0	0	108.6	V10	S8-V10 PolarHBondContact O-N 2.81Å
9	V	59.4	Low	51.2	Low	132 Å²	132	150.8 Å²	150.8	80%	0.8	79%	0.793	S	S	*	*			trans	-78.7	114	169.2	179.8	0	0	0	0	106.9	R7 C11	R7-V9 PolarHBondContact O-N 3.45Å; V9-C11 PolarHBondContact O-N 2.84Å
10	V	51.7	Low	50.8	Low	121 Å²	121	153.6 Å²	153.6	73%	0.733	79%	0.794	S	S	*	*			trans	-71.8	109	171	177	0	0	0	0	107	S8 S12	S8-V10 PolarHBondContact O-N 2.81Å; V10-S12 VanDerWaalsContact C-N 3.3Å; V10-S12 PolarHBondContact O-N 2.86Å
11	C	48.4	Very low	50.7	Low	119 Å²	119	153.9 Å²	153.9	80%	0.804	80%	0.796	S	S	*	*			trans	-70.6	90.9	164.1	-103.6	0	0	0	0	107.5	V9 D13	V9-C11 PolarHBondContact O-N 2.84Å; C11-D13 PolarHBondContact O-N 3.29Å
12	S	48.3	Very low	50.5	Low	93 Å²	93	148.3 Å²	148.3	65%	0.65	77%	0.771	S	S	*	*			trans	-68.4	106.7	155.4	40.6	0	0	0	0	106.5	V10 T14	V10-S12 VanDerWaalsContact C-N 3.3Å; V10-S12 PolarHBondContact O-N 2.86Å; S12-T14 PolarHBondContact O-N 2.69Å
13	D	44.2	Very low	50.9	Low	110 Å²	110	146.3 Å²	146.3	59%	0.588	77%	0.774	S	S	*	*			trans	-50.1	108.9	170.6	-105.3	-42.9	0	0	0	108.4	C11 R15	C11-D13 PolarHBondContact O-N 3.29Å; D13-R15 PolarHBondContact O-N 3.03Å; D13-R15 VanDerWaalsContact O-N 3.16Å; D13-R15 IonicContact OD1-NE 3.37Å
14	T	54.5	Low	51.3	Low	122 Å²	122	144.9 Å²	144.9	75%	0.748	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-74.5	7	174.8	45.4	0	0	0	0	112.3	S12	S12-T14 PolarHBondContact O-N 2.69Å
15	R	52.4	Low	51.5	Low	195 Å²	195	146.4 Å²	146.4	74%	0.736	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-79.2	-19.5	-174.6	-65.1	-178.5	-173.3	178.7	5.2	113.5	D13	D13-R15 PolarHBondContact O-N 3.03Å; D13-R15 VanDerWaalsContact O-N 3.16Å; D13-R15 IonicContact OD1-NE 3.37Å
16	D	42.8	Very low	52.9	Low	138 Å²	138	145.6 Å²	145.6	74%	0.738	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-98.7	13.6	-177.4	-60.3	-17.6	0	0	0	113
17	R	47.2	Very low	54.6	Low	231 Å²	231	145.8 Å²	145.8	87%	0.872	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-90.5	-4.7	175.1	-167.2	164.7	169.9	127.9	-1.4	113.3
18	E	53.9	Low	56.2	Low	158 Å²	158	137 Å²	137	74%	0.738	72%	0.723	S	S	*	*	S	Bend	trans	-90.3	-1.5	-178.7	-71.6	-169.5	152.6	0	0	114.1
19	E	48.4	Very low	58.2	Low	176 Å²	176	134 Å²	134	82%	0.822	70%	0.7	S	S	*	*	S	Bend	trans	-103.8	17.8	-173.3	-136	172	-155.6	0	0	115.5
20	Y	43.9	Very low	59.8	Low	206 Å²	206	127.8 Å²	127.8	81%	0.808	66%	0.662	S	S	*	*			trans	-130.8	44	172.8	-83.7	-89.7	0	0	0	111.8	D22	Y20-D22 PolarHBondContact O-N 2.5Å
21	D	48.2	Very low	61.8	Low	159 Å²	159	125 Å²	125	85%	0.85	64%	0.639	S	S	*	*	S	Bend	trans	-88.2	92.1	153.3	-155.8	32.8	0	0	0	105.6	G23	D21-G23 PolarHBondContact O-N 3.17Å
22	D	47.1	Very low	64	Low	122 Å²	122	119.4 Å²	119.4	65%	0.652	60%	0.601	S	S	*	*			trans	-42.6	124.9	174.5	-78.8	-58.4	0	0	0	108.8	Y20 E24	Y20-D22 PolarHBondContact O-N 2.5Å; D22-E24 PolarHBondContact O-N 2.81Å
23	G	55.4	Low	66	Low	85 Å²	85	119.6 Å²	119.6	88%	0.876	59%	0.594	S	S	*	*			trans	-65.1	32	-172.7	0	0	0	0	0	116	D21 K25	D21-G23 PolarHBondContact O-N 3.17Å; G23-K25 PolarHBondContact O-N 3.42Å
24	E	59.2	Low	68.2	Low	170 Å²	170	116.3 Å²	116.3	79%	0.794	58%	0.579	S	S	*	*			trans	-68.2	110.4	170.9	-65.3	-166.6	165.1	0	0	109.3	D22	D22-E24 PolarHBondContact O-N 2.81Å
25	K	65.7	Low	69.8	Low	170 Å²	170	113 Å²	113	74%	0.739	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.6	173.1	-72.1	173.1	-176.9	169.1	0	108.8	G23 L27	G23-K25 PolarHBondContact O-N 3.42Å; K25-L27 PolarHBondContact O-N 3.15Å
26	P	79.1	Confident	71.6	Confident	100 Å²	100	105.8 Å²	105.8	65%	0.649	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60.8	129.7	-178.2	23.1	-32.8	0	0	0	110.4	H28	P26-H28 PolarHBondContact O-CE1 2.71Å; P26-H28 PolarHBondContact O-ND1 2.98Å
27	L	88.5	Confident	74	Confident	114 Å²	114	102.5 Å²	102.5	60%	0.597	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-68.5	132.8	174.2	-65.1	176.5	0	0	0	110	K25 V40 D42	K25-L27 PolarHBondContact O-N 3.15Å; L27-V40 HydrophobicContact CB-CG1 4.07Å; L27-V40 HydrophobicContact CD1-CG1 4.29Å; L27-D42 HydrophobicContact CD2-CB 4.37Å
28	H	90.5	Very high	76.3	Confident	43 Å²	43	91.5 Å²	91.5	20%	0.199	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.6	179.3	-62.5	75.6	0	0	0	109.7	P26 Y30 V40 L41 Q44	P26-H28 PolarHBondContact O-CE1 2.71Å; P26-H28 PolarHBondContact O-ND1 2.98Å; H28-Y30 HydrophobicContact CB-CE2 3.59Å; H28-V40 WeakPolarHBondContact O-CA 3.48Å; H28-L41 WeakPolarHBondContact CA-O 3.45Å; H28-L41 WeakPolarHBondContact CB-O 3.42Å; H28-L41 PolarHBondContact N-O 2.78Å; H28-L41 PolarHBondContact O-N 3.36Å; H28-Q44 WeakPolarHBondContact NE2-CG 3.19Å
29	V	93	Very high	78.2	Confident	49 Å²	49	84 Å²	84	30%	0.297	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.9	179.7	-173.7	0	0	0	0	109.8	Y31 M37 V40	V29-Y31 HydrophobicContact CB-CE2 4.4Å; V29-Y31 HydrophobicContact CG1-CE2 3.94Å; V29-M37 HydrophobicContact CG1-CG 3.62Å; V29-M37 HydrophobicContact CG1-SD 3.74Å; V29-V40 HydrophobicContact CG2-CG1 4.49Å; V29-V40 HydrophobicContact CG2-CG2 4.4Å
30	Y	93.7	Very high	80.4	Confident	3 Å²	3	76.9 Å²	76.9	1%	0.012	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	144.2	-179.5	-60.9	-88.7	0	0	0	111.5	H28 V38 L39 L41 C43 Q44 L45 V120 K121	H28-Y30 HydrophobicContact CB-CE2 3.59Å; Y30-V38 PolarHBondContact O-N 2.83Å; Y30-L39 HydrophobicContact CD2-CD2 4.09Å; Y30-L39 HydrophobicContact CD2-CG 4.22Å; Y30-L39 PolarHBondContact N-O 3.27Å; Y30-L39 PolarHBondContact O-N 3.5Å; Y30-L41 HydrophobicContact CD2-CB 4.47Å; Y30-L41 HydrophobicContact CE2-CB 4.06Å; Y30-L41 HydrophobicContact CE2-CD2 4.4Å; Y30-C43 PolarHBondContact OH-O 2.84Å; Y30-Q44 WeakPolarHBondContact OH-CA 3.45Å; Y30-L45 HydrophobicContact CD1-CD1 3.87Å; Y30-L45 HydrophobicContact CD1-CD2 4.34Å; Y30-L45 HydrophobicContact CD2-CD1 3.84Å; Y30-L45 HydrophobicContact CE1-CB 3.93Å; Y30-L45 HydrophobicContact CE1-CD1 3.47Å; Y30-L45 VanDerWaalsContact CE1-CD1 3.47Å; Y30-L45 HydrophobicContact CE1-CD2 4.18Å; Y30-L45 HydrophobicContact CE1-CG 4.04Å; Y30-L45 HydrophobicContact CE2-CD1 3.45Å; Y30-L45 VanDerWaalsContact CE2-CD1 3.45Å; Y30-L45 HydrophobicContact CG-CD1 4.05Å; Y30-L45 PolarHBondContact OH-N 3.21Å; Y30-V120 WeakPolarHBondContact CA-O 3.43Å; Y30-K121 HydrophobicContact CD1-CG 3.83Å; Y30-K121 HydrophobicContact CE1-CD 4.19Å; Y30-K121 HydrophobicContact CE1-CG 3.46Å; Y30-K121 VanDerWaalsContact CE1-CG 3.46Å; Y30-K121 WeakPolarHBondContact OH-CE 3.47Å
31	Y	94.4	Very high	82.7	Confident	63 Å²	63	67 Å²	67	25%	0.247	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.3	-174.1	-58.3	-94.5	0	0	0	110.1	V29 Q36 M37 V119 V120 F122	V29-Y31 HydrophobicContact CB-CE2 4.4Å; V29-Y31 HydrophobicContact CG1-CE2 3.94Å; Y31-Q36 CarbonylContact C-O 3.5Å; Y31-Q36 VanDerWaalsContact CA-O 3.23Å; Y31-Q36 WeakPolarHBondContact CA-O 3.26Å; Y31-M37 HydrophobicContact CD1-CB 4.11Å; Y31-M37 HydrophobicContact CE1-CB 3.99Å; Y31-M37 HydrophobicContact CE1-CG 4.47Å; Y31-V119 CarbonylContact O-C 3.56Å; Y31-V119 VanDerWaalsContact O-CA 3.27Å; Y31-V119 WeakPolarHBondContact O-CA 3.37Å; Y31-V120 PolarHBondContact N-O 2.96Å; Y31-V120 PolarHBondContact O-N 3.28Å; Y31-F122 HydrophobicContact CD2-CB 4.3Å; Y31-F122 HydrophobicContact CE2-CB 3.77Å; Y31-F122 HydrophobicContact CE2-CD2 4.08Å; Y31-F122 HydrophobicContact CE2-CG 4.42Å
32	C	93.6	Very high	84.8	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	160.8	164.1	179.2	0	0	0	0	109.4	C34 G35 Q36 V38 L100	C32-C34 PolarHBondContact O-N 2.96Å; C32-G35 PolarHBondContact O-N 2.63Å; C32-Q36 HydrophobicContact CB-CB 4.34Å; C32-Q36 PolarHBondContact N-O 3.45Å; C32-V38 HydrophobicContact CB-CG1 3.8Å; C32-V38 HydrophobicContact CB-CG2 4.32Å; C32-L100 HydrophobicContact CB-CD2 4.11Å
33	L	90.3	Very high	86.8	Confident	97 Å²	97	56.4 Å²	56.4	51%	0.508	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.7	174	-57.2	179.2	0	0	0	113.6	G35 L98 V120	L33-G35 VanDerWaalsContact C-N 3.3Å; L33-L98 HydrophobicContact CB-CD2 4.26Å; L33-L98 HydrophobicContact CD1-CD2 3.82Å; L33-L98 HydrophobicContact CG-CD2 3.96Å; L33-V120 HydrophobicContact CD2-CG1 3.87Å
34	C	89.9	Confident	88.5	Confident	41 Å²	41	55.6 Å²	55.6	28%	0.277	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	1.5	174.8	69.9	0	0	0	0	114.5	C32 C93 C96	C32-C34 PolarHBondContact O-N 2.96Å; C34-C93 VanDerWaalsContact SG-SG 3.62Å; C34-C96 HydrophobicContact CB-CB 3.95Å
35	G	89	Confident	90	Very high	51 Å²	51	48.7 Å²	48.7	53%	0.526	26%	0.264	S	S	.	.	S	Bend	trans	85.2	0.3	-178.2	0	0	0	0	0	115.2	C32 L33	C32-G35 PolarHBondContact O-N 2.63Å; L33-G35 VanDerWaalsContact C-N 3.3Å
36	Q	90	Very high	91.2	Very high	44 Å²	44	45.6 Å²	45.6	21%	0.206	25%	0.252	C	S	.	.			trans	-69.6	133.2	174.7	-161.9	108.4	-19	0	0	110	Y31 C32 V38 N70	Y31-Q36 CarbonylContact C-O 3.5Å; Y31-Q36 VanDerWaalsContact CA-O 3.23Å; Y31-Q36 WeakPolarHBondContact CA-O 3.26Å; C32-Q36 HydrophobicContact CB-CB 4.34Å; C32-Q36 PolarHBondContact N-O 3.45Å; Q36-V38 HydrophobicContact CB-CG1 4.26Å; Q36-V38 HydrophobicContact CG-CG1 4.39Å; Q36-V38 PolarHBondContact O-N 2.9Å; Q36-N70 HydrophobicContact CG-CB 3.6Å; Q36-N70 VanDerWaalsContact NE2-CB 3.34Å
37	M	92.6	Very high	91.8	Very high	70 Å²	70	48.3 Å²	48.3	35%	0.345	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	124.7	168.6	-177.3	-176.4	72	0	0	109.5	V29 Y31 V40 C69 N70	V29-M37 HydrophobicContact CG1-CG 3.62Å; V29-M37 HydrophobicContact CG1-SD 3.74Å; Y31-M37 HydrophobicContact CD1-CB 4.11Å; Y31-M37 HydrophobicContact CE1-CB 3.99Å; Y31-M37 HydrophobicContact CE1-CG 4.47Å; M37-V40 HydrophobicContact SD-CG2 4.42Å; M37-C69 HydrophobicContact CE-CB 3.9Å; M37-N70 PolarHBondContact O-ND2 3.16Å
38	V	95.1	Very high	92	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	-27.8	-171.8	-66.7	0	0	0	0	115.8	Y30 C32 Q36 F68 C69 V71 L100 F101 V119	Y30-V38 PolarHBondContact O-N 2.83Å; C32-V38 HydrophobicContact CB-CG1 3.8Å; C32-V38 HydrophobicContact CB-CG2 4.32Å; Q36-V38 HydrophobicContact CB-CG1 4.26Å; Q36-V38 HydrophobicContact CG-CG1 4.39Å; Q36-V38 PolarHBondContact O-N 2.9Å; V38-F68 WeakPolarHBondContact O-CA 3.27Å; V38-C69 VanDerWaalsContact CA-O 3.27Å; V38-C69 WeakPolarHBondContact CA-O 3.28Å; V38-C69 PolarHBondContact O-N 3.39Å; V38-V71 HydrophobicContact CB-CG2 4.27Å; V38-L100 HydrophobicContact CB-CD1 3.82Å; V38-L100 HydrophobicContact CG1-CD1 3.56Å; V38-L100 HydrophobicContact CG2-CD1 4.18Å; V38-F101 HydrophobicContact CB-CE2 4.5Å; V38-F101 HydrophobicContact CG2-CZ 4.41Å; V38-V119 HydrophobicContact CG2-CG1 3.76Å
39	L	94.6	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	132.8	-178	170.7	69.4	0	0	0	110.3	Y30 L41 L45 I59 H66 F68 F101 I114	Y30-L39 HydrophobicContact CD2-CD2 4.09Å; Y30-L39 HydrophobicContact CD2-CG 4.22Å; Y30-L39 PolarHBondContact N-O 3.27Å; Y30-L39 PolarHBondContact O-N 3.5Å; L39-L41 HydrophobicContact CG-CB 4.41Å; L39-L45 HydrophobicContact CD2-CD1 4.16Å; L39-I59 HydrophobicContact CD1-CD1 4Å; L39-I59 HydrophobicContact CD2-CD1 4.01Å; L39-H66 HydrophobicContact CD1-CB 4.33Å; L39-F68 HydrophobicContact CD1-CD1 4.01Å; L39-F68 HydrophobicContact CD1-CE1 3.82Å; L39-F101 HydrophobicContact CB-CE1 4.46Å; L39-F101 HydrophobicContact CB-CZ 3.88Å; L39-F101 HydrophobicContact CD2-CE1 4.15Å; L39-F101 HydrophobicContact CD2-CZ 4.4Å; L39-I114 HydrophobicContact CD2-CD1 3.9Å
40	V	94.1	Very high	92.2	Very high	26 Å²	26	46.2 Å²	46.2	16%	0.158	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.8	165.1	-175	0	0	0	0	107.4	L27 H28 V29 M37 H66 K67	L27-V40 HydrophobicContact CB-CG1 4.07Å; L27-V40 HydrophobicContact CD1-CG1 4.29Å; H28-V40 WeakPolarHBondContact O-CA 3.48Å; V29-V40 HydrophobicContact CG2-CG1 4.49Å; V29-V40 HydrophobicContact CG2-CG2 4.4Å; M37-V40 HydrophobicContact SD-CG2 4.42Å; V40-H66 CarbonylContact O-C 3.53Å; V40-H66 VanDerWaalsContact O-CA 3.24Å; V40-H66 WeakPolarHBondContact O-CA 2.81Å; V40-K67 HydrophobicContact CB-CB 4.38Å; V40-K67 PolarHBondContact N-O 2.79Å; V40-K67 PolarHBondContact O-N 3.25Å
