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Septin

Filament-forming cytoskeletal GTPase. Required for normal organization of the actin cytoskeleton. Required for normal progress through mitosis. Involved in cytokinesis. Required for normal association of CENPE with the kinetochore. Plays a role in ciliogenesis and collective cell movements. Forms a filamentous structure with SEPTIN12, SEPTIN6, SEPTIN2 and probably SEPTIN4 at the sperm annulus which is required for the structural integrity and motility of the sperm tail during postmeiotic differentiation.

AlphaFold DB , UniProt , Accession A0A023T695, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 407 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.9	Very low	31.3	Very low	247 Å²	247	139.2 Å²	139.2	100%	1.217	79%	0.79	S	S	*	*				0	98.7	0	-71.9	178.5	-159.1	0	0	106.5
2	L	27	Very low	31.5	Very low	165 Å²	165	135.4 Å²	135.4	86%	0.864	78%	0.779	S	S	*	*			trans	-95.1	144.7	173.4	-78.6	162.8	0	0	0	108
3	P	31	Very low	31.7	Very low	114 Å²	114	133.9 Å²	133.9	74%	0.74	78%	0.781	S	S	*	*			trans	-74.8	141.3	-163.2	30.5	-33.6	0	0	0	112	A5	P3-A5 HydrophobicContact CB-CB 4.5Å; P3-A5 PolarHBondContact O-N 3.04Å
4	V	32.3	Very low	32	Very low	131 Å²	131	132.3 Å²	132.3	79%	0.794	77%	0.768	S	S	*	*			trans	-79.3	35.6	-175.7	-173	0	0	0	0	111.2
5	A	30.9	Very low	32.2	Very low	63 Å²	63	133.3 Å²	133.3	52%	0.521	78%	0.78	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.9	-10.5	-157	0	0	0	0	0	117.2	P3	P3-A5 HydrophobicContact CB-CB 4.5Å; P3-A5 PolarHBondContact O-N 3.04Å
6	N	31.1	Very low	32.4	Very low	150 Å²	150	130.1 Å²	130.1	80%	0.802	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	13.3	-176	-79.2	1.1	0	0	0	115.7
7	L	34.3	Very low	33.1	Very low	120 Å²	120	127.1 Å²	127.1	63%	0.628	76%	0.761	S	S	*	*	S	Bend	trans	-101.9	-5.7	168.4	-105.5	96.1	0	0	0	114.3
8	E	28	Very low	34.1	Very low	163 Å²	163	125.3 Å²	125.3	76%	0.762	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-87.3	-2	-173.3	-76.5	-170.9	155.2	0	0	115.2	L10 G11	E8-L10 PolarHBondContact O-N 3.22Å; E8-G11 PolarHBondContact O-N 3.4Å
9	L	32.5	Very low	35.4	Very low	170 Å²	170	120.3 Å²	120.3	89%	0.89	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-79.4	8	173.7	-80.1	167.5	0	0	0	114.5
10	L	37.5	Very low	36.5	Very low	133 Å²	133	116 Å²	116	70%	0.696	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-89.4	16.6	163.1	-78.1	164.9	0	0	0	112.8	E8 S12	E8-L10 PolarHBondContact O-N 3.22Å; L10-S12 PolarHBondContact O-N 3.17Å
11	G	31.2	Very low	37.7	Very low	75 Å²	75	110.7 Å²	110.7	77%	0.773	66%	0.664	S	S	*	*			trans	-75	54.3	171.9	0	0	0	0	0	114.2	E8	E8-G11 PolarHBondContact O-N 3.4Å