41	L	93	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	142.2	-173.2	-171.2	65.5	0	0	0	110.5	H28 Y30 L39 C43 L45 L48 I59 H64 H66	H28-L41 WeakPolarHBondContact CA-O 3.45Å; H28-L41 WeakPolarHBondContact CB-O 3.42Å; H28-L41 PolarHBondContact N-O 2.78Å; H28-L41 PolarHBondContact O-N 3.36Å; Y30-L41 HydrophobicContact CD2-CB 4.47Å; Y30-L41 HydrophobicContact CE2-CB 4.06Å; Y30-L41 HydrophobicContact CE2-CD2 4.4Å; L39-L41 HydrophobicContact CG-CB 4.41Å; L41-C43 VanDerWaalsContact CD2-O 3.31Å; L41-C43 WeakPolarHBondContact CD2-O 3.44Å; L41-C43 VanDerWaalsContact CD2-SG 3.55Å; L41-C43 PolarHBondContact O-N 2.82Å; L41-L45 HydrophobicContact CD2-CD1 3.98Å; L41-L48 HydrophobicContact CD2-CD1 3.79Å; L41-L48 HydrophobicContact CD2-CD2 4.5Å; L41-L48 HydrophobicContact CD2-CG 4.33Å; L41-I59 HydrophobicContact CD1-CG2 4.22Å; L41-H64 HydrophobicContact CD1-CB 4.04Å; L41-H66 HydrophobicContact CD1-CB 3.67Å
42	D	91.5	Very high	92	Very high	41 Å²	41	51 Å²	51	22%	0.219	28%	0.28	C	S	.	.	S	Bend	trans	-70.8	-14.5	175.9	63.4	-7	0	0	0	114.6	L27 H64 A65	L27-D42 HydrophobicContact CD2-CB 4.37Å; D42-H64 WeakPolarHBondContact OD1-CB 3.21Å; D42-H64 IonicContact OD1-CG 3.18Å; D42-H64 IonicContact OD1-ND1 3.93Å; D42-H64 PolarHBondContact OD1-ND1 3.49Å; D42-H64 WeakPolarHBondContact OD2-CA 3.45Å; D42-H64 IonicContact OD2-ND1 2.9Å; D42-A65 HydrophobicContact CB-CB 4.26Å; D42-A65 PolarHBondContact N-O 3.12Å; D42-A65 VanDerWaalsContact N-O 3.08Å; D42-A65 PolarHBondContact OD2-N 2.94Å
43	C	90.3	Very high	91.7	Very high	17 Å²	17	56.1 Å²	56.1	12%	0.115	30%	0.299	C	S	.	.	S	Bend	trans	-127.8	164	-177	66	0	0	0	0	113.5	Y30 L41 L48 H64	Y30-C43 PolarHBondContact OH-O 2.84Å; L41-C43 VanDerWaalsContact CD2-O 3.31Å; L41-C43 WeakPolarHBondContact CD2-O 3.44Å; L41-C43 VanDerWaalsContact CD2-SG 3.55Å; L41-C43 PolarHBondContact O-N 2.82Å; C43-L48 VanDerWaalsContact SG-CD2 3.57Å; C43-H64 VanDerWaalsContact SG-CE1 3.55Å; C43-H64 PolarHBondContact SG-ND1 2.89Å
44	Q	90.3	Very high	91.6	Very high	67 Å²	67	53.7 Å²	53.7	31%	0.313	29%	0.287	S	S	.	.			trans	-75.5	140.1	174.5	-69.8	176.8	-13.6	0	0	110.9	H28 Y30 E46 K47	H28-Q44 WeakPolarHBondContact NE2-CG 3.19Å; Y30-Q44 WeakPolarHBondContact OH-CA 3.45Å; Q44-E46 PolarHBondContact O-N 2.96Å; Q44-K47 HydrophobicContact CB-CD 4.31Å; Q44-K47 HydrophobicContact CB-CG 4.26Å; Q44-K47 WeakPolarHBondContact O-CB 3.14Å; Q44-K47 PolarHBondContact O-N 3.33Å
45	L	91.2	Very high	91.7	Very high	26 Å²	26	58.9 Å²	58.9	14%	0.136	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.7	-32.3	-179.7	-118	74.4	0	0	0	112.9	Y30 L39 L41 K47 L48 I114 V119	Y30-L45 HydrophobicContact CD1-CD1 3.87Å; Y30-L45 HydrophobicContact CD1-CD2 4.34Å; Y30-L45 HydrophobicContact CD2-CD1 3.84Å; Y30-L45 HydrophobicContact CE1-CB 3.93Å; Y30-L45 HydrophobicContact CE1-CD1 3.47Å; Y30-L45 VanDerWaalsContact CE1-CD1 3.47Å; Y30-L45 HydrophobicContact CE1-CD2 4.18Å; Y30-L45 HydrophobicContact CE1-CG 4.04Å; Y30-L45 HydrophobicContact CE2-CD1 3.45Å; Y30-L45 VanDerWaalsContact CE2-CD1 3.45Å; Y30-L45 HydrophobicContact CG-CD1 4.05Å; Y30-L45 PolarHBondContact OH-N 3.21Å; L39-L45 HydrophobicContact CD2-CD1 4.16Å; L41-L45 HydrophobicContact CD2-CD1 3.98Å; L45-K47 PolarHBondContact O-N 2.97Å; L45-L48 HydrophobicContact CD1-CD1 4.45Å; L45-L48 HydrophobicContact CG-CD1 4.47Å; L45-L48 PolarHBondContact O-N 3.16Å; L45-I114 HydrophobicContact CD1-CD1 3.92Å; L45-I114 HydrophobicContact CD2-CD1 4.28Å; L45-I114 HydrophobicContact CG-CD1 4.1Å; L45-V119 HydrophobicContact CD2-CG2 3.46Å; L45-V119 VanDerWaalsContact CD2-CG2 3.46Å
46	E	90.8	Very high	92	Very high	105 Å²	105	56.5 Å²	56.5	49%	0.491	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-66.4	-26.8	179	-58.1	99.7	-178.5	0	0	112.9	Q44 R57 K121	Q44-E46 PolarHBondContact O-N 2.96Å; E46-R57 PolarHBondContact O-NH1 3.23Å; E46-K121 IonicContact OE1-NZ 3.7Å; E46-K121 PolarHBondContact OE1-NZ 3.05Å; E46-K121 IonicContact OE2-NZ 3.71Å; E46-K121 PolarHBondContact OE2-NZ 3.5Å
47	K	91.4	Very high	92.2	Very high	156 Å²	156	57.1 Å²	57.1	68%	0.678	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-81.8	-17.7	-179	-61.9	-178.1	-178.2	179.9	0	112.9	Q44 L45	Q44-K47 HydrophobicContact CB-CD 4.31Å; Q44-K47 HydrophobicContact CB-CG 4.26Å; Q44-K47 WeakPolarHBondContact O-CB 3.14Å; Q44-K47 PolarHBondContact O-N 3.33Å; L45-K47 PolarHBondContact O-N 2.97Å
48	L	92.7	Very high	92.3	Very high	2 Å²	2	55 Å²	55	1%	0.01	27%	0.267	C	S	.	.	S	Bend	trans	-68.6	143.2	177.2	-69	178.5	0	0	0	110.7	L41 C43 L45 M50 R57 I59 I114	L41-L48 HydrophobicContact CD2-CD1 3.79Å; L41-L48 HydrophobicContact CD2-CD2 4.5Å; L41-L48 HydrophobicContact CD2-CG 4.33Å; C43-L48 VanDerWaalsContact SG-CD2 3.57Å; L45-L48 HydrophobicContact CD1-CD1 4.45Å; L45-L48 HydrophobicContact CG-CD1 4.47Å; L45-L48 PolarHBondContact O-N 3.16Å; L48-M50 PolarHBondContact O-N 2.79Å; L48-R57 HydrophobicContact CB-CB 4.18Å; L48-R57 HydrophobicContact CD1-CB 4.23Å; L48-R57 PolarHBondContact O-NH1 2.58Å; L48-I59 HydrophobicContact CD1-CG1 3.78Å; L48-I114 HydrophobicContact CD1-CD1 3.99Å
49	P	94.3	Very high	92.3	Very high	80 Å²	80	55 Å²	55	52%	0.519	27%	0.267	S	S	.	.			trans	-58.9	141.4	174.2	22.2	-29.8	0	0	0	110.7	R57 V58	P49-R57 WeakPolarHBondContact O-CA 3.24Å; P49-V58 HydrophobicContact CG-CB 4.21Å; P49-V58 PolarHBondContact O-N 2.97Å
50	M	94.4	Very high	92.2	Very high	80 Å²	80	56.8 Å²	56.8	39%	0.394	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-104.5	132.1	178.7	-173.9	-174.3	-68.6	0	0	109.6	L48 R55 R57	L48-M50 PolarHBondContact O-N 2.79Å; M50-R55 HydrophobicContact CG-CB 4.43Å; M50-R55 HydrophobicContact SD-CB 4.05Å; M50-R55 HydrophobicContact SD-CG 4.33Å; M50-R57 VanDerWaalsContact CE-CZ 3.48Å
51	R	92.9	Very high	92	Very high	40 Å²	40	58 Å²	58	15%	0.151	29%	0.289	C	S	.	.			trans	-77.4	125.6	172.6	-176.8	175.6	-176.8	-149.6	7.7	109.2	R53 D54 R55 A56 V58 E86 Y102	R51-R53 VanDerWaalsContact C-N 3.27Å; R51-R53 HydrophobicContact CG-CB 4.34Å; R51-R53 PolarHBondContact O-N 2.83Å; R51-D54 WeakPolarHBondContact CB-OD1 3.35Å; R51-D54 WeakPolarHBondContact CD-OD1 3.22Å; R51-D54 WeakPolarHBondContact CG-OD1 3.19Å; R51-D54 IonicContact NH1-OD2 3.17Å; R51-D54 PolarHBondContact NH1-OD2 2.8Å; R51-D54 VanDerWaalsContact NH1-OD2 3.17Å; R51-R55 WeakPolarHBondContact O-CA 3.35Å; R51-R55 PolarHBondContact O-N 2.89Å; R51-A56 PolarHBondContact N-O 3.16Å; R51-V58 HydrophobicContact CB-CG2 4.36Å; R51-E86 IonicContact CZ-OE1 2.71Å; R51-E86 IonicContact CZ-OE2 2.98Å; R51-E86 IonicContact NH1-OE1 3.36Å; R51-E86 PolarHBondContact NH1-OE1 2.78Å; R51-E86 IonicContact NH1-OE2 3.42Å; R51-E86 IonicContact NH2-OE1 3.42Å; R51-E86 PolarHBondContact NH2-OE1 3.4Å; R51-E86 IonicContact NH2-OE2 3.93Å; R51-E86 PolarHBondContact NH2-OE2 2.86Å; R51-Y102 PolarHBondContact NH1-OH 2.8Å; R51-Y102 VanDerWaalsContact NH1-OH 3.12Å
52	P	89.8	Confident	91.8	Very high	128 Å²	128	62.4 Å²	62.4	83%	0.831	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.9	-175.3	25.2	-34.1	0	0	0	113.8
53	R	87.1	Confident	91.7	Very high	108 Å²	108	67.7 Å²	67.7	41%	0.408	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-36.5	-173.4	-178.2	171.8	-92.1	-171.8	1.5	113.5	R51 E83 E86	R51-R53 VanDerWaalsContact C-N 3.27Å; R51-R53 HydrophobicContact CG-CB 4.34Å; R51-R53 PolarHBondContact O-N 2.83Å; R53-E83 IonicContact CZ-OE2 2.73Å; R53-E83 IonicContact NH1-OE2 3.15Å; R53-E83 IonicContact NH2-OE1 3.39Å; R53-E83 PolarHBondContact NH2-OE1 3.5Å; R53-E83 IonicContact NH2-OE2 3.28Å; R53-E83 PolarHBondContact NH2-OE2 3Å; R53-E86 IonicContact NH1-OE2 2.69Å
54	D	88.9	Confident	91.7	Very high	45 Å²	45	69 Å²	69	24%	0.241	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139	7.7	-173.2	59.6	-6.6	0	0	0	113	R51 A56 Y102	R51-D54 WeakPolarHBondContact CB-OD1 3.35Å; R51-D54 WeakPolarHBondContact CD-OD1 3.22Å; R51-D54 WeakPolarHBondContact CG-OD1 3.19Å; R51-D54 IonicContact NH1-OD2 3.17Å; R51-D54 PolarHBondContact NH1-OD2 2.8Å; R51-D54 VanDerWaalsContact NH1-OD2 3.17Å; D54-A56 PolarHBondContact O-N 3.08Å; D54-A56 WeakPolarHBondContact OD1-CB 3.49Å; D54-A56 PolarHBondContact OD1-N 3.22Å; D54-Y102 PolarHBondContact OD2-OH 2.86Å
55	R	91.9	Very high	91.8	Very high	151 Å²	151	69 Å²	69	57%	0.57	36%	0.363	S	S	*	.			trans	58.3	14.8	-178.4	-55.9	171.7	62.6	107.2	2.9	113.9	M50 R51 D116	M50-R55 HydrophobicContact CG-CB 4.43Å; M50-R55 HydrophobicContact SD-CB 4.05Å; M50-R55 HydrophobicContact SD-CG 4.33Å; R51-R55 WeakPolarHBondContact O-CA 3.35Å; R51-R55 PolarHBondContact O-N 2.89Å; R55-D116 HydrophobicContact CB-CB 4.36Å; R55-D116 IonicContact NE-OD2 3.48Å
56	A	94.4	Very high	91.8	Very high	1 Å²	1	70.4 Å²	70.4	1%	0.008	37%	0.368	C	S	.	.			trans	-65.9	137.5	178.1	0	0	0	0	0	110.5	R51 D54 Y102 F113 I114	R51-A56 PolarHBondContact N-O 3.16Å; D54-A56 PolarHBondContact O-N 3.08Å; D54-A56 WeakPolarHBondContact OD1-CB 3.49Å; D54-A56 PolarHBondContact OD1-N 3.22Å; A56-Y102 HydrophobicContact CB-CE1 4.16Å; A56-F113 HydrophobicContact CB-CB 4.28Å; A56-F113 HydrophobicContact CB-CD1 4.47Å; A56-I114 WeakPolarHBondContact CA-O 3.41Å; A56-I114 VanDerWaalsContact CB-O 3.24Å; A56-I114 WeakPolarHBondContact CB-O 3.32Å
57	R	95.1	Very high	91.9	Very high	57 Å²	57	72 Å²	72	22%	0.215	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	140	171.8	-65	-66.2	-175.6	155.7	5.4	109.4	E46 L48 P49 M50 F113 I114	E46-R57 PolarHBondContact O-NH1 3.23Å; L48-R57 HydrophobicContact CB-CB 4.18Å; L48-R57 HydrophobicContact CD1-CB 4.23Å; L48-R57 PolarHBondContact O-NH1 2.58Å; P49-R57 WeakPolarHBondContact O-CA 3.24Å; M50-R57 VanDerWaalsContact CE-CZ 3.48Å; R57-F113 CarbonylContact O-C 3.59Å; R57-F113 WeakPolarHBondContact O-CA 3.47Å; R57-I114 HydrophobicContact CB-CB 4.28Å; R57-I114 HydrophobicContact CB-CD1 4.21Å; R57-I114 HydrophobicContact CB-CG1 4.46Å; R57-I114 PolarHBondContact N-O 2.9Å; R57-I114 VanDerWaalsContact N-O 3.16Å; R57-I114 PolarHBondContact O-N 3.18Å
58	V	95	Very high	92	Very high	24 Å²	24	67.1 Å²	67.1	15%	0.145	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.5	-175.4	-167.5	0	0	0	0	110.1	P49 R51 A111 F113	P49-V58 HydrophobicContact CG-CB 4.21Å; P49-V58 PolarHBondContact O-N 2.97Å; R51-V58 HydrophobicContact CB-CG2 4.36Å; V58-A111 HydrophobicContact CG1-CB 3.76Å; V58-F113 HydrophobicContact CB-CD1 4.43Å; V58-F113 HydrophobicContact CB-CE1 4.36Å; V58-F113 HydrophobicContact CG1-CD1 4.26Å; V58-F113 HydrophobicContact CG1-CE1 3.94Å; V58-F113 HydrophobicContact CG1-CZ 4.22Å; V58-F113 HydrophobicContact CG2-CD1 3.63Å; V58-F113 HydrophobicContact CG2-CE1 3.54Å
59	I	94.4	Very high	92	Very high	0 Å²	0	68 Å²	68	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	121.4	169.9	-57.6	169.6	0	0	0	107.7	L39 L41 L48 H64 H66 F68 A111 T112 I114	L39-I59 HydrophobicContact CD1-CD1 4Å; L39-I59 HydrophobicContact CD2-CD1 4.01Å; L41-I59 HydrophobicContact CD1-CG2 4.22Å; L48-I59 HydrophobicContact CD1-CG1 3.78Å; I59-H64 HydrophobicContact CG2-CB 4.35Å; I59-H66 HydrophobicContact CG2-CB 4.18Å; I59-F68 HydrophobicContact CD1-CE1 4.41Å; I59-F68 HydrophobicContact CD1-CZ 4.38Å; I59-A111 CarbonylContact O-C 3.54Å; I59-A111 WeakPolarHBondContact O-CA 3.2Å; I59-T112 PolarHBondContact N-O 2.84Å; I59-T112 PolarHBondContact O-N 3.31Å; I59-I114 HydrophobicContact CD1-CD1 3.68Å; I59-I114 HydrophobicContact CD1-CG1 3.8Å; I59-I114 HydrophobicContact CG1-CD1 3.85Å; I59-I114 HydrophobicContact CG1-CG1 4.04Å