12	S	33	Very low	39.3	Very low	94 Å²	94	99 Å²	99	66%	0.657	61%	0.607	S	S	*	*	S	Bend	trans	-143.9	90.9	161.2	55.9	0	0	0	0	111.2	L10 D14	L10-S12 PolarHBondContact O-N 3.17Å; S12-D14 PolarHBondContact O-N 3.17Å
13	S	35	Very low	41.1	Very low	116 Å²	116	91.7 Å²	91.7	81%	0.811	57%	0.569	S	S	*	*	S	Bend	trans	43.5	56	144.7	61.7	0	0	0	0	118.6
14	D	35.1	Very low	43	Very low	111 Å²	111	86.2 Å²	86.2	59%	0.594	53%	0.534	S	S	*	.			trans	-163	104.1	147.8	-119.2	-39.3	0	0	0	111.8	S12 S16 A17	S12-D14 PolarHBondContact O-N 3.17Å; D14-S16 PolarHBondContact O-N 3.36Å; D14-S16 PolarHBondContact OD1-OG 3.35Å; D14-A17 PolarHBondContact O-N 3.02Å
15	P	34.7	Very low	44.6	Very low	147 Å²	147	80 Å²	80	96%	0.955	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	8.2	174.1	26	-29.4	0	0	0	113.6
16	S	35.5	Very low	46.3	Very low	83 Å²	83	77 Å²	77	58%	0.58	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-5.5	-178.2	67.9	0	0	0	0	114.1	D14 L18	D14-S16 PolarHBondContact O-N 3.36Å; D14-S16 PolarHBondContact OD1-OG 3.35Å; S16-L18 PolarHBondContact O-N 3.47Å
17	A	44.1	Very low	47.8	Very low	78 Å²	78	69.9 Å²	69.9	65%	0.645	43%	0.434	S	S	*	.			trans	-74.8	93.7	-178.1	0	0	0	0	0	111.6	D14 A19	D14-A17 PolarHBondContact O-N 3.02Å; A17-A19 PolarHBondContact O-N 3.46Å
18	L	51.4	Low	49.6	Very low	96 Å²	96	65.6 Å²	65.6	50%	0.503	41%	0.41	S	S	.	.			trans	-64.9	113.7	168.2	-80.8	150.8	0	0	0	109.7	S16 S20 L69 Q76	S16-L18 PolarHBondContact O-N 3.47Å; L18-S20 PolarHBondContact O-N 2.91Å; L18-L69 HydrophobicContact CD2-CD1 3.38Å; L18-Q76 HydrophobicContact CD2-CB 3.83Å
19	A	58.7	Low	51.9	Low	29 Å²	29	59.4 Å²	59.4	24%	0.24	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	122.5	169.1	0	0	0	0	0	108.3	A17 Q76 L77 L78	A17-A19 PolarHBondContact O-N 3.46Å; A19-Q76 PolarHBondContact N-O 2.68Å; A19-L77 HydrophobicContact CB-CD1 3.89Å; A19-L77 CarbonylContact O-C 3.59Å; A19-L77 VanDerWaalsContact O-CA 3.31Å; A19-L77 WeakPolarHBondContact O-CA 3.38Å; A19-L78 PolarHBondContact O-N 2.86Å
20	S	57.9	Low	54	Low	35 Å²	35	53 Å²	53	25%	0.245	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	127.7	176.9	-180	0	0	0	0	110.3	L18 L78 K268	L18-S20 PolarHBondContact O-N 2.91Å; S20-L78 WeakPolarHBondContact CA-O 3.49Å; S20-K268 WeakPolarHBondContact O-CE 3.47Å; S20-K268 PolarHBondContact O-NZ 3.37Å
21	Q	62.7	Low	56.1	Low	4 Å²	4	47.4 Å²	47.4	2%	0.019	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133	171.9	-170.7	179.5	28.4	0	0	109.6	L77 L78 L79 T80 Q129 L259 M264	Q21-L77 HydrophobicContact CB-CD1 3.92Å; Q21-L77 HydrophobicContact CB-CG 4.42Å; Q21-L78 PolarHBondContact N-O 3.47Å; Q21-L79 HydrophobicContact CB-CD1 4.25Å; Q21-L79 HydrophobicContact CG-CD1 4.33Å; Q21-L79 CarbonylContact O-C 3.49Å; Q21-L79 VanDerWaalsContact O-CA 3.28Å; Q21-L79 WeakPolarHBondContact O-CA 3.41Å; Q21-T80 PolarHBondContact O-N 3.34Å; Q21-Q129 VanDerWaalsContact CG-OE1 3.26Å; Q21-L259 PolarHBondContact NE2-O 2.97Å; Q21-M264 HydrophobicContact CB-SD 4.11Å; Q21-M264 HydrophobicContact CG-CG 4.26Å; Q21-M264 HydrophobicContact CG-SD 4.21Å