60	D	92.4	Very high	91.9	Very high	39 Å²	39	68.2 Å²	68.2	21%	0.209	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.2	171.8	-173.5	-14.7	0	0	0	109	A62 K63 H64 P110	D60-A62 PolarHBondContact O-N 3.39Å; D60-A62 PolarHBondContact OD1-N 2.85Å; D60-A62 VanDerWaalsContact OD1-N 3.14Å; D60-K63 HydrophobicContact CB-CB 4.21Å; D60-K63 HydrophobicContact CB-CD 4.21Å; D60-K63 HydrophobicContact CB-CG 4.32Å; D60-K63 PolarHBondContact O-N 2.74Å; D60-K63 VanDerWaalsContact O-N 3.13Å; D60-K63 VanDerWaalsContact OD2-CD 3.28Å; D60-K63 WeakPolarHBondContact OD2-CD 3.08Å; D60-K63 WeakPolarHBondContact OD2-CE 3.14Å; D60-K63 IonicContact OD2-NZ 3.66Å; D60-K63 PolarHBondContact OD2-NZ 3.34Å; D60-K63 VanDerWaalsContact OD2-NZ 3.15Å; D60-H64 PolarHBondContact O-N 3.33Å; D60-P110 WeakPolarHBondContact CA-O 3.47Å
61	A	89.3	Confident	91.8	Very high	50 Å²	50	66 Å²	66	41%	0.413	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.4	-176.6	0	0	0	0	0	113.4	P110	A61-P110 PolarHBondContact N-O 2.89Å
62	A	89.5	Confident	91.8	Very high	93 Å²	93	69.8 Å²	69.8	77%	0.769	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-24.6	177.8	0	0	0	0	0	113.1	D60	D60-A62 PolarHBondContact O-N 3.39Å; D60-A62 PolarHBondContact OD1-N 2.85Å; D60-A62 VanDerWaalsContact OD1-N 3.14Å
63	K	89.9	Confident	91.8	Very high	153 Å²	153	70.8 Å²	70.8	67%	0.665	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-29.6	-174.6	-64.6	177.8	-173.8	153.6	0	113.5	D60	D60-K63 HydrophobicContact CB-CB 4.21Å; D60-K63 HydrophobicContact CB-CD 4.21Å; D60-K63 HydrophobicContact CB-CG 4.32Å; D60-K63 PolarHBondContact O-N 2.74Å; D60-K63 VanDerWaalsContact O-N 3.13Å; D60-K63 VanDerWaalsContact OD2-CD 3.28Å; D60-K63 WeakPolarHBondContact OD2-CD 3.08Å; D60-K63 WeakPolarHBondContact OD2-CE 3.14Å; D60-K63 IonicContact OD2-NZ 3.66Å; D60-K63 PolarHBondContact OD2-NZ 3.34Å; D60-K63 VanDerWaalsContact OD2-NZ 3.15Å
64	H	90.5	Very high	91.7	Very high	44 Å²	44	69.4 Å²	69.4	20%	0.204	36%	0.357	C	S	.	.	S	Bend	trans	-123.9	121.9	-171.5	-66.5	-58.9	0	0	0	111.1	L41 D42 C43 I59 D60 H66	L41-H64 HydrophobicContact CD1-CB 4.04Å; D42-H64 WeakPolarHBondContact OD1-CB 3.21Å; D42-H64 IonicContact OD1-CG 3.18Å; D42-H64 IonicContact OD1-ND1 3.93Å; D42-H64 PolarHBondContact OD1-ND1 3.49Å; D42-H64 WeakPolarHBondContact OD2-CA 3.45Å; D42-H64 IonicContact OD2-ND1 2.9Å; C43-H64 VanDerWaalsContact SG-CE1 3.55Å; C43-H64 PolarHBondContact SG-ND1 2.89Å; I59-H64 HydrophobicContact CG2-CB 4.35Å; D60-H64 PolarHBondContact O-N 3.33Å; H64-H66 PolarHBondContact O-N 3.45Å; H64-H66 PolarHBondContact O-ND1 3.08Å
65	A	91	Very high	91.4	Very high	68 Å²	68	75.5 Å²	75.5	56%	0.562	39%	0.385	S	S	*	.			trans	-69.1	120.5	168.8	0	0	0	0	0	108.7	D42	D42-A65 HydrophobicContact CB-CB 4.26Å; D42-A65 PolarHBondContact N-O 3.12Å; D42-A65 VanDerWaalsContact N-O 3.08Å; D42-A65 PolarHBondContact OD2-N 2.94Å
66	H	92.6	Very high	91.3	Very high	54 Å²	54	71.9 Å²	71.9	25%	0.25	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.5	-177.5	66.1	-78.6	0	0	0	111.4	L39 V40 L41 I59 H64 F68	L39-H66 HydrophobicContact CD1-CB 4.33Å; V40-H66 CarbonylContact O-C 3.53Å; V40-H66 VanDerWaalsContact O-CA 3.24Å; V40-H66 WeakPolarHBondContact O-CA 2.81Å; L41-H66 HydrophobicContact CD1-CB 3.67Å; I59-H66 HydrophobicContact CG2-CB 4.18Å; H64-H66 PolarHBondContact O-N 3.45Å; H64-H66 PolarHBondContact O-ND1 3.08Å; H66-F68 AromaticContact CD2-CE2 3.36Å; H66-F68 WeakPolarHBondContact CD2-CE2 3.31Å; H66-F68 AromaticContact CD2-CZ 3.58Å; H66-F68 AromaticContact NE2-CE2 3.57Å
67	K	93.1	Very high	91.1	Very high	139 Å²	139	72.8 Å²	72.8	60%	0.604	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	124.9	175.3	-173.4	176.7	-179.4	178.8	0	109.8	V40	V40-K67 HydrophobicContact CB-CB 4.38Å; V40-K67 PolarHBondContact N-O 2.79Å; V40-K67 PolarHBondContact O-N 3.25Å
68	F	93.6	Very high	91	Very high	53 Å²	53	76.2 Å²	76.2	23%	0.232	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	138.3	170.6	-58.6	-69.1	0	0	0	109.7	V38 L39 I59 H66 V71 F101 T112	V38-F68 WeakPolarHBondContact O-CA 3.27Å; L39-F68 HydrophobicContact CD1-CD1 4.01Å; L39-F68 HydrophobicContact CD1-CE1 3.82Å; I59-F68 HydrophobicContact CD1-CE1 4.41Å; I59-F68 HydrophobicContact CD1-CZ 4.38Å; H66-F68 AromaticContact CD2-CE2 3.36Å; H66-F68 WeakPolarHBondContact CD2-CE2 3.31Å; H66-F68 AromaticContact CD2-CZ 3.58Å; H66-F68 AromaticContact NE2-CE2 3.57Å; F68-V71 HydrophobicContact CB-CG2 4.43Å; F68-F101 AromaticContact CD1-CD2 3.88Å; F68-F101 HydrophobicContact CD1-CD2 3.88Å; F68-F101 HydrophobicContact CD1-CE1 4.45Å; F68-F101 AromaticContact CD1-CE2 3.7Å; F68-F101 HydrophobicContact CD1-CE2 3.7Å; F68-F101 HydrophobicContact CD1-CG 4.35Å; F68-F101 HydrophobicContact CD1-CZ 4.03Å; F68-F101 AromaticContact CE1-CD1 3.94Å; F68-F101 HydrophobicContact CE1-CD1 3.94Å; F68-F101 AromaticContact CE1-CD2 3.95Å; F68-F101 HydrophobicContact CE1-CD2 3.95Å; F68-F101 AromaticContact CE1-CE1 3.99Å; F68-F101 HydrophobicContact CE1-CE1 3.99Å; F68-F101 AromaticContact CE1-CE2 4Å; F68-F101 HydrophobicContact CE1-CE2 4Å; F68-F101 AromaticContact CE1-CG 3.93Å; F68-F101 HydrophobicContact CE1-CG 3.93Å; F68-F101 HydrophobicContact CE1-CZ 4.04Å; F68-T112 HydrophobicContact CE1-CG2 4.32Å; F68-T112 HydrophobicContact CE2-CG2 4.38Å; F68-T112 HydrophobicContact CZ-CG2 3.64Å
69	C	92.4	Very high	90.8	Very high	20 Å²	20	77 Å²	77	14%	0.135	40%	0.402	C	S	.	.			trans	-131.2	142.2	178.3	-63.4	0	0	0	0	109.3	M37 V38 V71	M37-C69 HydrophobicContact CE-CB 3.9Å; V38-C69 VanDerWaalsContact CA-O 3.27Å; V38-C69 WeakPolarHBondContact CA-O 3.28Å; V38-C69 PolarHBondContact O-N 3.39Å; C69-V71 WeakPolarHBondContact O-CG2 3.43Å; C69-V71 PolarHBondContact O-N 3.3Å; C69-V71 VanDerWaalsContact O-N 3.1Å
70	N	91.1	Very high	90.7	Very high	86 Å²	86	86.1 Å²	86.1	46%	0.46	44%	0.441	S	S	.	.	S	Bend	trans	54.3	34.5	173.9	-52.7	-45.4	0	0	0	114.8	Q36 M37 G94	Q36-N70 HydrophobicContact CG-CB 3.6Å; Q36-N70 VanDerWaalsContact NE2-CB 3.34Å; M37-N70 PolarHBondContact O-ND2 3.16Å; N70-G94 PolarHBondContact O-N 2.94Å
71	V	93.1	Very high	90.5	Very high	32 Å²	32	87 Å²	87	19%	0.194	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.5	-179.5	169.9	0	0	0	0	107.4	V38 F68 C69 K91 K92 L100 F101	V38-V71 HydrophobicContact CB-CG2 4.27Å; F68-V71 HydrophobicContact CB-CG2 4.43Å; C69-V71 WeakPolarHBondContact O-CG2 3.43Å; C69-V71 PolarHBondContact O-N 3.3Å; C69-V71 VanDerWaalsContact O-N 3.1Å; V71-K91 HydrophobicContact CG1-CB 3.45Å; V71-K91 VanDerWaalsContact CG1-CB 3.45Å; V71-K91 HydrophobicContact CG1-CD 4.15Å; V71-K91 HydrophobicContact CG1-CG 4.37Å; V71-K92 CarbonylContact C-O 3.59Å; V71-K92 VanDerWaalsContact CA-O 3.31Å; V71-K92 WeakPolarHBondContact CA-O 3.48Å; V71-L100 HydrophobicContact CG2-CD1 4.04Å; V71-F101 HydrophobicContact CG1-CD2 4.3Å; V71-F101 HydrophobicContact CG2-CD2 4.11Å; V71-F101 HydrophobicContact CG2-CE2 3.73Å
72	E	92.8	Very high	90.4	Very high	120 Å²	120	89.9 Å²	89.9	56%	0.561	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.9	139	175.4	-67.3	-177.9	162.6	0	0	109.3	K91 K92	E72-K91 CarbonylContact O-C 3.5Å; E72-K91 VanDerWaalsContact O-CA 3.31Å; E72-K91 WeakPolarHBondContact O-CA 3.2Å; E72-K92 PolarHBondContact N-O 3Å; E72-K92 PolarHBondContact O-N 3.25Å
73	E	90.4	Very high	90.2	Very high	150 Å²	150	93.4 Å²	93.4	70%	0.701	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.7	175.7	-59.8	-171.3	153.4	0	0	108.7	K91	E73-K91 HydrophobicContact CG-CD 4.19Å; E73-K91 HydrophobicContact CG-CG 4.36Å; E73-K91 WeakPolarHBondContact OE1-CE 3.23Å; E73-K91 IonicContact OE1-NZ 2.94Å; E73-K91 PolarHBondContact OE1-NZ 3Å
74	E	84.8	Confident	90.2	Very high	79 Å²	79	87.9 Å²	87.9	37%	0.369	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	161.7	177.4	-176.9	173.9	-135.8	0	0	110.5	R90 K92	E74-R90 HydrophobicContact CB-CB 4.4Å; E74-R90 PolarHBondContact N-O 2.85Å; E74-K92 HydrophobicContact CB-CD 4.27Å; E74-K92 HydrophobicContact CB-CG 4.49Å; E74-K92 VanDerWaalsContact CD-CE 3.4Å; E74-K92 HydrophobicContact CG-CD 4.42Å; E74-K92 WeakPolarHBondContact OE1-CE 3.4Å; E74-K92 IonicContact OE1-NZ 2.81Å; E74-K92 PolarHBondContact OE1-NZ 2.87Å; E74-K92 WeakPolarHBondContact OE2-CD 3.31Å; E74-K92 WeakPolarHBondContact OE2-CE 3.45Å; E74-K92 IonicContact OE2-NZ 3.92Å; E74-K92 PolarHBondContact OE2-NZ 3.22Å
75	E	81.4	Confident	90.2	Very high	173 Å²	173	91.6 Å²	91.6	81%	0.808	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-49.5	153	169.6	-65.7	-174	165.2	0	0	114.4	A77	E75-A77 PolarHBondContact O-N 2.84Å
76	Q	89.8	Confident	90.2	Very high	74 Å²	74	89.3 Å²	89.3	35%	0.346	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	129	-177.8	-52.5	-174.8	4.9	0	0	110.7	F78 H89 D106	Q76-F78 HydrophobicContact CB-CE2 4.49Å; Q76-H89 WeakPolarHBondContact CG-ND1 3.27Å; Q76-H89 PolarHBondContact NE2-CE1 2.78Å; Q76-D106 PolarHBondContact NE2-OD2 2.84Å
77	A	91.3	Very high	90.1	Very high	21 Å²	21	92.7 Å²	92.7	17%	0.174	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	137.5	173.3	0	0	0	0	0	110.9	E75 Q88 R90	E75-A77 PolarHBondContact O-N 2.84Å; A77-Q88 PolarHBondContact N-O 3.01Å; A77-Q88 PolarHBondContact O-N 3.28Å; A77-R90 HydrophobicContact CB-CG 4.3Å
78	F	92.2	Very high	90.1	Very high	128 Å²	128	86.4 Å²	86.4	56%	0.561	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.2	117	174.9	-63.4	-94.9	0	0	0	109.2	Q76 I85 R87	Q76-F78 HydrophobicContact CB-CE2 4.49Å; F78-I85 HydrophobicContact CB-CG2 3.93Å; F78-I85 HydrophobicContact CD1-CG2 3.97Å; F78-I85 HydrophobicContact CG-CG2 4.45Å; F78-R87 HydrophobicContact CD1-CG 3.7Å; F78-R87 HydrophobicContact CE1-CG 3.53Å
79	I	91.3	Very high	90	Very high	42 Å²	42	84.4 Å²	84.4	22%	0.215	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.1	178.2	-56.1	-172.7	0	0	0	109	R81 I85 E86 Q88	I79-R81 HydrophobicContact CG2-CG 4Å; I79-R81 PolarHBondContact O-N 3.37Å; I79-I85 WeakPolarHBondContact O-CA 3.47Å; I79-E86 PolarHBondContact N-O 2.91Å; I79-E86 PolarHBondContact O-N 2.91Å; I79-Q88 VanDerWaalsContact CD1-CD 3.41Å; I79-Q88 HydrophobicContact CD1-CG 4.35Å
80	K	91.9	Very high	90.1	Very high	190 Å²	190	86.7 Å²	86.7	83%	0.826	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.8	171.4	-169.1	177.1	-178.2	179.7	0	109.5
81	R	88.8	Confident	90.2	Very high	57 Å²	57	83.6 Å²	83.6	22%	0.215	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	170.9	175	-57.5	-164.2	-171.7	-98.5	11.3	110.1	I79 E83 G84 E86	I79-R81 HydrophobicContact CG2-CG 4Å; I79-R81 PolarHBondContact O-N 3.37Å; R81-E83 VanDerWaalsContact C-N 3.26Å; R81-E83 PolarHBondContact O-N 3.4Å; R81-G84 CarbonylContact C-O 3.52Å; R81-G84 WeakPolarHBondContact CA-O 3.45Å; R81-G84 PolarHBondContact N-O 3.14Å; R81-G84 PolarHBondContact O-N 2.85Å; R81-G84 VanDerWaalsContact O-O 3.09Å; R81-E86 WeakPolarHBondContact CD-OE2 3.48Å; R81-E86 IonicContact CZ-OE1 3.72Å; R81-E86 IonicContact CZ-OE2 3.66Å; R81-E86 IonicContact NE-OE1 3.63Å; R81-E86 IonicContact NE-OE2 3.79Å; R81-E86 PolarHBondContact NE-OE2 2.73Å; R81-E86 IonicContact NH2-OE1 3.17Å; R81-E86 PolarHBondContact NH2-OE1 2.88Å; R81-E86 IonicContact NH2-OE2 3.78Å; R81-E86 PolarHBondContact NH2-OE2 2.82Å
82	A	88	Confident	90.3	Very high	112 Å²	112	84.9 Å²	84.9	93%	0.926	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.4	-179.6	0	0	0	0	0	113.2
83	E	85.1	Confident	90.4	Very high	166 Å²	166	79.1 Å²	79.1	78%	0.776	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	0.6	-178.9	-67.9	176.5	-175.4	0	0	114	R53 R81	R53-E83 IonicContact CZ-OE2 2.73Å; R53-E83 IonicContact NH1-OE2 3.15Å; R53-E83 IonicContact NH2-OE1 3.39Å; R53-E83 PolarHBondContact NH2-OE1 3.5Å; R53-E83 IonicContact NH2-OE2 3.28Å; R53-E83 PolarHBondContact NH2-OE2 3Å; R81-E83 VanDerWaalsContact C-N 3.26Å; R81-E83 PolarHBondContact O-N 3.4Å
84	G	89.4	Confident	90.5	Very high	37 Å²	37	73.5 Å²	73.5	38%	0.381	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139	-165	-179	0	0	0	0	0	114	R81	R81-G84 CarbonylContact C-O 3.52Å; R81-G84 WeakPolarHBondContact CA-O 3.45Å; R81-G84 PolarHBondContact N-O 3.14Å; R81-G84 PolarHBondContact O-N 2.85Å; R81-G84 VanDerWaalsContact O-O 3.09Å
85	I	90.3	Very high	90.9	Very high	122 Å²	122	76.6 Å²	76.6	63%	0.626	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	119.2	-178.6	-57.7	173.1	0	0	0	109	F78 I79	F78-I85 HydrophobicContact CB-CG2 3.93Å; F78-I85 HydrophobicContact CD1-CG2 3.97Å; F78-I85 HydrophobicContact CG-CG2 4.45Å; I79-I85 WeakPolarHBondContact O-CA 3.47Å
86	E	89.9	Confident	91.4	Very high	20 Å²	20	71.6 Å²	71.6	9%	0.093	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123.8	175.4	-173.4	173.9	125.3	0	0	109.7	R51 R53 I79 R81 Q88 H104	R51-E86 IonicContact CZ-OE1 2.71Å; R51-E86 IonicContact CZ-OE2 2.98Å; R51-E86 IonicContact NH1-OE1 3.36Å; R51-E86 PolarHBondContact NH1-OE1 2.78Å; R51-E86 IonicContact NH1-OE2 3.42Å; R51-E86 IonicContact NH2-OE1 3.42Å; R51-E86 PolarHBondContact NH2-OE1 3.4Å; R51-E86 IonicContact NH2-OE2 3.93Å; R51-E86 PolarHBondContact NH2-OE2 2.86Å; R53-E86 IonicContact NH1-OE2 2.69Å; I79-E86 PolarHBondContact N-O 2.91Å; I79-E86 PolarHBondContact O-N 2.91Å; R81-E86 WeakPolarHBondContact CD-OE2 3.48Å; R81-E86 IonicContact CZ-OE1 3.72Å; R81-E86 IonicContact CZ-OE2 3.66Å; R81-E86 IonicContact NE-OE1 3.63Å; R81-E86 IonicContact NE-OE2 3.79Å; R81-E86 PolarHBondContact NE-OE2 2.73Å; R81-E86 IonicContact NH2-OE1 3.17Å; R81-E86 PolarHBondContact NH2-OE1 2.88Å; R81-E86 IonicContact NH2-OE2 3.78Å; R81-E86 PolarHBondContact NH2-OE2 2.82Å; E86-Q88 HydrophobicContact CG-CG 4.19Å; E86-Q88 PolarHBondContact OE1-NE2 3.18Å; E86-H104 IonicContact OE1-CE1 2.77Å; E86-H104 IonicContact OE1-NE2 3.76Å; E86-H104 PolarHBondContact OE1-NE2 3.1Å
87	R	91.1	Very high	91.5	Very high	126 Å²	126	69.7 Å²	69.7	48%	0.475	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.4	173.4	-62.5	-178	63.5	-168	-1.9	109.3	F78	F78-R87 HydrophobicContact CD1-CG 3.7Å; F78-R87 HydrophobicContact CE1-CG 3.53Å
88	Q	92.4	Very high	91.6	Very high	6 Å²	6	71.6 Å²	71.6	3%	0.028	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.4	179.7	-65.8	-169	-13.7	0	0	111.1	A77 I79 E86 R90 Y102 Q103	A77-Q88 PolarHBondContact N-O 3.01Å; A77-Q88 PolarHBondContact O-N 3.28Å; I79-Q88 VanDerWaalsContact CD1-CD 3.41Å; I79-Q88 HydrophobicContact CD1-CG 4.35Å; E86-Q88 HydrophobicContact CG-CG 4.19Å; E86-Q88 PolarHBondContact OE1-NE2 3.18Å; Q88-R90 HydrophobicContact CB-CG 4.49Å; Q88-Y102 HydrophobicContact CB-CD2 4.37Å; Q88-Y102 HydrophobicContact CG-CD2 3.97Å; Q88-Y102 HydrophobicContact CG-CE2 4.44Å; Q88-Q103 CarbonylContact C-O 3.54Å; Q88-Q103 WeakPolarHBondContact CA-O 3.35Å
89	H	93.1	Very high	91.8	Very high	11 Å²	11	67.4 Å²	67.4	5%	0.051	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	106.5	171.3	-58.2	-88.6	0	0	0	107.3	Q76 Y102 Q103 D106	Q76-H89 WeakPolarHBondContact CG-ND1 3.27Å; Q76-H89 PolarHBondContact NE2-CE1 2.78Å; H89-Y102 CarbonylContact O-C 3.6Å; H89-Y102 WeakPolarHBondContact O-CA 3.44Å; H89-Q103 HydrophobicContact CB-CB 4.38Å; H89-Q103 PolarHBondContact CD2-O 2.86Å; H89-Q103 PolarHBondContact N-O 3.38Å; H89-Q103 PolarHBondContact O-N 3.14Å; H89-D106 IonicContact CE1-OD1 3.95Å; H89-D106 PolarHBondContact CE1-OD1 2.87Å; H89-D106 IonicContact CE1-OD2 3.27Å; H89-D106 PolarHBondContact CE1-OD2 3.37Å; H89-D106 IonicContact CG-OD1 3.66Å; H89-D106 IonicContact ND1-OD1 2.63Å; H89-D106 PolarHBondContact ND1-OD1 2.9Å; H89-D106 IonicContact ND1-OD2 2.96Å; H89-D106 PolarHBondContact ND1-OD2 2.8Å; H89-D106 IonicContact NE2-OD2 3.69Å
90	R	93.4	Very high	91.9	Very high	69 Å²	69	65.4 Å²	65.4	26%	0.26	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	142.7	-169.5	-74	-174.8	173.5	180	0.7	110.4	E74 A77 Q88 L99	E74-R90 HydrophobicContact CB-CB 4.4Å; E74-R90 PolarHBondContact N-O 2.85Å; A77-R90 HydrophobicContact CB-CG 4.3Å; Q88-R90 HydrophobicContact CB-CG 4.49Å; R90-L99 HydrophobicContact CB-CD1 3.55Å; R90-L99 HydrophobicContact CG-CD1 3.68Å
91	K	94.3	Very high	92.1	Very high	21 Å²	21	56.3 Å²	56.3	9%	0.091	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	124.8	175.1	-51.3	-163.7	-175.4	-157.3	0	109.7	V71 E72 E73 L100 F101 Q103	V71-K91 HydrophobicContact CG1-CB 3.45Å; V71-K91 VanDerWaalsContact CG1-CB 3.45Å; V71-K91 HydrophobicContact CG1-CD 4.15Å; V71-K91 HydrophobicContact CG1-CG 4.37Å; E72-K91 CarbonylContact O-C 3.5Å; E72-K91 VanDerWaalsContact O-CA 3.31Å; E72-K91 WeakPolarHBondContact O-CA 3.2Å; E73-K91 HydrophobicContact CG-CD 4.19Å; E73-K91 HydrophobicContact CG-CG 4.36Å; E73-K91 WeakPolarHBondContact OE1-CE 3.23Å; E73-K91 IonicContact OE1-NZ 2.94Å; E73-K91 PolarHBondContact OE1-NZ 3Å; K91-L100 PolarHBondContact O-N 3.17Å; K91-F101 HydrophobicContact CB-CB 4.2Å; K91-F101 PolarHBondContact N-O 3.2Å; K91-F101 PolarHBondContact O-N 3.13Å; K91-F101 VanDerWaalsContact O-N 3.16Å; K91-Q103 VanDerWaalsContact CE-OE1 3.23Å
92	K	95.2	Very high	92.3	Very high	58 Å²	58	53.9 Å²	53.9	25%	0.252	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	160.6	-173	-75.6	-179.6	156.2	172.1	0	111.9	V71 E72 E74 G94 G97 L98	V71-K92 CarbonylContact C-O 3.59Å; V71-K92 VanDerWaalsContact CA-O 3.31Å; V71-K92 WeakPolarHBondContact CA-O 3.48Å; E72-K92 PolarHBondContact N-O 3Å; E72-K92 PolarHBondContact O-N 3.25Å; E74-K92 HydrophobicContact CB-CD 4.27Å; E74-K92 HydrophobicContact CB-CG 4.49Å; E74-K92 VanDerWaalsContact CD-CE 3.4Å; E74-K92 HydrophobicContact CG-CD 4.42Å; E74-K92 WeakPolarHBondContact OE1-CE 3.4Å; E74-K92 IonicContact OE1-NZ 2.81Å; E74-K92 PolarHBondContact OE1-NZ 2.87Å; E74-K92 WeakPolarHBondContact OE2-CD 3.31Å; E74-K92 WeakPolarHBondContact OE2-CE 3.45Å; E74-K92 IonicContact OE2-NZ 3.92Å; E74-K92 PolarHBondContact OE2-NZ 3.22Å; K92-G94 PolarHBondContact O-N 3.15Å; K92-G97 VanDerWaalsContact CD-O 3.28Å; K92-G97 WeakPolarHBondContact CD-O 3.36Å; K92-G97 VanDerWaalsContact CE-O 3.26Å; K92-G97 WeakPolarHBondContact CE-O 3.31Å; K92-G97 WeakPolarHBondContact CG-O 3.47Å; K92-L98 CarbonylContact C-O 3.49Å; K92-L98 WeakPolarHBondContact CA-O 3.47Å
93	C	95.1	Very high	92.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	126.4	169.2	-174	0	0	0	0	110.1	C34 K95 G97 L98 L100	C34-C93 VanDerWaalsContact SG-SG 3.62Å; C93-K95 PolarHBondContact O-N 3.33Å; C93-K95 VanDerWaalsContact O-N 3.08Å; C93-G97 VanDerWaalsContact O-CA 3.27Å; C93-G97 WeakPolarHBondContact O-CA 3.45Å; C93-G97 PolarHBondContact O-N 3.02Å; C93-L98 HydrophobicContact CB-CB 4.39Å; C93-L98 PolarHBondContact N-O 3.35Å; C93-L100 HydrophobicContact CB-CD1 3.75Å; C93-L100 HydrophobicContact CB-CG 4.24Å
94	G	92.6	Very high	92.8	Very high	32 Å²	32	44.4 Å²	44.4	33%	0.33	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-9.8	179.2	0	0	0	0	0	115.3	N70 K92	N70-G94 PolarHBondContact O-N 2.94Å; K92-G94 PolarHBondContact O-N 3.15Å
95	K	91.9	Very high	92.6	Very high	143 Å²	143	48.9 Å²	48.9	62%	0.622	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-48.6	177.7	-179.2	176	176.2	-171.4	0	113.9	C93	C93-K95 PolarHBondContact O-N 3.33Å; C93-K95 VanDerWaalsContact O-N 3.08Å
96	C	93.1	Very high	91.8	Very high	69 Å²	69	47.6 Å²	47.6	47%	0.466	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-3.7	-174.9	64	0	0	0	0	114	C34 L98	C34-C96 HydrophobicContact CB-CB 3.95Å; C96-L98 PolarHBondContact O-N 3.19Å; C96-L98 VanDerWaalsContact SG-CB 3.59Å
97	G	91.2	Very high	91.1	Very high	34 Å²	34	55.2 Å²	55.2	35%	0.351	27%	0.273	S	S	.	.			trans	69.7	8.6	-178.5	0	0	0	0	0	115.1	K92 C93 L99	K92-G97 VanDerWaalsContact CD-O 3.28Å; K92-G97 WeakPolarHBondContact CD-O 3.36Å; K92-G97 VanDerWaalsContact CE-O 3.26Å; K92-G97 WeakPolarHBondContact CE-O 3.31Å; K92-G97 WeakPolarHBondContact CG-O 3.47Å; C93-G97 VanDerWaalsContact O-CA 3.27Å; C93-G97 WeakPolarHBondContact O-CA 3.45Å; C93-G97 PolarHBondContact O-N 3.02Å; G97-L99 PolarHBondContact O-N 3.32Å
98	L	94.1	Very high	90.1	Very high	60 Å²	60	57 Å²	57	31%	0.314	29%	0.292	S	S	.	.			trans	-61.5	136.6	177.8	-177.1	66.8	0	0	0	110.4	L33 K92 C93 C96 L100	L33-L98 HydrophobicContact CB-CD2 4.26Å; L33-L98 HydrophobicContact CD1-CD2 3.82Å; L33-L98 HydrophobicContact CG-CD2 3.96Å; K92-L98 CarbonylContact C-O 3.49Å; K92-L98 WeakPolarHBondContact CA-O 3.47Å; C93-L98 HydrophobicContact CB-CB 4.39Å; C93-L98 PolarHBondContact N-O 3.35Å; C96-L98 PolarHBondContact O-N 3.19Å; C96-L98 VanDerWaalsContact SG-CB 3.59Å; L98-L100 HydrophobicContact CD2-CD2 4.21Å; L98-L100 HydrophobicContact CG-CD2 4.46Å; L98-L100 PolarHBondContact O-N 2.98Å
99	L	94.7	Very high	89.4	Confident	40 Å²	40	57.5 Å²	57.5	21%	0.209	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	117.9	173.9	-179.5	64.1	0	0	0	110.2	R90 G97 V115	R90-L99 HydrophobicContact CB-CD1 3.55Å; R90-L99 HydrophobicContact CG-CD1 3.68Å; G97-L99 PolarHBondContact O-N 3.32Å; L99-V115 HydrophobicContact CD2-CG2 4.1Å; L99-V115 HydrophobicContact CG-CG2 3.97Å
100	L	94.8	Very high	89	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-50.6	-175.6	-63.2	172.7	0	0	0	112	C32 V38 V71 K91 C93 L98 V115 A118 V119	C32-L100 HydrophobicContact CB-CD2 4.11Å; V38-L100 HydrophobicContact CB-CD1 3.82Å; V38-L100 HydrophobicContact CG1-CD1 3.56Å; V38-L100 HydrophobicContact CG2-CD1 4.18Å; V71-L100 HydrophobicContact CG2-CD1 4.04Å; K91-L100 PolarHBondContact O-N 3.17Å; C93-L100 HydrophobicContact CB-CD1 3.75Å; C93-L100 HydrophobicContact CB-CG 4.24Å; L98-L100 HydrophobicContact CD2-CD2 4.21Å; L98-L100 HydrophobicContact CG-CD2 4.46Å; L98-L100 PolarHBondContact O-N 2.98Å; L100-V115 PolarHBondContact O-N 3.14Å; L100-A118 HydrophobicContact CD2-CB 4.16Å; L100-A118 WeakPolarHBondContact CD2-O 3.4Å; L100-V119 HydrophobicContact CD2-CG1 4.15Å
101	F	94.9	Very high	88.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	157.6	-173.6	-45.3	-74	0	0	0	110.2	V38 L39 F68 V71 K91 T112 F113 I114 V119	V38-F101 HydrophobicContact CB-CE2 4.5Å; V38-F101 HydrophobicContact CG2-CZ 4.41Å; L39-F101 HydrophobicContact CB-CE1 4.46Å; L39-F101 HydrophobicContact CB-CZ 3.88Å; L39-F101 HydrophobicContact CD2-CE1 4.15Å; L39-F101 HydrophobicContact CD2-CZ 4.4Å; F68-F101 AromaticContact CD1-CD2 3.88Å; F68-F101 HydrophobicContact CD1-CD2 3.88Å; F68-F101 HydrophobicContact CD1-CE1 4.45Å; F68-F101 AromaticContact CD1-CE2 3.7Å; F68-F101 HydrophobicContact CD1-CE2 3.7Å; F68-F101 HydrophobicContact CD1-CG 4.35Å; F68-F101 HydrophobicContact CD1-CZ 4.03Å; F68-F101 AromaticContact CE1-CD1 3.94Å; F68-F101 HydrophobicContact CE1-CD1 3.94Å; F68-F101 AromaticContact CE1-CD2 3.95Å; F68-F101 HydrophobicContact CE1-CD2 3.95Å; F68-F101 AromaticContact CE1-CE1 3.99Å; F68-F101 HydrophobicContact CE1-CE1 3.99Å; F68-F101 AromaticContact CE1-CE2 4Å; F68-F101 HydrophobicContact CE1-CE2 4Å; F68-F101 AromaticContact CE1-CG 3.93Å; F68-F101 HydrophobicContact CE1-CG 3.93Å; F68-F101 HydrophobicContact CE1-CZ 4.04Å; V71-F101 HydrophobicContact CG1-CD2 4.3Å; V71-F101 HydrophobicContact CG2-CD2 4.11Å; V71-F101 HydrophobicContact CG2-CE2 3.73Å; K91-F101 HydrophobicContact CB-CB 4.2Å; K91-F101 PolarHBondContact N-O 3.2Å; K91-F101 PolarHBondContact O-N 3.13Å; K91-F101 VanDerWaalsContact O-N 3.16Å; F101-T112 HydrophobicContact CB-CG2 4.07Å; F101-F113 CarbonylContact C-O 3.46Å; F101-F113 WeakPolarHBondContact CA-O 3.17Å; F101-I114 HydrophobicContact CD1-CB 4.19Å; F101-I114 HydrophobicContact CD1-CG1 3.94Å; F101-I114 HydrophobicContact CD1-CG2 4.12Å; F101-I114 HydrophobicContact CE1-CB 4.3Å; F101-I114 HydrophobicContact CE1-CG1 3.95Å; F101-I114 HydrophobicContact CE1-CG2 3.87Å; F101-V119 HydrophobicContact CE1-CG1 4.28Å; F101-V119 HydrophobicContact CZ-CG1 4.05Å