22	S	61.2	Low	58.5	Low	3 Å²	3	44.9 Å²	44.9	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	106.9	177	-67	0	0	0	0	109.2	T80 R127 Q129	S22-T80 CarbonylContact C-O 3.58Å; S22-T80 WeakPolarHBondContact CA-O 3.33Å; S22-R127 VanDerWaalsContact CB-O 3.24Å; S22-R127 WeakPolarHBondContact CB-O 3.09Å; S22-Q129 WeakPolarHBondContact O-CB 3.39Å; S22-Q129 PolarHBondContact O-N 3.37Å
23	A	64.6	Low	60.9	Low	10 Å²	10	40.7 Å²	40.7	8%	0.083	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	130	178.8	0	0	0	0	0	109.7	L79 T80 I81 V82	A23-L79 HydrophobicContact CB-CD1 4.31Å; A23-T80 PolarHBondContact N-O 2.98Å; A23-T80 VanDerWaalsContact O-O 3.11Å; A23-I81 WeakPolarHBondContact O-CA 3.47Å; A23-V82 PolarHBondContact O-N 3.47Å
24	R	71.4	Confident	63.2	Low	0 Å²	0	36.1 Å²	36.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	143.7	174	-178.7	168.2	-162.6	145.7	11.5	110.6	V63 V82 V100 V128 C130 C131 L132	R24-V63 VanDerWaalsContact NH2-CG1 3.29Å; R24-V82 HydrophobicContact CB-CB 4.09Å; R24-V82 HydrophobicContact CG-CB 4Å; R24-V82 HydrophobicContact CG-CG1 4.14Å; R24-V100 PolarHBondContact NH1-O 3.25Å; R24-V128 HydrophobicContact CB-CG1 3.36Å; R24-V128 HydrophobicContact CG-CG1 4.46Å; R24-C130 PolarHBondContact N-O 2.98Å; R24-C131 CarbonylContact O-C 3.55Å; R24-C131 WeakPolarHBondContact O-CA 3.43Å; R24-L132 PolarHBondContact O-N 3.01Å
25	I	65.6	Low	65.6	Low	1 Å²	1	33.3 Å²	33.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.4	-179.4	-50.5	174.8	0	0	0	107.8	K33 I37 I81 V82 T84 F134	I25-K33 HydrophobicContact CG2-CB 4.1Å; I25-K33 HydrophobicContact CG2-CD 3.9Å; I25-K33 HydrophobicContact CG2-CG 4.17Å; I25-I37 HydrophobicContact CD1-CD1 3.28Å; I25-I37 HydrophobicContact CD1-CG1 3.3Å; I25-I37 HydrophobicContact CG1-CD1 4.15Å; I25-I81 HydrophobicContact CD1-CG2 3.42Å; I25-I81 VanDerWaalsContact CD1-CG2 3.42Å; I25-I81 HydrophobicContact CG1-CG2 4.13Å; I25-V82 PolarHBondContact N-O 2.99Å; I25-T84 PolarHBondContact O-OG1 3.03Å; I25-T84 VanDerWaalsContact O-OG1 3.11Å; I25-F134 HydrophobicContact CG2-CD2 4.23Å; I25-F134 HydrophobicContact CG2-CE2 3.67Å; I25-F134 HydrophobicContact CG2-CZ 4.46Å
26	T	66.6	Low	68	Low	0 Å²	0	26.4 Å²	26.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	140.4	176.6	-41.7	0	0	0	0	110.9	F87 L132 Y133 F134 F149	T26-F87 HydrophobicContact CG2-CD1 4.3Å; T26-F87 HydrophobicContact CG2-CD2 4.13Å; T26-F87 HydrophobicContact CG2-CE1 4.43Å; T26-F87 HydrophobicContact CG2-CE2 4.28Å; T26-F87 HydrophobicContact CG2-CG 4.14Å; T26-F87 HydrophobicContact CG2-CZ 4.42Å; T26-L132 PolarHBondContact N-O 3.39Å; T26-Y133 WeakPolarHBondContact O-CA 3.44Å; T26-F134 PolarHBondContact O-N 3.37Å; T26-F149 HydrophobicContact CG2-CE1 3.73Å; T26-F149 HydrophobicContact CG2-CE2 3.75Å; T26-F149 HydrophobicContact CG2-CZ 3.19Å
27	G	63.7	Low	70.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.5	163.6	177.8	0	0	0	0	0	111.3	K33	G27-K33 PolarHBondContact O-NZ 3Å
28	E	71.8	Confident	72.2	Confident	30 Å²	30	19.3 Å²	19.3	14%	0.14	13%	0.13	C	C	.	.			trans	-57	152.8	-176.3	-62.2	-179.4	155.9	0	0	112.6	L31 K33 F87 K143	E28-L31 HydrophobicContact CB-CD1 3.88Å; E28-L31 HydrophobicContact CB-CG 4.14Å; E28-L31 WeakPolarHBondContact O-CG 3.47Å; E28-K33 PolarHBondContact O-NZ 3Å; E28-F87 WeakPolarHBondContact CA-O 3.25Å; E28-K143 WeakPolarHBondContact OE1-CD 3.35Å; E28-K143 IonicContact OE1-NZ 3.94Å; E28-K143 PolarHBondContact OE1-NZ 3.33Å; E28-K143 IonicContact OE2-NZ 3.55Å; E28-K143 PolarHBondContact OE2-NZ 3.45Å
29	S	74.8	Confident	73.8	Confident	32 Å²	32	14.9 Å²	14.9	22%	0.224	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	151.3	174.5	-168.8	0	0	0	0	112	L31 S54 D89	S29-L31 VanDerWaalsContact C-N 3.26Å; S29-L31 PolarHBondContact O-N 2.89Å; S29-S54 WeakPolarHBondContact OG-CA 3.32Å; S29-S54 WeakPolarHBondContact OG-CB 3.05Å; S29-S54 PolarHBondContact OG-OG 3.38Å; S29-D89 VanDerWaalsContact CB-CG 3.45Å; S29-D89 WeakPolarHBondContact CB-OD1 3.44Å; S29-D89 WeakPolarHBondContact CB-OD2 3.15Å; S29-D89 PolarHBondContact N-OD1 2.67Å
30	G	76.6	Confident	74.9	Confident	37 Å²	37	13.5 Å²	13.5	38%	0.381	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	0.9	177.9	0	0	0	0	0	116.3	G32 S54 K165	G30-G32 PolarHBondContact O-N 3.33Å; G30-S54 PolarHBondContact N-OG 3.37Å; G30-K165 WeakPolarHBondContact O-CE 3.5Å; G30-K165 PolarHBondContact O-NZ 3.25Å
31	L	83.1	Confident	75.6	Confident	14 Å²	14	12.5 Å²	12.5	7%	0.073	9%	0.087	C	C	.	.	S	Bend	trans	-75.9	4.1	176.1	-65.6	-174.8	0	0	0	115.1	E28 S29 F134 A136 A164	E28-L31 HydrophobicContact CB-CD1 3.88Å; E28-L31 HydrophobicContact CB-CG 4.14Å; E28-L31 WeakPolarHBondContact O-CG 3.47Å; S29-L31 VanDerWaalsContact C-N 3.26Å; S29-L31 PolarHBondContact O-N 2.89Å; L31-F134 HydrophobicContact CB-CB 4.28Å; L31-F134 HydrophobicContact CB-CD1 4.39Å; L31-F134 HydrophobicContact CD1-CB 3.74Å; L31-F134 WeakPolarHBondContact CD1-O 3.4Å; L31-A136 HydrophobicContact CD2-CB 3.95Å; L31-A164 HydrophobicContact CB-CB 3.84Å; L31-A164 HydrophobicContact CD1-CB 4.38Å; L31-A164 HydrophobicContact CD2-CB 4.15Å; L31-A164 HydrophobicContact CG-CB 4.35Å