102	Y	94.1	Very high	88.9	Confident	5 Å²	5	58.3 Å²	58.3	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	156.7	166.1	69.2	-89.9	0	0	0	111.4	R51 D54 A56 Q88 H89 H104 F113 V115	R51-Y102 PolarHBondContact NH1-OH 2.8Å; R51-Y102 VanDerWaalsContact NH1-OH 3.12Å; D54-Y102 PolarHBondContact OD2-OH 2.86Å; A56-Y102 HydrophobicContact CB-CE1 4.16Å; Q88-Y102 HydrophobicContact CB-CD2 4.37Å; Q88-Y102 HydrophobicContact CG-CD2 3.97Å; Q88-Y102 HydrophobicContact CG-CE2 4.44Å; H89-Y102 CarbonylContact O-C 3.6Å; H89-Y102 WeakPolarHBondContact O-CA 3.44Å; Y102-H104 AromaticContact CE2-CE1 3.8Å; Y102-F113 HydrophobicContact CD1-CB 3.88Å; Y102-F113 HydrophobicContact CD2-CB 3.95Å; Y102-F113 HydrophobicContact CD2-CD2 4.17Å; Y102-F113 HydrophobicContact CD2-CG 4.25Å; Y102-F113 HydrophobicContact CE1-CB 3.43Å; Y102-F113 VanDerWaalsContact CE1-CB 3.43Å; Y102-F113 HydrophobicContact CE1-CG 4.33Å; Y102-F113 HydrophobicContact CE2-CB 3.47Å; Y102-F113 VanDerWaalsContact CE2-CB 3.47Å; Y102-F113 HydrophobicContact CE2-CD1 4.26Å; Y102-F113 AromaticContact CE2-CD2 3.72Å; Y102-F113 HydrophobicContact CE2-CD2 3.72Å; Y102-F113 AromaticContact CE2-CG 3.54Å; Y102-F113 HydrophobicContact CE2-CG 3.54Å; Y102-F113 HydrophobicContact CG-CB 4.12Å; Y102-F113 AromaticContact CZ-CG 3.58Å; Y102-F113 PolarHBondContact N-O 3.33Å; Y102-F113 PolarHBondContact O-N 2.76Å; Y102-F113 WeakPolarHBondContact OH-CB 3.28Å; Y102-V115 HydrophobicContact CD1-CG2 3.91Å; Y102-V115 HydrophobicContact CE1-CG2 4.28Å
103	Q	92.8	Very high	88.9	Confident	17 Å²	17	56.6 Å²	56.6	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	153	176.3	-68.6	172.3	-31.6	0	0	109	Q88 H89 K91 S109 T112	Q88-Q103 CarbonylContact C-O 3.54Å; Q88-Q103 WeakPolarHBondContact CA-O 3.35Å; H89-Q103 HydrophobicContact CB-CB 4.38Å; H89-Q103 PolarHBondContact CD2-O 2.86Å; H89-Q103 PolarHBondContact N-O 3.38Å; H89-Q103 PolarHBondContact O-N 3.14Å; K91-Q103 VanDerWaalsContact CE-OE1 3.23Å; Q103-S109 WeakPolarHBondContact CG-OG 3.32Å; Q103-S109 PolarHBondContact NE2-OG 2.74Å; Q103-T112 HydrophobicContact CG-CG2 3.95Å; Q103-T112 PolarHBondContact NE2-OG1 2.9Å
104	H	89.4	Confident	88.9	Confident	63 Å²	63	56.8 Å²	56.8	29%	0.292	31%	0.31	S	S	.	.	S	Bend	trans	-86.5	-16.9	176.7	-72	79.3	0	0	0	112.6	E86 Y102 F113	E86-H104 IonicContact OE1-CE1 2.77Å; E86-H104 IonicContact OE1-NE2 3.76Å; E86-H104 PolarHBondContact OE1-NE2 3.1Å; Y102-H104 AromaticContact CE2-CE1 3.8Å; H104-F113 AromaticContact CE1-CD2 3.91Å; H104-F113 AromaticContact CE1-CE2 3.47Å; H104-F113 VanDerWaalsContact CE1-CE2 3.47Å; H104-F113 WeakPolarHBondContact CE1-CE2 3.48Å; H104-F113 AromaticContact CE1-CZ 3.64Å; H104-F113 AromaticContact ND1-CD2 3.62Å; H104-F113 AromaticContact ND1-CE2 3.08Å; H104-F113 WeakPolarHBondContact ND1-CE2 3.27Å; H104-F113 AromaticContact ND1-CZ 3.66Å
105	Q	85.3	Confident	89	Confident	130 Å²	130	57.2 Å²	57.2	61%	0.607	31%	0.306	S	S	*	.	S	Bend	trans	-135	145.2	175.1	-60.9	-160.8	5.7	0	0	109.6
106	D	74	Confident	89.1	Confident	95 Å²	95	54.6 Å²	54.6	51%	0.508	30%	0.299	S	S	.	.	S	Bend	trans	-65.8	-43.6	177.7	-82.9	-48.4	0	0	0	113.2	Q76 H89	Q76-D106 PolarHBondContact NE2-OD2 2.84Å; H89-D106 IonicContact CE1-OD1 3.95Å; H89-D106 PolarHBondContact CE1-OD1 2.87Å; H89-D106 IonicContact CE1-OD2 3.27Å; H89-D106 PolarHBondContact CE1-OD2 3.37Å; H89-D106 IonicContact CG-OD1 3.66Å; H89-D106 IonicContact ND1-OD1 2.63Å; H89-D106 PolarHBondContact ND1-OD1 2.9Å; H89-D106 IonicContact ND1-OD2 2.96Å; H89-D106 PolarHBondContact ND1-OD2 2.8Å; H89-D106 IonicContact NE2-OD2 3.69Å
107	K	74.6	Confident	88.9	Confident	181 Å²	181	53.8 Å²	53.8	79%	0.787	30%	0.302	S	S	*	.	S	Bend	trans	-114.9	129.3	-169.5	-63.3	-176	-177.4	-178.4	0	109.9	S109	K107-S109 VanDerWaalsContact C-N 3.31Å; K107-S109 PolarHBondContact O-N 3.08Å
108	N	70.4	Confident	89	Confident	162 Å²	162	52.4 Å²	52.4	87%	0.866	29%	0.287	S	S	*	.	S	Bend	trans	57.9	35.9	173.8	-159.8	31	0	0	0	114.6	P110	N108-P110 VanDerWaalsContact O-CD 3.32Å; N108-P110 WeakPolarHBondContact O-CD 3.36Å
109	S	78.3	Confident	88.9	Confident	18 Å²	18	50.1 Å²	50.1	13%	0.126	28%	0.276	C	S	.	.			trans	-69	120.5	173	65.2	0	0	0	0	109.5	Q103 K107 A111	Q103-S109 WeakPolarHBondContact CG-OG 3.32Å; Q103-S109 PolarHBondContact NE2-OG 2.74Å; K107-S109 VanDerWaalsContact C-N 3.31Å; K107-S109 PolarHBondContact O-N 3.08Å; S109-A111 PolarHBondContact O-N 3Å
110	P	84.4	Confident	88.8	Confident	88 Å²	88	49.7 Å²	49.7	57%	0.571	28%	0.275	S	S	*	.	S	Bend	trans	-69.2	-26.6	178	28.1	-34.4	0	0	0	111.5	D60 A61 N108	D60-P110 WeakPolarHBondContact CA-O 3.47Å; A61-P110 PolarHBondContact N-O 2.89Å; N108-P110 VanDerWaalsContact O-CD 3.32Å; N108-P110 WeakPolarHBondContact O-CD 3.36Å
111	A	91.8	Very high	88.6	Confident	28 Å²	28	51.9 Å²	51.9	23%	0.231	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.2	-175.7	0	0	0	0	0	111.5	V58 I59 S109 F113	V58-A111 HydrophobicContact CG1-CB 3.76Å; I59-A111 CarbonylContact O-C 3.54Å; I59-A111 WeakPolarHBondContact O-CA 3.2Å; S109-A111 PolarHBondContact O-N 3Å; A111-F113 HydrophobicContact CB-CE2 4.02Å; A111-F113 HydrophobicContact CB-CZ 4.13Å
112	T	94	Very high	87.7	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.012	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.2	169.5	-54.7	0	0	0	0	109.8	I59 F68 F101 Q103	I59-T112 PolarHBondContact N-O 2.84Å; I59-T112 PolarHBondContact O-N 3.31Å; F68-T112 HydrophobicContact CE1-CG2 4.32Å; F68-T112 HydrophobicContact CE2-CG2 4.38Å; F68-T112 HydrophobicContact CZ-CG2 3.64Å; F101-T112 HydrophobicContact CB-CG2 4.07Å; Q103-T112 HydrophobicContact CG-CG2 3.95Å; Q103-T112 PolarHBondContact NE2-OG1 2.9Å
113	F	94.9	Very high	86.6	Confident	22 Å²	22	59.8 Å²	59.8	10%	0.096	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128	-176.2	-60	-96.2	0	0	0	109.5	A56 R57 V58 F101 Y102 H104 A111	A56-F113 HydrophobicContact CB-CB 4.28Å; A56-F113 HydrophobicContact CB-CD1 4.47Å; R57-F113 CarbonylContact O-C 3.59Å; R57-F113 WeakPolarHBondContact O-CA 3.47Å; V58-F113 HydrophobicContact CB-CD1 4.43Å; V58-F113 HydrophobicContact CB-CE1 4.36Å; V58-F113 HydrophobicContact CG1-CD1 4.26Å; V58-F113 HydrophobicContact CG1-CE1 3.94Å; V58-F113 HydrophobicContact CG1-CZ 4.22Å; V58-F113 HydrophobicContact CG2-CD1 3.63Å; V58-F113 HydrophobicContact CG2-CE1 3.54Å; F101-F113 CarbonylContact C-O 3.46Å; F101-F113 WeakPolarHBondContact CA-O 3.17Å; Y102-F113 HydrophobicContact CD1-CB 3.88Å; Y102-F113 HydrophobicContact CD2-CB 3.95Å; Y102-F113 HydrophobicContact CD2-CD2 4.17Å; Y102-F113 HydrophobicContact CD2-CG 4.25Å; Y102-F113 HydrophobicContact CE1-CB 3.43Å; Y102-F113 VanDerWaalsContact CE1-CB 3.43Å; Y102-F113 HydrophobicContact CE1-CG 4.33Å; Y102-F113 HydrophobicContact CE2-CB 3.47Å; Y102-F113 VanDerWaalsContact CE2-CB 3.47Å; Y102-F113 HydrophobicContact CE2-CD1 4.26Å; Y102-F113 AromaticContact CE2-CD2 3.72Å; Y102-F113 HydrophobicContact CE2-CD2 3.72Å; Y102-F113 AromaticContact CE2-CG 3.54Å; Y102-F113 HydrophobicContact CE2-CG 3.54Å; Y102-F113 HydrophobicContact CG-CB 4.12Å; Y102-F113 AromaticContact CZ-CG 3.58Å; Y102-F113 PolarHBondContact N-O 3.33Å; Y102-F113 PolarHBondContact O-N 2.76Å; Y102-F113 WeakPolarHBondContact OH-CB 3.28Å; H104-F113 AromaticContact CE1-CD2 3.91Å; H104-F113 AromaticContact CE1-CE2 3.47Å; H104-F113 VanDerWaalsContact CE1-CE2 3.47Å; H104-F113 WeakPolarHBondContact CE1-CE2 3.48Å; H104-F113 AromaticContact CE1-CZ 3.64Å; H104-F113 AromaticContact ND1-CD2 3.62Å; H104-F113 AromaticContact ND1-CE2 3.08Å; H104-F113 WeakPolarHBondContact ND1-CE2 3.27Å; H104-F113 AromaticContact ND1-CZ 3.66Å; A111-F113 HydrophobicContact CB-CE2 4.02Å; A111-F113 HydrophobicContact CB-CZ 4.13Å
114	I	95.4	Very high	85.3	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.015	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.9	173.2	-46.2	177	0	0	0	107.9	L39 L45 L48 A56 R57 I59 F101 V119	L39-I114 HydrophobicContact CD2-CD1 3.9Å; L45-I114 HydrophobicContact CD1-CD1 3.92Å; L45-I114 HydrophobicContact CD2-CD1 4.28Å; L45-I114 HydrophobicContact CG-CD1 4.1Å; L48-I114 HydrophobicContact CD1-CD1 3.99Å; A56-I114 WeakPolarHBondContact CA-O 3.41Å; A56-I114 VanDerWaalsContact CB-O 3.24Å; A56-I114 WeakPolarHBondContact CB-O 3.32Å; R57-I114 HydrophobicContact CB-CB 4.28Å; R57-I114 HydrophobicContact CB-CD1 4.21Å; R57-I114 HydrophobicContact CB-CG1 4.46Å; R57-I114 PolarHBondContact N-O 2.9Å; R57-I114 VanDerWaalsContact N-O 3.16Å; R57-I114 PolarHBondContact O-N 3.18Å; I59-I114 HydrophobicContact CD1-CD1 3.68Å; I59-I114 HydrophobicContact CD1-CG1 3.8Å; I59-I114 HydrophobicContact CG1-CD1 3.85Å; I59-I114 HydrophobicContact CG1-CG1 4.04Å; F101-I114 HydrophobicContact CD1-CB 4.19Å; F101-I114 HydrophobicContact CD1-CG1 3.94Å; F101-I114 HydrophobicContact CD1-CG2 4.12Å; F101-I114 HydrophobicContact CE1-CB 4.3Å; F101-I114 HydrophobicContact CE1-CG1 3.95Å; F101-I114 HydrophobicContact CE1-CG2 3.87Å; I114-V119 HydrophobicContact CG2-CG1 4.4Å; I114-V119 HydrophobicContact CG2-CG2 3.76Å
115	V	94.8	Very high	83.7	Confident	41 Å²	41	63.9 Å²	63.9	25%	0.248	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-66	135.6	175.1	177.2	0	0	0	0	109.9	L99 L100 Y102 G117 A118	L99-V115 HydrophobicContact CD2-CG2 4.1Å; L99-V115 HydrophobicContact CG-CG2 3.97Å; L100-V115 PolarHBondContact O-N 3.14Å; Y102-V115 HydrophobicContact CD1-CG2 3.91Å; Y102-V115 HydrophobicContact CE1-CG2 4.28Å; V115-G117 PolarHBondContact O-N 2.96Å; V115-A118 HydrophobicContact CB-CB 3.84Å; V115-A118 HydrophobicContact CG1-CB 4.2Å; V115-A118 WeakPolarHBondContact O-CB 3.44Å; V115-A118 PolarHBondContact O-N 3.13Å; V115-A118 VanDerWaalsContact O-N 3.16Å
116	D	93.3	Very high	81.9	Confident	88 Å²	88	68 Å²	68	47%	0.471	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	132	-179.3	-167.8	26.8	0	0	0	110.8	R55 A118	R55-D116 HydrophobicContact CB-CB 4.36Å; R55-D116 IonicContact NE-OD2 3.48Å; D116-A118 PolarHBondContact O-N 3.2Å; D116-A118 VanDerWaalsContact O-N 3.15Å
117	G	90.6	Very high	80.8	Confident	52 Å²	52	66 Å²	66	54%	0.536	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	3.9	-178.3	0	0	0	0	0	116.6	V115	V115-G117 PolarHBondContact O-N 2.96Å
118	A	92	Very high	79.6	Confident	5 Å²	5	64.7 Å²	64.7	4%	0.041	38%	0.384	C	S	.	.	S	Bend	trans	-78	-24.6	-177.3	0	0	0	0	0	113.8	L100 V115 D116	L100-A118 HydrophobicContact CD2-CB 4.16Å; L100-A118 WeakPolarHBondContact CD2-O 3.4Å; V115-A118 HydrophobicContact CB-CB 3.84Å; V115-A118 HydrophobicContact CG1-CB 4.2Å; V115-A118 WeakPolarHBondContact O-CB 3.44Å; V115-A118 PolarHBondContact O-N 3.13Å; V115-A118 VanDerWaalsContact O-N 3.16Å; D116-A118 PolarHBondContact O-N 3.2Å; D116-A118 VanDerWaalsContact O-N 3.15Å
119	V	93.1	Very high	78.5	Confident	13 Å²	13	62.7 Å²	62.7	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.5	-179.6	-58.2	0	0	0	0	111.4	Y31 V38 L45 L100 F101 I114	Y31-V119 CarbonylContact O-C 3.56Å; Y31-V119 VanDerWaalsContact O-CA 3.27Å; Y31-V119 WeakPolarHBondContact O-CA 3.37Å; V38-V119 HydrophobicContact CG2-CG1 3.76Å; L45-V119 HydrophobicContact CD2-CG2 3.46Å; L45-V119 VanDerWaalsContact CD2-CG2 3.46Å; L100-V119 HydrophobicContact CD2-CG1 4.15Å; F101-V119 HydrophobicContact CE1-CG1 4.28Å; F101-V119 HydrophobicContact CZ-CG1 4.05Å; I114-V119 HydrophobicContact CG2-CG1 4.4Å; I114-V119 HydrophobicContact CG2-CG2 3.76Å
120	V	92.3	Very high	76.9	Confident	30 Å²	30	66.2 Å²	66.2	18%	0.182	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.6	-177.8	-66.5	0	0	0	0	110.8	Y30 Y31 L33	Y30-V120 WeakPolarHBondContact CA-O 3.43Å; Y31-V120 PolarHBondContact N-O 2.96Å; Y31-V120 PolarHBondContact O-N 3.28Å; L33-V120 HydrophobicContact CD2-CG1 3.87Å