32	G	81.4	Confident	76.1	Confident	23 Å²	23	16.9 Å²	16.9	24%	0.237	11%	0.11	C	C	.	.	S	Bend	trans	82.2	20.2	178	0	0	0	0	0	114.8	G30 S34 T35 L36	G30-G32 PolarHBondContact O-N 3.33Å; G32-S34 PolarHBondContact O-N 2.89Å; G32-T35 PolarHBondContact O-N 3.27Å; G32-L36 PolarHBondContact O-N 3.09Å
33	K	83.4	Confident	76.3	Confident	6 Å²	6	19.3 Å²	19.3	3%	0.026	13%	0.125	C	C	.	.	H	α-helix	trans	-50.1	-52.2	177.8	-59.8	-174.2	-65.2	-97.7	0	112.7	I25 G27 E28 T35 L36 I37 F134	I25-K33 HydrophobicContact CG2-CB 4.1Å; I25-K33 HydrophobicContact CG2-CD 3.9Å; I25-K33 HydrophobicContact CG2-CG 4.17Å; G27-K33 PolarHBondContact O-NZ 3Å; E28-K33 PolarHBondContact O-NZ 3Å; K33-T35 PolarHBondContact O-N 2.94Å; K33-L36 PolarHBondContact O-N 3.37Å; K33-I37 WeakPolarHBondContact O-CG1 3.43Å; K33-I37 PolarHBondContact O-N 3.35Å; K33-I37 VanDerWaalsContact O-N 3.14Å; K33-F134 HydrophobicContact CB-CZ 4.31Å; K33-F134 HydrophobicContact CD-CD2 4.49Å; K33-F134 HydrophobicContact CG-CD1 4.12Å; K33-F134 HydrophobicContact CG-CD2 4.05Å; K33-F134 HydrophobicContact CG-CE1 4.16Å; K33-F134 HydrophobicContact CG-CE2 4.13Å; K33-F134 HydrophobicContact CG-CG 4.05Å; K33-F134 HydrophobicContact CG-CZ 4.15Å
34	S	81.9	Confident	76.3	Confident	19 Å²	19	24.9 Å²	24.9	13%	0.133	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-41.5	179.7	-62.8	0	0	0	0	113	G32 I37 N38 Y46 G52 P53	G32-S34 PolarHBondContact O-N 2.89Å; S34-I37 PolarHBondContact O-N 2.86Å; S34-N38 PolarHBondContact O-N 2.89Å; S34-Y46 VanDerWaalsContact CA-CD2 3.43Å; S34-G52 WeakPolarHBondContact OG-CA 3.42Å; S34-P53 WeakPolarHBondContact OG-CD 3.41Å
35	T	86.1	Confident	75.8	Confident	52 Å²	52	25.6 Å²	25.6	32%	0.319	16%	0.157	S	C	.	.	H	α-helix	trans	-64.7	-42.7	178	-45	0	0	0	0	111.3	G32 K33 I37 S39 N222	G32-T35 PolarHBondContact O-N 3.27Å; K33-T35 PolarHBondContact O-N 2.94Å; T35-I37 VanDerWaalsContact C-N 3.3Å; T35-I37 PolarHBondContact O-N 2.76Å; T35-S39 WeakPolarHBondContact O-CB 3.34Å; T35-S39 PolarHBondContact O-N 3.37Å; T35-S39 PolarHBondContact O-OG 3.45Å; T35-N222 PolarHBondContact O-OD1 2.91Å
36	L	86.5	Confident	75.8	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-62.3	-39.7	178.4	-169.2	73.3	0	0	0	111.4	G32 K33 S39 L40 F134 L162 V218 F252 L255	G32-L36 PolarHBondContact O-N 3.09Å; K33-L36 PolarHBondContact O-N 3.37Å; L36-S39 CarbonylContact O-C 3.45Å; L36-S39 WeakPolarHBondContact O-CB 3.45Å; L36-S39 PolarHBondContact O-N 2.93Å; L36-L40 HydrophobicContact CD2-CD1 4.22Å; L36-L40 HydrophobicContact CG-CD1 3.98Å; L36-L40 HydrophobicContact CG-CG 4.48Å; L36-L40 WeakPolarHBondContact O-CB 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.47Å; L36-L40 PolarHBondContact O-N 2.85Å; L36-F134 HydrophobicContact CB-CE1 4.21Å; L36-F134 HydrophobicContact CB-CZ 4.15Å; L36-F134 HydrophobicContact