121	K	89.6	Confident	75.4	Confident	47 Å²	47	68 Å²	68	20%	0.204	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	156.6	167	-69.4	176.7	-175.1	157	0	109.4	Y30 E46 G123 Q124	Y30-K121 HydrophobicContact CD1-CG 3.83Å; Y30-K121 HydrophobicContact CE1-CD 4.19Å; Y30-K121 HydrophobicContact CE1-CG 3.46Å; Y30-K121 VanDerWaalsContact CE1-CG 3.46Å; Y30-K121 WeakPolarHBondContact OH-CE 3.47Å; E46-K121 IonicContact OE1-NZ 3.7Å; E46-K121 PolarHBondContact OE1-NZ 3.05Å; E46-K121 IonicContact OE2-NZ 3.71Å; E46-K121 PolarHBondContact OE2-NZ 3.5Å; K121-G123 PolarHBondContact O-N 3.47Å; K121-Q124 PolarHBondContact O-N 3.45Å; K121-Q124 VanDerWaalsContact O-N 3.08Å
122	F	76.3	Confident	73.3	Confident	103 Å²	103	75.3 Å²	75.3	45%	0.452	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	129.9	172.2	-167.4	-98.2	0	0	0	110.2	Y31 Q124 Y132	Y31-F122 HydrophobicContact CD2-CB 4.3Å; Y31-F122 HydrophobicContact CE2-CB 3.77Å; Y31-F122 HydrophobicContact CE2-CD2 4.08Å; Y31-F122 HydrophobicContact CE2-CG 4.42Å; F122-Q124 VanDerWaalsContact C-N 3.33Å; F122-Q124 PolarHBondContact O-N 3.01Å; F122-Y132 WeakPolarHBondContact CZ-O 3.24Å
123	G	70.3	Confident	71.1	Confident	68 Å²	68	79.4 Å²	79.4	70%	0.701	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-3.2	-178.4	0	0	0	0	0	116.4	K121	K121-G123 PolarHBondContact O-N 3.47Å
124	Q	66.1	Low	69	Low	141 Å²	141	86.1 Å²	86.1	66%	0.659	49%	0.494	S	S	*	.	S	Bend	trans	-109.9	13.8	178	-95.2	-178.5	-18.9	0	0	113.9	K121 F122	K121-Q124 PolarHBondContact O-N 3.45Å; K121-Q124 VanDerWaalsContact O-N 3.08Å; F122-Q124 VanDerWaalsContact C-N 3.33Å; F122-Q124 PolarHBondContact O-N 3.01Å
125	G	55.8	Low	66.8	Low	25 Å²	25	94.1 Å²	94.1	26%	0.258	53%	0.529	S	S	.	.	S	Bend	trans	-107.8	156.4	-178.8	0	0	0	0	0	114.3	G127	G125-G127 PolarHBondContact O-N 3.11Å
126	F	48.2	Very low	64.4	Low	217 Å²	217	97.5 Å²	97.5	95%	0.952	55%	0.552	S	S	*	*	S	Bend	trans	-68.5	94.5	175.9	-151.5	-90	0	0	0	109.9
127	G	51.3	Low	62.3	Low	52 Å²	52	99.1 Å²	99.1	54%	0.536	57%	0.567	S	S	.	*			trans	136.5	93.1	-179.2	0	0	0	0	0	111.4	G125 T129	G125-G127 PolarHBondContact O-N 3.11Å; G127-T129 PolarHBondContact O-N 3.22Å
128	N	48.8	Very low	60.4	Low	154 Å²	154	105.1 Å²	105.1	82%	0.824	58%	0.581	S	S	*	*			trans	-69.9	65.5	172.3	-67.3	-26.6	0	0	0	111	S130	N128-S130 VanDerWaalsContact C-N 3.33Å; N128-S130 PolarHBondContact O-N 3.39Å
129	T	47.1	Very low	58.2	Low	120 Å²	120	108.9 Å²	108.9	74%	0.736	61%	0.613	S	S	*	*			trans	-94.9	71.3	166.5	50	0	0	0	0	109.1	G127 V131	G127-T129 PolarHBondContact O-N 3.22Å; T129-V131 PolarHBondContact O-N 2.77Å; T129-V131 VanDerWaalsContact O-N 3.14Å
130	S	45.7	Very low	55.8	Low	92 Å²	92	113 Å²	113	64%	0.643	64%	0.64	S	S	*	*			trans	-70.8	100.7	170.5	67.3	0	0	0	0	109.7	N128	N128-S130 VanDerWaalsContact C-N 3.33Å; N128-S130 PolarHBondContact O-N 3.39Å
131	V	51.8	Low	54	Low	125 Å²	125	120.6 Å²	120.6	76%	0.758	67%	0.67	S	S	*	*	S	Bend	trans	-110.6	-12.4	167	-177.7	0	0	0	0	111.9	T129	T129-V131 PolarHBondContact O-N 2.77Å; T129-V131 VanDerWaalsContact O-N 3.14Å
132	Y	47.3	Very low	51.9	Low	182 Å²	182	127 Å²	127	71%	0.714	70%	0.698	S	S	*	*			trans	-144	65.1	175.9	-112.8	-89.8	0	0	0	111.5	F122	F122-Y132 WeakPolarHBondContact CZ-O 3.24Å
133	S	48.1	Very low	50.6	Low	88 Å²	88	128 Å²	128	62%	0.615	71%	0.713	S	S	*	*			trans	-97.7	79	160.7	-136.3	0	0	0	0	107.8
134	Q	50.5	Low	49.5	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	71%	0.712	S	S	*	*			trans	-113.7	61.6	162.9	-73.3	-170.9	-21.9	0	0	108.4
135	K	49.3	Very low	48.6	Very low	172 Å²	172	132.7 Å²	132.7	75%	0.748	72%	0.716	S	S	*	*			trans	-134.1	107.3	147.1	-112.6	-174.7	177.2	-171.7	0	105.2
136	P	45.2	Very low	48.3	Very low	111 Å²	111	138.8 Å²	138.8	72%	0.721	74%	0.74	S	S	*	*			trans	-55.2	135.9	165.4	9.1	-7.1	0	0	0	107.2	E138	P136-E138 PolarHBondContact O-N 3.2Å; P136-E138 VanDerWaalsContact O-N 3.13Å
137	P	48.2	Very low	48.3	Very low	122 Å²	122	136.6 Å²	136.6	79%	0.792	74%	0.735	S	S	*	*			trans	-54.9	123.7	172.2	22.9	-30.6	0	0	0	107.5	A139	P137-A139 PolarHBondContact O-N 3.46Å
138	E	50.4	Low	48.4	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	73%	0.734	S	S	*	*			trans	-52.8	113.7	172.5	-76.8	175.2	-176.4	0	0	107.7	P136	P136-E138 PolarHBondContact O-N 3.2Å; P136-E138 VanDerWaalsContact O-N 3.13Å
139	A	46.1	Very low	48.8	Very low	85 Å²	85	138.9 Å²	138.9	70%	0.702	73%	0.73	S	S	*	*			trans	-58.3	132.6	-177.2	0	0	0	0	0	108.5	P137 K141	P137-A139 PolarHBondContact O-N 3.46Å; A139-K141 PolarHBondContact O-N 3.03Å
140	P	44.1	Very low	49.2	Very low	100 Å²	100	142.9 Å²	142.9	65%	0.649	73%	0.731	S	S	*	*			trans	-57.9	128.3	173.1	24.1	-31.8	0	0	0	107.9	K142	P140-K142 VanDerWaalsContact C-N 3.34Å; P140-K142 WeakPolarHBondContact O-CG 3.47Å; P140-K142 PolarHBondContact O-N 2.96Å
141	K	53.3	Low	49.9	Very low	188 Å²	188	142.2 Å²	142.2	82%	0.817	72%	0.724	S	S	*	*			trans	-53.3	95.9	176.1	-67.2	-177.4	179.9	-173.6	0	108.8	A139 V143	A139-K141 PolarHBondContact O-N 3.03Å; K141-V143 PolarHBondContact O-N 2.93Å
142	K	45.2	Very low	50.1	Low	181 Å²	181	144.1 Å²	144.1	79%	0.787	72%	0.722	S	S	*	*			trans	-79.6	110.9	178.2	-70.7	-177.5	-172.4	172.8	0	107.7	P140 R144	P140-K142 VanDerWaalsContact C-N 3.34Å; P140-K142 WeakPolarHBondContact O-CG 3.47Å; P140-K142 PolarHBondContact O-N 2.96Å; K142-R144 PolarHBondContact O-N 3.21Å; K142-R144 VanDerWaalsContact O-N 3.11Å
143	V	49.9	Very low	50.3	Low	126 Å²	126	141.3 Å²	141.3	76%	0.764	72%	0.719	S	S	*	*			trans	-58.4	113.8	170.5	176.5	0	0	0	0	107.9	K141 V145	K141-V143 PolarHBondContact O-N 2.93Å; V143-V145 HydrophobicContact CG1-CG2 4.4Å; V143-V145 PolarHBondContact O-N 3.2Å
144	R	48	Very low	50.6	Low	184 Å²	184	145.7 Å²	145.7	69%	0.694	73%	0.732	S	S	*	*			trans	-65	101.3	174.8	-78	-177.4	148.3	-176.4	-6.3	109.4	K142 M146 E167	K142-R144 PolarHBondContact O-N 3.21Å; K142-R144 VanDerWaalsContact O-N 3.11Å; R144-M146 PolarHBondContact O-N 2.68Å; R144-E167 IonicContact CZ-OE2 2.58Å; R144-E167 IonicContact NE-OE2 3.23Å; R144-E167 IonicContact NH2-OE2 3.85Å; R144-E167 PolarHBondContact NH2-OE2 3.27Å
145	V	46.6	Very low	51.1	Low	122 Å²	122	141.2 Å²	141.2	74%	0.739	73%	0.729	S	S	*	*			trans	-90.1	97.3	171.2	-179.1	0	0	0	0	108	V143 M147	V143-V145 HydrophobicContact CG1-CG2 4.4Å; V143-V145 PolarHBondContact O-N 3.2Å; V145-M147 PolarHBondContact O-N 3.26Å
146	M	48.5	Very low	51.5	Low	154 Å²	154	141.7 Å²	141.7	76%	0.759	73%	0.731	S	S	*	*			trans	-79.7	114.3	171.3	-65.6	-177.2	-160.5	0	0	109.6	R144 T148	R144-M146 PolarHBondContact O-N 2.68Å; M146-T148 PolarHBondContact O-N 2.95Å
147	M	49.2	Very low	51.6	Low	170 Å²	170	143.7 Å²	143.7	84%	0.837	73%	0.729	S	S	*	*			trans	-84.9	111.5	169	-74.6	-170.7	90.5	0	0	109.8	V145	V145-M147 PolarHBondContact O-N 3.26Å
148	T	52.9	Low	51.6	Low	85 Å²	85	141.1 Å²	141.1	52%	0.521	71%	0.714	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.9	109.7	168.4	49.1	0	0	0	0	109.3	M146 T161	M146-T148 PolarHBondContact O-N 2.95Å; T148-T161 HydrophobicContact CG2-CG2 4.13Å
149	K	58	Low	51.5	Low	169 Å²	169	137 Å²	137	74%	0.735	71%	0.705	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.2	113.6	172.2	-162.7	175.8	-179.1	179.5	0	108.6
150	R	54.9	Low	51.7	Low	204 Å²	204	137.6 Å²	137.6	77%	0.77	70%	0.7	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.8	117.9	173.4	-63.2	-178.6	-176.6	-170.8	-0.2	108.5
151	T	61.1	Low	52.2	Low	79 Å²	79	137.5 Å²	137.5	49%	0.485	70%	0.697	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.9	134.5	168	42	0	0	0	0	109.1
152	K	54.6	Low	51.9	Low	164 Å²	164	134.6 Å²	134.6	71%	0.713	70%	0.695	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.1	118.2	172.8	-66.9	-173.1	-179.6	-164.2	0	107.2	F157	K152-F157 HydrophobicContact CD-CD1 4.25Å; K152-F157 HydrophobicContact CD-CE1 3.59Å; K152-F157 HydrophobicContact CG-CD1 3.84Å; K152-F157 HydrophobicContact CG-CE1 3.68Å
153	D	52.4	Low	52.2	Low	123 Å²	123	130.6 Å²	130.6	66%	0.658	69%	0.69	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.2	131.7	162.2	-164.2	12.3	0	0	0	108.9	G155 K156	D153-G155 VanDerWaalsContact C-N 3.3Å; D153-G155 PolarHBondContact O-N 3.34Å; D153-K156 PolarHBondContact O-N 3.47Å
154	M	53.7	Low	52.6	Low	181 Å²	181	129.9 Å²	129.9	89%	0.892	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	37.8	48.5	179.7	-60.3	-60.2	-179.6	0	0	116.3	K156	M154-K156 VanDerWaalsContact C-N 3.32Å; M154-K156 PolarHBondContact O-N 3.28Å
155	G	61.6	Low	53	Low	68 Å²	68	126.7 Å²	126.7	70%	0.701	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.8	4.9	167.8	0	0	0	0	0	116.7	D153	D153-G155 VanDerWaalsContact C-N 3.3Å; D153-G155 PolarHBondContact O-N 3.34Å
156	K	57.3	Low	53.3	Low	181 Å²	181	127 Å²	127	79%	0.787	68%	0.679	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.7	120.1	171.9	-125.5	174.6	-177.3	177.6	0	109.9	D153 M154	D153-K156 PolarHBondContact O-N 3.47Å; M154-K156 VanDerWaalsContact C-N 3.32Å; M154-K156 PolarHBondContact O-N 3.28Å
157	F	46.7	Very low	53.4	Low	153 Å²	153	124.8 Å²	124.8	67%	0.671	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.7	114.2	179.5	-55.7	-68.2	0	0	0	110	K152	K152-F157 HydrophobicContact CD-CD1 4.25Å; K152-F157 HydrophobicContact CD-CE1 3.59Å; K152-F157 HydrophobicContact CG-CD1 3.84Å; K152-F157 HydrophobicContact CG-CE1 3.68Å
158	S	49.2	Very low	53.8	Low	69 Å²	69	123.1 Å²	123.1	48%	0.483	66%	0.657	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.4	121.1	165.4	59.3	0	0	0	0	109.2
159	S	49	Very low	54	Low	92 Å²	92	124.9 Å²	124.9	64%	0.643	66%	0.659	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.4	122.9	169.1	54.3	0	0	0	0	109
160	V	49.7	Very low	54.1	Low	97 Å²	97	123.8 Å²	123.8	59%	0.588	66%	0.657	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.8	115.9	172.9	-179.2	0	0	0	0	107.6	V162	V160-V162 HydrophobicContact CG1-CG2 4.34Å
161	T	53.4	Low	54.7	Low	98 Å²	98	121 Å²	121	60%	0.601	65%	0.653	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96.6	118	173.1	48.7	0	0	0	0	108.1	T148	T148-T161 HydrophobicContact CG2-CG2 4.13Å
162	V	48.6	Very low	54.7	Low	127 Å²	127	121.5 Å²	121.5	77%	0.77	65%	0.651	S	S	*	*			trans	-98.6	111.6	172.7	-179.1	0	0	0	0	107.4	V160	V160-V162 HydrophobicContact CG1-CG2 4.34Å
163	S	50.8	Low	55.4	Low	96 Å²	96	119.5 Å²	119.5	67%	0.671	64%	0.644	S	S	*	*			trans	-99.2	137.8	170.7	-53.9	0	0	0	0	108.9
164	T	57.7	Low	56.5	Low	112 Å²	112	116.6 Å²	116.6	69%	0.687	64%	0.637	S	S	*	*			trans	-75.4	126.2	169.9	43.8	0	0	0	0	109.1
165	I	57.3	Low	57.6	Low	117 Å²	117	116.7 Å²	116.7	60%	0.6	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-12.7	-169.8	-71.9	163	0	0	0	112.9	E167 E168	I165-E167 PolarHBondContact O-N 3Å; I165-E167 VanDerWaalsContact O-N 3.14Å; I165-E168 PolarHBondContact O-N 3.05Å
166	D	52.4	Low	58.3	Low	128 Å²	128	119.5 Å²	119.5	68%	0.684	62%	0.623	S	S	*	*	H	α-helix	trans	-67.8	-16.7	-173	-54.3	-24.7	0	0	0	114.6
167	E	52	Low	59.3	Low	108 Å²	108	114.5 Å²	114.5	51%	0.505	61%	0.607	S	S	.	*	H	α-helix	trans	-84.4	-20	177.4	-73.9	-176.3	173.9	0	0	113.5	R144 I165	R144-E167 IonicContact CZ-OE2 2.58Å; R144-E167 IonicContact NE-OE2 3.23Å; R144-E167 IonicContact NH2-OE2 3.85Å; R144-E167 PolarHBondContact NH2-OE2 3.27Å; I165-E167 PolarHBondContact O-N 3Å; I165-E167 VanDerWaalsContact O-N 3.14Å
168	E	56.1	Low	61	Low	134 Å²	134	110 Å²	110	63%	0.626	60%	0.598	S	S	*	*	H	α-helix	trans	-84.3	-32.5	-177.2	-162.2	168.1	-162.3	0	0	111.7	I165 I172	I165-E168 PolarHBondContact O-N 3.05Å; E168-I172 HydrophobicContact CG-CD1 4.29Å; E168-I172 VanDerWaalsContact O-CD1 3.29Å; E168-I172 WeakPolarHBondContact O-CD1 3.29Å; E168-I172 WeakPolarHBondContact O-CG1 3.42Å; E168-I172 PolarHBondContact O-N 3.47Å
169	E	57.2	Low	62.7	Low	122 Å²	122	111.2 Å²	111.2	57%	0.57	60%	0.599	S	S	*	*	H	α-helix	trans	-65.9	-43.7	174.6	-77.7	-174.3	150.7	0	0	112.1	E171 I172 E173	E169-E171 VanDerWaalsContact C-N 3.32Å; E169-E171 PolarHBondContact O-N 3.21Å; E169-I172 PolarHBondContact O-N 3.18Å; E169-E173 WeakPolarHBondContact O-CG 3.4Å; E169-E173 PolarHBondContact O-N 3.03Å