CD2-CE1 3.66Å; L36-F134 HydrophobicContact CD2-CE2 4.43Å; L36-F134 HydrophobicContact CD2-CZ 3.37Å; L36-F134 HydrophobicContact CG-CZ 4.38Å; L36-L162 HydrophobicContact CD2-CD1 4.01Å; L36-V218 HydrophobicContact CD1-CB 4.03Å; L36-V218 HydrophobicContact CD1-CG2 4.02Å; L36-V218 HydrophobicContact CD2-CG2 3.99Å; L36-F252 HydrophobicContact CD1-CD2 3.68Å; L36-F252 HydrophobicContact CD1-CE2 3.84Å; L36-L255 HydrophobicContact CD2-CD2 3.93Å
37	I	83.7	Confident	75.7	Confident	3 Å²	3	28 Å²	28	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-68.8	-46.7	-179.7	-70.8	-65.4	0	0	0	112.4	I25 K33 S34 T35 S39 L40 F41 L45 Y46 I81	I25-I37 HydrophobicContact CD1-CD1 3.28Å; I25-I37 HydrophobicContact CD1-CG1 3.3Å; I25-I37 HydrophobicContact CG1-CD1 4.15Å; K33-I37 WeakPolarHBondContact O-CG1 3.43Å; K33-I37 PolarHBondContact O-N 3.35Å; K33-I37 VanDerWaalsContact O-N 3.14Å; S34-I37 PolarHBondContact O-N 2.86Å; T35-I37 VanDerWaalsContact C-N 3.3Å; T35-I37 PolarHBondContact O-N 2.76Å; I37-S39 PolarHBondContact O-N 3.5Å; I37-L40 HydrophobicContact CD1-CD1 4.21Å; I37-L40 PolarHBondContact O-N 3.22Å; I37-F41 HydrophobicContact CD1-CE2 4.11Å; I37-F41 HydrophobicContact CG2-CD2 4.14Å; I37-F41 HydrophobicContact CG2-CE2 4.49Å; I37-F41 WeakPolarHBondContact O-CD2 3.48Å; I37-F41 PolarHBondContact O-N 3.17Å; I37-F41 VanDerWaalsContact O-N 3.13Å; I37-L45 HydrophobicContact CG2-CB 4.23Å; I37-L45 HydrophobicContact CG2-CD1 3.3Å; I37-L45 HydrophobicContact CG2-CG 4.37Å; I37-Y46 HydrophobicContact CB-CE2 3.84Å; I37-Y46 HydrophobicContact CG1-CE2 4.37Å; I37-Y46 HydrophobicContact CG2-CD2 4.35Å; I37-Y46 HydrophobicContact CG2-CE2 3.66Å; I37-I81 HydrophobicContact CG2-CD1 3.66Å
38	N	83.8	Confident	75.5	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-36.3	173	-71.6	13.2	0	0	0	110.6	S34 L42 T43 L45 Y46 N222	S34-N38 PolarHBondContact O-N 2.89Å; N38-L42 WeakPolarHBondContact O-CA 3.46Å; N38-L42 PolarHBondContact O-N 3.21Å; N38-T43 VanDerWaalsContact CA-O 3.32Å; N38-T43 WeakPolarHBondContact CA-O 3.48Å; N38-T43 PolarHBondContact O-N 3.27Å; N38-T43 PolarHBondContact OD1-O 2.83Å; N38-L45 PolarHBondContact OD1-N 3.15Å; N38-Y46 PolarHBondContact ND2-O 2.89Å; N38-Y46 WeakPolarHBondContact OD1-CD2 3.47Å; N38-Y46 PolarHBondContact OD1-N 3.02Å; N38-Y46 VanDerWaalsContact OD1-N 3.09Å; N38-N222 WeakPolarHBondContact CB-OD1 3.36Å; N38-N222 PolarHBondContact ND2-ND2 2.94Å
39	S	84.3	Confident	74.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-42.5	176.3	-57.9	0	0	0	0	113.1	T35 L36 I37 S221 R233 F252	T35-S39 WeakPolarHBondContact O-CB 3.34Å; T35-S39 PolarHBondContact O-N 3.37Å; T35-S39 PolarHBondContact O-OG 3.45Å; L36-S39 CarbonylContact O-C 3.45Å; L36-S39 WeakPolarHBondContact O-CB 3.45Å; L36-S39 PolarHBondContact O-N 2.93Å; I37-S39 PolarHBondContact O-N 3.5Å; S39-S221 PolarHBondContact OG-N 2.96Å; S39-S221 PolarHBondContact OG-O 2.87Å; S39-S221 VanDerWaalsContact OG-O 3.05Å; S39-R233 PolarHBondContact O-NH1 2.83Å; S39-R233 VanDerWaalsContact O-NH1 3.08Å; S39-F252 WeakPolarHBondContact O-CZ 3.43Å
40	L	81.2	Confident	74.4	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-44.4	-178.5	-88	160.6	0	0	0	111.7	L36 I37 F252 L255 R256 L259	L36-L40 HydrophobicContact CD2-CD1 4.22Å; L36-L40 HydrophobicContact CG-CD1 3.98Å; L36-L40 HydrophobicContact CG-CG 4.48Å; L36-L40 WeakPolarHBondContact O-CB 3.44Å; L36-L40 WeakPolarHBondContact O-CG 3.47Å; L36-L40 PolarHBondContact O-N 2.85Å; I37-L40 HydrophobicContact CD1-CD1 4.21Å; I37-L40 PolarHBondContact O-N 3.22Å; L40-F252 HydrophobicContact CD2-CE2 4.21Å; L40-F252 HydrophobicContact CD2-CZ 4.37Å; L40-F252 HydrophobicContact CG-CE2 3.94Å; L40-F252 HydrophobicContact CG-CZ 4.29Å; L40-L255 HydrophobicContact CD1-CD2 4.37Å; L40-L255 HydrophobicContact CD2-CD2 4.49Å; L40-L255 HydrophobicContact CD2-CG 4.39Å; L40-R256 HydrophobicContact CD2-CB 3.83Å; L40-R256 HydrophobicContact CD2-CG 4.14Å; L40-L259 HydrophobicContact CD1-CD1 4.5Å; L40-L259 HydrophobicContact CD2-CD1 4.46Å
41	F	74.4	Confident	73.9	Confident	14 Å²	14	43.6 Å²	43.6	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-103.5	3.4	-172.2	-62.1	-64.1	0	0	0	114.1	I37 T43 L45 I70 L79 I260	I37-F41 HydrophobicContact CD1-CE2 4.11Å; I37-F41 HydrophobicContact CG2-CD2 4.14Å; I37-F41 HydrophobicContact CG2-CE2 4.49Å; I37-F41 WeakPolarHBondContact O-CD2 3.48Å; I37-F41 PolarHBondContact O-N 3.17Å; I37-F41 VanDerWaalsContact O-N 3.13Å; F41-T43 PolarHBondContact O-N 2.86Å; F41-T43 PolarHBondContact O-OG1 2.93Å; F41-L45 HydrophobicContact CB-CD1 3.88Å; F41-L45 HydrophobicContact CD2-CD1 3.64Å; F41-L45 HydrophobicContact CG-CD1 4.12Å; F41-I70 HydrophobicContact CB-CD1 3.73Å; F41-I70 HydrophobicContact CD1-CD1 3.3Å; F41-I70 HydrophobicContact CD2-CD1 4.38Å; F41-I70 HydrophobicContact CE1-CD1 3.98Å; F41-I70 HydrophobicContact CG-CD1 3.52Å; F41-L79 HydrophobicContact CD1-CD2 4.03Å; F41-L79 HydrophobicContact CD2-CD2 3.63Å; F41-L79 HydrophobicContact CE1-CD1 4.34Å; F41-L79 HydrophobicContact CE1-CD2 3.64Å; F41-L79 HydrophobicContact CE2-CD2 3.23Å; F41-L79 HydrophobicContact CG-CD2 4.01Å; F41-L79 HydrophobicContact CZ-CD1 3.92Å; F41-L79 HydrophobicContact CZ-CD2 3.23Å; F41-L79 HydrophobicContact CZ-CG 4.2Å; F41-I260 HydrophobicContact CD1-CD1 4Å; F41-I260 HydrophobicContact CE1-CD1 3.77Å; F41-I260 HydrophobicContact CE1-CG1 4.13Å