170	E	61.2	Low	64.4	Low	146 Å²	146	109.7 Å²	109.7	68%	0.682	59%	0.589	S	S	*	*	H	α-helix	trans	-68.1	-31.5	-178.8	-165.5	171.5	-156.1	0	0	112.2	A174	E170-A174 WeakPolarHBondContact O-CB 3.19Å; E170-A174 PolarHBondContact O-N 3.48Å
171	E	66.3	Low	66.2	Low	147 Å²	147	113 Å²	113	69%	0.687	59%	0.592	S	S	*	*	H	α-helix	trans	-70.7	-35.7	174.2	-170.4	171.3	-177.2	0	0	112	E169 R175	E169-E171 VanDerWaalsContact C-N 3.32Å; E169-E171 PolarHBondContact O-N 3.21Å; E171-R175 WeakPolarHBondContact O-CB 3.48Å; E171-R175 PolarHBondContact O-N 3.3Å
172	I	62.6	Low	67.8	Low	88 Å²	88	110.5 Å²	110.5	45%	0.451	58%	0.581	S	S	.	*	H	α-helix	trans	-69.6	-44.2	175.4	-65.1	162.9	0	0	0	110.2	E168 E169 A174 R175 E176	E168-I172 HydrophobicContact CG-CD1 4.29Å; E168-I172 VanDerWaalsContact O-CD1 3.29Å; E168-I172 WeakPolarHBondContact O-CD1 3.29Å; E168-I172 WeakPolarHBondContact O-CG1 3.42Å; E168-I172 PolarHBondContact O-N 3.47Å; E169-I172 PolarHBondContact O-N 3.18Å; I172-A174 PolarHBondContact O-N 3Å; I172-R175 WeakPolarHBondContact O-CB 3.45Å; I172-R175 PolarHBondContact O-N 3.18Å; I172-E176 HydrophobicContact CG2-CG 4.48Å; I172-E176 WeakPolarHBondContact O-CG 3.38Å; I172-E176 PolarHBondContact O-N 3.47Å
173	E	68.4	Low	69.8	Low	122 Å²	122	110.7 Å²	110.7	57%	0.57	57%	0.573	S	S	*	*	H	α-helix	trans	-60.8	-44.9	176.8	-73.7	-177	-176.2	0	0	112	E169 R175 E176 V177	E169-E173 WeakPolarHBondContact O-CG 3.4Å; E169-E173 PolarHBondContact O-N 3.03Å; E173-R175 VanDerWaalsContact C-N 3.27Å; E173-R175 PolarHBondContact O-N 3.3Å; E173-E176 PolarHBondContact O-N 3.01Å; E173-V177 WeakPolarHBondContact O-CB 3.49Å; E173-V177 VanDerWaalsContact O-CG2 3.24Å; E173-V177 WeakPolarHBondContact O-CG2 3.41Å; E173-V177 PolarHBondContact O-N 3.48Å
174	A	75.1	Confident	71.1	Confident	62 Å²	62	110.3 Å²	110.3	51%	0.512	56%	0.564	S	S	.	*	H	α-helix	trans	-62	-36.9	177.8	0	0	0	0	0	112.2	E170 I172 A178	E170-A174 WeakPolarHBondContact O-CB 3.19Å; E170-A174 PolarHBondContact O-N 3.48Å; I172-A174 PolarHBondContact O-N 3Å; A174-A178 WeakPolarHBondContact O-CB 3.24Å; A174-A178 PolarHBondContact O-N 3.41Å
175	R	76.7	Confident	72.5	Confident	184 Å²	184	107.6 Å²	107.6	69%	0.694	55%	0.553	S	S	*	*	H	α-helix	trans	-67.8	-44.3	176.6	-172.3	175	-175.6	143.2	1.6	111.9	E171 I172 E173 V177 A178 D179	E171-R175 WeakPolarHBondContact O-CB 3.48Å; E171-R175 PolarHBondContact O-N 3.3Å; I172-R175 WeakPolarHBondContact O-CB 3.45Å; I172-R175 PolarHBondContact O-N 3.18Å; E173-R175 VanDerWaalsContact C-N 3.27Å; E173-R175 PolarHBondContact O-N 3.3Å; R175-V177 VanDerWaalsContact C-N 3.32Å; R175-V177 PolarHBondContact O-N 3.34Å; R175-A178 PolarHBondContact O-N 3.46Å; R175-D179 PolarHBondContact O-N 2.94Å
176	E	76.9	Confident	74	Confident	126 Å²	126	108.4 Å²	108.4	59%	0.589	55%	0.552	S	S	*	*	H	α-helix	trans	-62.9	-39.8	176.9	-71.9	-178.3	173.2	0	0	112	I172 E173 D179 S180	I172-E176 HydrophobicContact CG2-CG 4.48Å; I172-E176 WeakPolarHBondContact O-CG 3.38Å; I172-E176 PolarHBondContact O-N 3.47Å; E173-E176 PolarHBondContact O-N 3.01Å; E176-D179 PolarHBondContact O-N 3.23Å; E176-S180 WeakPolarHBondContact O-CB 3.42Å; E176-S180 PolarHBondContact O-N 3.47Å
177	V	77.8	Confident	75.7	Confident	77 Å²	77	106.4 Å²	106.4	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-64	-45.3	175.7	172	0	0	0	0	110.9	E173 R175 D179 S180 Y181	E173-V177 WeakPolarHBondContact O-CB 3.49Å; E173-V177 VanDerWaalsContact O-CG2 3.24Å; E173-V177 WeakPolarHBondContact O-CG2 3.41Å; E173-V177 PolarHBondContact O-N 3.48Å; R175-V177 VanDerWaalsContact C-N 3.32Å; R175-V177 PolarHBondContact O-N 3.34Å; V177-D179 PolarHBondContact O-N 3.02Å; V177-S180 WeakPolarHBondContact O-CB 3.43Å; V177-S180 PolarHBondContact O-N 3.34Å; V177-Y181 HydrophobicContact CG1-CD2 3.64Å; V177-Y181 HydrophobicContact CG1-CE2 3.42Å; V177-Y181 VanDerWaalsContact CG1-CE2 3.42Å; V177-Y181 WeakPolarHBondContact O-CD2 3.41Å; V177-Y181 PolarHBondContact O-N 3.11Å
178	A	82.1	Confident	77.1	Confident	57 Å²	57	106.2 Å²	106.2	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-61.7	-42.6	177.7	0	0	0	0	0	112.7	A174 R175 S180 Y181 A182	A174-A178 WeakPolarHBondContact O-CB 3.24Å; A174-A178 PolarHBondContact O-N 3.41Å; R175-A178 PolarHBondContact O-N 3.46Å; A178-S180 VanDerWaalsContact C-N 3.33Å; A178-S180 PolarHBondContact O-N 2.98Å; A178-Y181 PolarHBondContact O-N 3.25Å; A178-A182 WeakPolarHBondContact O-CB 3.44Å; A178-A182 PolarHBondContact O-N 3.02Å
179	D	86.6	Confident	78.2	Confident	95 Å²	95	105.2 Å²	105.2	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-37.1	177.4	-76.7	-23	0	0	0	111.8	R175 E176 V177 A182 Q183	R175-D179 PolarHBondContact O-N 2.94Å; E176-D179 PolarHBondContact O-N 3.23Å; V177-D179 PolarHBondContact O-N 3.02Å; D179-A182 PolarHBondContact O-N 3.4Å; D179-Q183 WeakPolarHBondContact O-CG 3.16Å; D179-Q183 PolarHBondContact O-N 3.34Å
180	S	84.1	Confident	79.5	Confident	61 Å²	61	105.5 Å²	105.5	43%	0.427	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-46	173.5	-178	0	0	0	0	112.2	E176 V177 A178 A182 Q183 N184	E176-S180 WeakPolarHBondContact O-CB 3.42Å; E176-S180 PolarHBondContact O-N 3.47Å; V177-S180 WeakPolarHBondContact O-CB 3.43Å; V177-S180 PolarHBondContact O-N 3.34Å; A178-S180 VanDerWaalsContact C-N 3.33Å; A178-S180 PolarHBondContact O-N 2.98Å; S180-A182 PolarHBondContact O-N 2.91Å; S180-Q183 PolarHBondContact O-N 3.24Å; S180-N184 PolarHBondContact O-N 3.48Å; S180-N184 PolarHBondContact O-ND2 3.05Å
181	Y	86.7	Confident	80.2	Confident	166 Å²	166	102.9 Å²	102.9	65%	0.651	53%	0.528	S	S	*	.	H	α-helix	trans	-64.2	-39.7	175.5	-80.7	-70.4	0	0	0	112.4	V177 A178 Q183 N184 A185	V177-Y181 HydrophobicContact CG1-CD2 3.64Å; V177-Y181 HydrophobicContact CG1-CE2 3.42Å; V177-Y181 VanDerWaalsContact CG1-CE2 3.42Å; V177-Y181 WeakPolarHBondContact O-CD2 3.41Å; V177-Y181 PolarHBondContact O-N 3.11Å; A178-Y181 PolarHBondContact O-N 3.25Å; Y181-Q183 VanDerWaalsContact C-N 3.34Å; Y181-Q183 PolarHBondContact O-N 3.46Å; Y181-N184 PolarHBondContact O-N 2.98Å; Y181-A185 PolarHBondContact O-N 3.29Å
182	A	88.4	Confident	80.7	Confident	45 Å²	45	100.1 Å²	100.1	37%	0.372	52%	0.517	S	S	.	.	H	α-helix	trans	-64.8	-36.7	177.1	0	0	0	0	0	112.5	A178 D179 S180 K186	A178-A182 WeakPolarHBondContact O-CB 3.44Å; A178-A182 PolarHBondContact O-N 3.02Å; D179-A182 PolarHBondContact O-N 3.4Å; S180-A182 PolarHBondContact O-N 2.91Å; A182-K186 WeakPolarHBondContact O-CG 3.45Å; A182-K186 PolarHBondContact O-N 3.4Å
183	Q	89.8	Confident	81.2	Confident	132 Å²	132	101.4 Å²	101.4	62%	0.617	52%	0.522	S	S	*	.	H	α-helix	trans	-68.8	-43	174.3	-77.3	178.4	-0.5	0	0	112	D179 S180 Y181 A185 K186 V187	D179-Q183 WeakPolarHBondContact O-CG 3.16Å; D179-Q183 PolarHBondContact O-N 3.34Å; S180-Q183 PolarHBondContact O-N 3.24Å; Y181-Q183 VanDerWaalsContact C-N 3.34Å; Y181-Q183 PolarHBondContact O-N 3.46Å; Q183-A185 VanDerWaalsContact C-N 3.31Å; Q183-A185 PolarHBondContact O-N 2.91Å; Q183-K186 PolarHBondContact O-N 3.19Å; Q183-V187 WeakPolarHBondContact O-CG2 3.42Å; Q183-V187 PolarHBondContact O-N 3.03Å; Q183-V187 VanDerWaalsContact O-N 3.11Å
184	N	78.9	Confident	81.6	Confident	87 Å²	87	105.2 Å²	105.2	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-60.8	-40	176.1	-73	-33	0	0	0	112.1	S180 Y181 K186 V187 I188	S180-N184 PolarHBondContact O-N 3.48Å; S180-N184 PolarHBondContact O-ND2 3.05Å; Y181-N184 PolarHBondContact O-N 2.98Å; N184-K186 PolarHBondContact O-N 3.48Å; N184-V187 PolarHBondContact O-N 3.26Å; N184-I188 VanDerWaalsContact O-CG1 3.28Å; N184-I188 WeakPolarHBondContact O-CG1 3.47Å; N184-I188 PolarHBondContact O-N 3.4Å
185	A	86.3	Confident	81.8	Confident	56 Å²	56	109.5 Å²	109.5	46%	0.463	54%	0.538	S	S	.	.	H	α-helix	trans	-59.6	-44.8	175.3	0	0	0	0	0	112.5	Y181 Q183 V187 I188 E189	Y181-A185 PolarHBondContact O-N 3.29Å; Q183-A185 VanDerWaalsContact C-N 3.31Å; Q183-A185 PolarHBondContact O-N 2.91Å; A185-V187 VanDerWaalsContact C-N 3.31Å; A185-V187 PolarHBondContact O-N 3.14Å; A185-I188 PolarHBondContact O-N 3.28Å; A185-E189 WeakPolarHBondContact O-CB 3.28Å; A185-E189 PolarHBondContact O-N 3.09Å
186	K	87.8	Confident	81.3	Confident	133 Å²	133	102.3 Å²	102.3	58%	0.578	52%	0.521	S	S	*	.	H	α-helix	trans	-64	-34.8	177.3	-72.8	174.7	-179.1	172.4	0	112.9	A182 Q183 N184 K190	A182-K186 WeakPolarHBondContact O-CG 3.45Å; A182-K186 PolarHBondContact O-N 3.4Å; Q183-K186 PolarHBondContact O-N 3.19Å; N184-K186 PolarHBondContact O-N 3.48Å; K186-K190 PolarHBondContact O-N 3.28Å; K186-K190 VanDerWaalsContact O-N 3.14Å
187	V	87.9	Confident	80.4	Confident	86 Å²	86	100.8 Å²	100.8	52%	0.521	52%	0.515	S	S	.	.	H	α-helix	trans	-68.9	-42.2	176.5	174	0	0	0	0	110.5	Q183 N184 A185 K190 Q191	Q183-V187 WeakPolarHBondContact O-CG2 3.42Å; Q183-V187 PolarHBondContact O-N 3.03Å; Q183-V187 VanDerWaalsContact O-N 3.11Å; N184-V187 PolarHBondContact O-N 3.26Å; A185-V187 VanDerWaalsContact C-N 3.31Å; A185-V187 PolarHBondContact O-N 3.14Å; V187-K190 PolarHBondContact O-N 3.04Å; V187-Q191 VanDerWaalsContact O-CG 3.27Å; V187-Q191 WeakPolarHBondContact O-CG 3.43Å; V187-Q191 PolarHBondContact O-N 2.95Å
188	I	81.8	Confident	79.5	Confident	104 Å²	104	100.4 Å²	100.4	53%	0.533	52%	0.516	S	S	.	.	H	α-helix	trans	-65.3	-42.1	177.4	-66	164.3	0	0	0	110.8	N184 A185 Q191 L192	N184-I188 VanDerWaalsContact O-CG1 3.28Å; N184-I188 WeakPolarHBondContact O-CG1 3.47Å; N184-I188 PolarHBondContact O-N 3.4Å; A185-I188 PolarHBondContact O-N 3.28Å; I188-Q191 WeakPolarHBondContact O-CB 3.24Å; I188-Q191 PolarHBondContact O-N 3.12Å; I188-L192 HydrophobicContact CG2-CD1 3.95Å; I188-L192 HydrophobicContact CG2-CG 4.48Å; I188-L192 WeakPolarHBondContact O-CG 3.27Å; I188-L192 PolarHBondContact O-N 3.03Å
189	E	78.8	Confident	78.5	Confident	114 Å²	114	105.8 Å²	105.8	53%	0.533	53%	0.528	S	S	.	.	H	α-helix	trans	-58.3	-50.6	175.8	-174.9	174.8	-139.9	0	0	111.6	A185 Q191 L192 E193	A185-E189 WeakPolarHBondContact O-CB 3.28Å; A185-E189 PolarHBondContact O-N 3.09Å; E189-Q191 VanDerWaalsContact C-N 3.27Å; E189-Q191 PolarHBondContact O-N 3.41Å; E189-L192 WeakPolarHBondContact O-CB 3.4Å; E189-L192 PolarHBondContact O-N 3.47Å; E189-L192 VanDerWaalsContact O-N 3.09Å; E189-E193 WeakPolarHBondContact O-CG 3.36Å; E189-E193 PolarHBondContact O-N 3.37Å
190	K	85.1	Confident	77.3	Confident	128 Å²	128	109.6 Å²	109.6	56%	0.557	54%	0.536	S	S	*	.	H	α-helix	trans	-61.6	-33.1	175.6	-76.8	-179.7	177.6	177.5	0	113.3	K186 V187 R194	K186-K190 PolarHBondContact O-N 3.28Å; K186-K190 VanDerWaalsContact O-N 3.14Å; V187-K190 PolarHBondContact O-N 3.04Å; K190-R194 WeakPolarHBondContact O-CB 3.41Å; K190-R194 VanDerWaalsContact O-CG 3.24Å; K190-R194 WeakPolarHBondContact O-CG 3.49Å; K190-R194 PolarHBondContact O-N 3.39Å
191	Q	76.5	Confident	76.3	Confident	90 Å²	90	115.5 Å²	115.5	42%	0.421	55%	0.549	S	S	.	.	H	α-helix	trans	-69.7	-38.3	174.8	-75.5	-77.5	-14.6	0	0	111.8	V187 I188 E189 R194 K195	V187-Q191 VanDerWaalsContact O-CG 3.27Å; V187-Q191 WeakPolarHBondContact O-CG 3.43Å; V187-Q191 PolarHBondContact O-N 2.95Å; I188-Q191 WeakPolarHBondContact O-CB 3.24Å; I188-Q191 PolarHBondContact O-N 3.12Å; E189-Q191 VanDerWaalsContact C-N 3.27Å; E189-Q191 PolarHBondContact O-N 3.41Å; Q191-R194 PolarHBondContact O-N 3.09Å; Q191-K195 WeakPolarHBondContact O-CB 3.42Å; Q191-K195 WeakPolarHBondContact O-CG 3.45Å; Q191-K195 PolarHBondContact O-N 3.08Å
192	L	76.4	Confident	75.1	Confident	89 Å²	89	113.7 Å²	113.7	47%	0.466	55%	0.55	S	S	.	.	H	α-helix	trans	-67.3	-38.5	175.6	-75.6	164.1	0	0	0	112.2	I188 E189 G196 M197	I188-L192 HydrophobicContact CG2-CD1 3.95Å; I188-L192 HydrophobicContact CG2-CG 4.48Å; I188-L192 WeakPolarHBondContact O-CG 3.27Å; I188-L192 PolarHBondContact O-N 3.03Å; E189-L192 WeakPolarHBondContact O-CB 3.4Å; E189-L192 PolarHBondContact O-N 3.47Å; E189-L192 VanDerWaalsContact O-N 3.09Å; L192-G196 PolarHBondContact O-N 3.49Å; L192-M197 HydrophobicContact CD2-CB 4.4Å; L192-M197 PolarHBondContact O-N 3.49Å
193	E	73.8	Confident	73.9	Confident	116 Å²	116	117.6 Å²	117.6	54%	0.542	56%	0.56	S	S	.	*	H	α-helix	trans	-64.2	-47.3	173.3	-70.9	178.9	159	0	0	111.7	E189 K195 G196	E189-E193 WeakPolarHBondContact O-CG 3.36Å; E189-E193 PolarHBondContact O-N 3.37Å; E193-K195 VanDerWaalsContact C-N 3.32Å; E193-K195 PolarHBondContact O-N 3.34Å; E193-G196 PolarHBondContact O-N 3.38Å
194	R	75.9	Confident	72.8	Confident	201 Å²	201	117.1 Å²	117.1	76%	0.758	56%	0.558	S	S	*	*	H	α-helix	trans	-63.3	-34.8	177.3	-75.1	175	-176.9	-166.6	0.5	113.1	K190 Q191 G196	K190-R194 WeakPolarHBondContact O-CB 3.41Å; K190-R194 VanDerWaalsContact O-CG 3.24Å; K190-R194 WeakPolarHBondContact O-CG 3.49Å; K190-R194 PolarHBondContact O-N 3.39Å; Q191-R194 PolarHBondContact O-N 3.09Å; R194-G196 PolarHBondContact O-N 2.96Å
195	K	78.9	Confident	72.2	Confident	152 Å²	152	118.1 Å²	118.1	66%	0.661	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	2.6	175	-71.3	-179.8	179.8	-179.1	0	113.3	Q191 E193 M197	Q191-K195 WeakPolarHBondContact O-CB 3.42Å; Q191-K195 WeakPolarHBondContact O-CG 3.45Å; Q191-K195 PolarHBondContact O-N 3.08Å; E193-K195 VanDerWaalsContact C-N 3.32Å; E193-K195 PolarHBondContact O-N 3.34Å; K195-M197 HydrophobicContact CB-CG 4.23Å; K195-M197 PolarHBondContact O-N 2.9Å; K195-M197 VanDerWaalsContact O-N 3.12Å
196	G	66.8	Low	71.5	Confident	33 Å²	33	118.1 Å²	118.1	34%	0.34	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	68.1	9.4	174.6	0	0	0	0	0	114.8	L192 E193 R194 S198 K199 R200	L192-G196 PolarHBondContact O-N 3.49Å; E193-G196 PolarHBondContact O-N 3.38Å; R194-G196 PolarHBondContact O-N 2.96Å; G196-S198 VanDerWaalsContact C-N 3.28Å; G196-S198 PolarHBondContact O-N 3.33Å; G196-K199 PolarHBondContact O-N 3.31Å; G196-R200 PolarHBondContact O-N 3.01Å
197	M	58.3	Low	70.7	Confident	95 Å²	95	117 Å²	117	47%	0.468	56%	0.559	S	S	.	*	H	α-helix	trans	-70.1	-27	-176	-68.2	-65.7	-71.2	0	0	112	L192 K195 R200 R201	L192-M197 HydrophobicContact CD2-CB 4.4Å; L192-M197 PolarHBondContact O-N 3.49Å; K195-M197 HydrophobicContact CB-CG 4.23Å; K195-M197 PolarHBondContact O-N 2.9Å; K195-M197 VanDerWaalsContact O-N 3.12Å; M197-R200 PolarHBondContact O-N 3.16Å; M197-R201 PolarHBondContact O-N 2.98Å; M197-R201 VanDerWaalsContact O-N 3.09Å
198	S	59.2	Low	69.8	Low	68 Å²	68	117.8 Å²	117.8	48%	0.476	56%	0.56	S	S	.	*	H	α-helix	trans	-63.8	-40.1	175.5	-169.1	0	0	0	0	112.2	G196 R201 L202	G196-S198 VanDerWaalsContact C-N 3.28Å; G196-S198 PolarHBondContact O-N 3.33Å; S198-R201 PolarHBondContact O-N 3.02Å; S198-L202 PolarHBondContact O-N 3.08Å; S198-L202 VanDerWaalsContact O-N 3.08Å
199	K	60.9	Low	69.2	Low	170 Å²	170	119.6 Å²	119.6	74%	0.739	57%	0.567	S	S	*	*	H	α-helix	trans	-66.6	-41.9	175.5	-88.1	-172.6	175.1	-178	0	112.6	G196 R201 L202 Q203	G196-K199 PolarHBondContact O-N 3.31Å; K199-R201 PolarHBondContact O-N 3.43Å; K199-L202 PolarHBondContact O-N 3.47Å; K199-Q203 VanDerWaalsContact O-CB 3.28Å; K199-Q203 WeakPolarHBondContact O-CB 3.39Å; K199-Q203 PolarHBondContact O-N 3.48Å
200	R	61.2	Low	68.8	Low	175 Å²	175	116.5 Å²	116.5	66%	0.66	56%	0.56	S	S	*	*	H	α-helix	trans	-62.3	-42	177.1	-75.1	-175.6	-178.3	174.8	0.5	111.9	G196 M197 Q203 E204	G196-R200 PolarHBondContact O-N 3.01Å; M197-R200 PolarHBondContact O-N 3.16Å; R200-Q203 PolarHBondContact O-N 3Å; R200-E204 PolarHBondContact O-N 3.32Å
201	R	62.8	Low	67.9	Low	186 Å²	186	116.5 Å²	116.5	70%	0.702	56%	0.56	S	S	*	*	H	α-helix	trans	-68.4	-38.2	179.8	-148.6	177.6	-164.3	-175.8	3.3	112.7	M197 S198 K199 Q203 L205	M197-R201 PolarHBondContact O-N 2.98Å; M197-R201 VanDerWaalsContact O-N 3.09Å; S198-R201 PolarHBondContact O-N 3.02Å; K199-R201 PolarHBondContact O-N 3.43Å; R201-Q203 VanDerWaalsContact C-N 3.33Å; R201-L205 WeakPolarHBondContact O-CB 3.49Å; R201-L205 WeakPolarHBondContact O-CG 3.45Å; R201-L205 PolarHBondContact O-N 2.93Å; R201-L205 VanDerWaalsContact O-N 3.08Å
202	L	61.3	Low	67.3	Low	128 Å²	128	120.1 Å²	120.1	67%	0.67	58%	0.575	S	S	*	*	H	α-helix	trans	-66.3	-37.6	174.5	-140.1	97.9	0	0	0	111.6	S198 K199 A206	S198-L202 PolarHBondContact O-N 3.08Å; S198-L202 VanDerWaalsContact O-N 3.08Å; K199-L202 PolarHBondContact O-N 3.47Å; L202-A206 WeakPolarHBondContact O-CB 3.27Å; L202-A206 PolarHBondContact O-N 3.41Å
203	Q	64	Low	66.6	Low	126 Å²	126	119.7 Å²	119.7	59%	0.589	58%	0.584	S	S	*	*	H	α-helix	trans	-72.7	-39.5	179.6	-157.7	166.2	11.1	0	0	111.8	K199 R200 R201 A206 E207	K199-Q203 VanDerWaalsContact O-CB 3.28Å; K199-Q203 WeakPolarHBondContact O-CB 3.39Å; K199-Q203 PolarHBondContact O-N 3.48Å; R200-Q203 PolarHBondContact O-N 3Å; R201-Q203 VanDerWaalsContact C-N 3.33Å; Q203-A206 PolarHBondContact O-N 3.46Å; Q203-E207 WeakPolarHBondContact O-CB 3.28Å; Q203-E207 WeakPolarHBondContact O-CG 3.41Å; Q203-E207 PolarHBondContact O-N 2.92Å
204	E	65.6	Low	66	Low	122 Å²	122	122.8 Å²	122.8	57%	0.57	60%	0.596	S	S	*	*	H	α-helix	trans	-62.6	-41.1	171.1	-82.9	-179	147.1	0	0	112.5	R200 E207 L208	R200-E204 PolarHBondContact O-N 3.32Å; E204-E207 PolarHBondContact O-N 3.45Å; E204-L208 WeakPolarHBondContact O-CB 3.47Å; E204-L208 VanDerWaalsContact O-CG 3.27Å; E204-L208 WeakPolarHBondContact O-CG 3.44Å; E204-L208 PolarHBondContact O-N 3Å
205	L	66.3	Low	65	Low	108 Å²	108	120.9 Å²	120.9	57%	0.565	60%	0.597	S	S	*	*	H	α-helix	trans	-64.8	-43.9	176.4	-79.5	167.1	0	0	0	111.7	R201 E207 L208 E209	R201-L205 WeakPolarHBondContact O-CB 3.49Å; R201-L205 WeakPolarHBondContact O-CG 3.45Å; R201-L205 PolarHBondContact O-N 2.93Å; R201-L205 VanDerWaalsContact O-N 3.08Å; L205-E207 VanDerWaalsContact C-N 3.34Å; L205-E207 PolarHBondContact O-N 3.24Å; L205-L208 PolarHBondContact O-N 3.45Å; L205-E209 WeakPolarHBondContact O-CB 3.32Å; L205-E209 PolarHBondContact O-N 3.06Å
206	A	72.1	Confident	63.9	Low	57 Å²	57	123.5 Å²	123.5	47%	0.471	61%	0.608	S	S	.	*	H	α-helix	trans	-63.9	-37.5	175.4	0	0	0	0	0	112.5	L202 Q203 E209 A210	L202-A206 WeakPolarHBondContact O-CB 3.27Å; L202-A206 PolarHBondContact O-N 3.41Å; Q203-A206 PolarHBondContact O-N 3.46Å; A206-E209 PolarHBondContact O-N 3.44Å; A206-A210 WeakPolarHBondContact O-CB 3.46Å; A206-A210 PolarHBondContact O-N 3.42Å
207	E	70.3	Confident	63.4	Low	108 Å²	108	125.5 Å²	125.5	51%	0.505	63%	0.629	S	S	.	*	H	α-helix	trans	-68.1	-37.7	175.2	-80.2	-175.4	-175.4	0	0	113	Q203 E204 L205 K211	Q203-E207 WeakPolarHBondContact O-CB 3.28Å; Q203-E207 WeakPolarHBondContact O-CG 3.41Å; Q203-E207 PolarHBondContact O-N 2.92Å; E204-E207 PolarHBondContact O-N 3.45Å; L205-E207 VanDerWaalsContact C-N 3.34Å; L205-E207 PolarHBondContact O-N 3.24Å; E207-K211 WeakPolarHBondContact O-CB 3.42Å; E207-K211 VanDerWaalsContact O-CG 3.29Å; E207-K211 WeakPolarHBondContact O-CG 3.41Å; E207-K211 PolarHBondContact O-N 3.47Å
208	L	69.2	Low	63.3	Low	103 Å²	103	126.9 Å²	126.9	54%	0.539	64%	0.643	S	S	.	*	H	α-helix	trans	-67.7	-37.8	175.5	-74	168.3	0	0	0	111.7	E204 L205 K211 K212	E204-L208 WeakPolarHBondContact O-CB 3.47Å; E204-L208 VanDerWaalsContact O-CG 3.27Å; E204-L208 WeakPolarHBondContact O-CG 3.44Å; E204-L208 PolarHBondContact O-N 3Å; L205-L208 PolarHBondContact O-N 3.45Å; L208-K211 PolarHBondContact O-N 2.95Å; L208-K212 WeakPolarHBondContact O-CG 3.47Å; L208-K212 PolarHBondContact O-N 3.41Å
209	E	70.8	Confident	63.1	Low	143 Å²	143	132.1 Å²	132.1	67%	0.668	67%	0.665	S	S	*	*	H	α-helix	trans	-69.8	-40.9	176.3	-161.5	168.2	-158	0	0	111.7	L205 A206 K211 K212 A213	L205-E209 WeakPolarHBondContact O-CB 3.32Å; L205-E209 PolarHBondContact O-N 3.06Å; A206-E209 PolarHBondContact O-N 3.44Å; E209-K211 VanDerWaalsContact C-N 3.34Å; E209-K211 PolarHBondContact O-N 3.28Å; E209-K212 PolarHBondContact O-N 3.03Å; E209-A213 PolarHBondContact O-N 3.21Å
210	A	69.4	Low	62.9	Low	48 Å²	48	130.2 Å²	130.2	40%	0.397	66%	0.662	S	S	.	*	H	α-helix	trans	-64.7	-35.1	172.9	0	0	0	0	0	112.9	A206 A213 K214	A206-A210 WeakPolarHBondContact O-CB 3.46Å; A206-A210 PolarHBondContact O-N 3.42Å; A210-A213 PolarHBondContact O-N 3.29Å; A210-K214 WeakPolarHBondContact O-CG 3.29Å; A210-K214 PolarHBondContact O-N 3.22Å
211	K	65.8	Low	62.6	Low	128 Å²	128	129.3 Å²	129.3	56%	0.557	67%	0.67	S	S	*	*	H	α-helix	trans	-68	-37.9	173.6	-78.2	172.8	-178.1	170.2	0	112	E207 L208 E209 K214	E207-K211 WeakPolarHBondContact O-CB 3.42Å; E207-K211 VanDerWaalsContact O-CG 3.29Å; E207-K211 WeakPolarHBondContact O-CG 3.41Å; E207-K211 PolarHBondContact O-N 3.47Å; L208-K211 PolarHBondContact O-N 2.95Å; E209-K211 VanDerWaalsContact C-N 3.34Å; E209-K211 PolarHBondContact O-N 3.28Å; K211-K214 PolarHBondContact O-N 2.95Å
212	K	63.8	Low	62.3	Low	167 Å²	167	128.1 Å²	128.1	73%	0.726	68%	0.677	S	S	*	*	H	α-helix	trans	-65.4	-38.1	173.3	-76.2	179.4	178.3	-179.7	0	112.5	L208 E209 K214 M215	L208-K212 WeakPolarHBondContact O-CG 3.47Å; L208-K212 PolarHBondContact O-N 3.41Å; E209-K212 PolarHBondContact O-N 3.03Å; K212-K214 VanDerWaalsContact C-N 3.31Å; K212-K214 PolarHBondContact O-N 3.26Å; K212-M215 PolarHBondContact O-N 3.38Å
213	A	62	Low	61.9	Low	79 Å²	79	130.1 Å²	130.1	65%	0.653	68%	0.683	S	S	*	*	H	α-helix	trans	-67.1	-29.1	178	0	0	0	0	0	113.4	E209 A210	E209-A213 PolarHBondContact O-N 3.21Å; A210-A213 PolarHBondContact O-N 3.29Å
214	K	60.8	Low	61.1	Low	182 Å²	182	133.6 Å²	133.6	79%	0.791	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-7.2	179.3	-71.7	177.6	-178.4	-177.8	0	114.8	A210 K211 K212 K216	A210-K214 WeakPolarHBondContact O-CG 3.29Å; A210-K214 PolarHBondContact O-N 3.22Å; K211-K214 PolarHBondContact O-N 2.95Å; K212-K214 VanDerWaalsContact C-N 3.31Å; K212-K214 PolarHBondContact O-N 3.26Å; K214-K216 PolarHBondContact O-N 3.41Å
215	M	56.3	Low	60.2	Low	160 Å²	160	141.3 Å²	141.3	79%	0.788	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	14.3	-175.7	-73.8	178	70	0	0	115.3	K212	K212-M215 PolarHBondContact O-N 3.38Å
216	K	55.6	Low	59.9	Low	207 Å²	207	143 Å²	143	90%	0.9	74%	0.737	S	S	*	*			trans	-104.8	104.9	172.8	-78.6	-173	176.7	-177.4	0	111.5	K214	K214-K216 PolarHBondContact O-N 3.41Å
217	G	55.1	Low	59.3	Low	76 Å²	76	147.5 Å²	147.5	78%	0.784	75%	0.751	S	S	*	*			trans	171.8	81.9	169	0	0	0	0	0	111.5
218	T	57.7	Low	58.7	Low	123 Å²	123	149.7 Å²	149.7	76%	0.755	76%	0.764	S	S	*	*			trans	-84.6	133.2	163.3	44.8	0	0	0	0	109.3	I220	T218-I220 VanDerWaalsContact C-N 3.31Å; T218-I220 PolarHBondContact O-N 3.27Å
219	L	54.1	Low	58	Low	178 Å²	178	152.5 Å²	152.5	93%	0.932	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	64.8	-168.8	-152.8	141.5	0	0	0	111.7
220	I	55.9	Low	57.2	Low	131 Å²	131	153.1 Å²	153.1	67%	0.672	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	-15.4	-176.8	-58.6	177.9	0	0	0	113.6	T218 N222	T218-I220 VanDerWaalsContact C-N 3.31Å; T218-I220 PolarHBondContact O-N 3.27Å; I220-N222 PolarHBondContact O-N 3.44Å
221	D	55.3	Low	56.4	Low	155 Å²	155	160.1 Å²	160.1	83%	0.829	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	7.4	-171.3	-68.9	-27.9	0	0	0	116.6
222	N	57.2	Low	55.8	Low	161 Å²	161	162.4 Å²	162.4	86%	0.861	83%	0.828	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	12.9	-177.1	-81.7	-3.6	0	0	0	115.5	I220	I220-N222 PolarHBondContact O-N 3.44Å
223	Q	52.3	Low	55.1	Low	170 Å²	170	162 Å²	162	79%	0.794	84%	0.836	S	S	*	*	S	Bend	trans	-99.3	3.3	-177.6	-90.9	-172	5.5	0	0	116.7
224	F	47.7	Very low	54.6	Low	200 Å²	200	168.9 Å²	168.9	88%	0.877	85%	0.851	S	S	*	*			trans	-132.9	82.9	174.8	-68.4	-79.4	0	0	0	112
225	K	47	Very low	54	Low	284 Å²	284	167.7 Å²	167.7	100%	1.235	86%	0.857	S	S	*	*			trans	-147.5	0	151.7	-97.1	-172.9	-177.9	177	0	109.6

Retrieved 225 of 225 residues in 104 ms (Link to these results)

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