42	L	71.8	Confident	73	Confident	95 Å²	95	43.3 Å²	43.3	50%	0.497	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	28	178.4	-50.3	177.8	0	0	0	113.2	N38	N38-L42 WeakPolarHBondContact O-CA 3.46Å; N38-L42 PolarHBondContact O-N 3.21Å
43	T	66.3	Low	72	Confident	55 Å²	55	42.3 Å²	42.3	34%	0.337	23%	0.233	S	C	.	.	S	Bend	trans	-134.5	139.9	-170.9	-54.7	0	0	0	0	108.1	N38 F41 L45	N38-T43 VanDerWaalsContact CA-O 3.32Å; N38-T43 WeakPolarHBondContact CA-O 3.48Å; N38-T43 PolarHBondContact O-N 3.27Å; N38-T43 PolarHBondContact OD1-O 2.83Å; F41-T43 PolarHBondContact O-N 2.86Å; F41-T43 PolarHBondContact O-OG1 2.93Å; T43-L45 HydrophobicContact CG2-CD2 4.14Å; T43-L45 HydrophobicContact CG2-CG 4.27Å; T43-L45 PolarHBondContact O-N 3.33Å
44	D	63.1	Low	71.2	Confident	127 Å²	127	43.7 Å²	43.7	68%	0.679	24%	0.243	S	C	*	.			trans	-76.2	66.8	174.6	-72.9	-36.5	0	0	0	111.2	Y46	D44-Y46 VanDerWaalsContact C-N 3.28Å; D44-Y46 PolarHBondContact O-N 2.83Å
45	L	61.8	Low	70.2	Confident	15 Å²	15	50.3 Å²	50.3	8%	0.079	27%	0.272	C	S	.	.			trans	-63.6	-36.8	178.6	-64.9	168.4	0	0	0	111.6	I37 N38 F41 T43 V68 I81	I37-L45 HydrophobicContact CG2-CB 4.23Å; I37-L45 HydrophobicContact CG2-CD1 3.3Å; I37-L45 HydrophobicContact CG2-CG 4.37Å; N38-L45 PolarHBondContact OD1-N 3.15Å; F41-L45 HydrophobicContact CB-CD1 3.88Å; F41-L45 HydrophobicContact CD2-CD1 3.64Å; F41-L45 HydrophobicContact CG-CD1 4.12Å; T43-L45 HydrophobicContact CG2-CD2 4.14Å; T43-L45 HydrophobicContact CG2-CG 4.27Å; T43-L45 PolarHBondContact O-N 3.33Å; L45-V68 HydrophobicContact CD2-CB 3.45Å; L45-V68 VanDerWaalsContact CD2-CB 3.45Å; L45-V68 HydrophobicContact CD2-CG1 3.43Å; L45-V68 VanDerWaalsContact CD2-CG1 3.43Å; L45-V68 HydrophobicContact CD2-CG2 3.31Å; L45-I81 HydrophobicContact CD1-CD1 3.72Å
46	Y	64.8	Low	69	Low	21 Å²	21	49.5 Å²	49.5	8%	0.082	26%	0.263	C	S	.	.	S	Bend	trans	-103.6	112.2	168.2	-57.9	-73	0	0	0	109.3	S34 I37 N38 D44 Y50 D83	S34-Y46 VanDerWaalsContact CA-CD2 3.43Å; I37-Y46 HydrophobicContact CB-CE2 3.84Å; I37-Y46 HydrophobicContact CG1-CE2 4.37Å; I37-Y46 HydrophobicContact CG2-CD2 4.35Å; I37-Y46 HydrophobicContact CG2-CE2 3.66Å; N38-Y46 PolarHBondContact ND2-O 2.89Å; N38-Y46 WeakPolarHBondContact OD1-CD2 3.47Å; N38-Y46 PolarHBondContact OD1-N 3.02Å; N38-Y46 VanDerWaalsContact OD1-N 3.09Å; D44-Y46 VanDerWaalsContact C-N 3.28Å; D44-Y46 PolarHBondContact O-N 2.83Å; Y46-Y50 WeakPolarHBondContact CA-O 3.41Å; Y46-Y50 HydrophobicContact CD1-CD1 4.01Å; Y46-Y50 HydrophobicContact CD1-CE1 4.17Å; Y46-Y50 HydrophobicContact CE1-CD1 4.31Å; Y46-Y50 AromaticContact CE1-CE1 4Å; Y46-Y50 HydrophobicContact CE1-CE1 4Å; Y46-D83 WeakPolarHBondContact CE1-OD2 3.48Å; Y46-D83 VanDerWaalsContact OH-CG 3.23Å; Y46-D83 PolarHBondContact OH-OD1 3.25Å; Y46-D83 PolarHBondContact OH-OD2 3.27Å
47	S	65.9	Low	67.8	Low	31 Å²	31	53.4 Å²	53.4	22%	0.217	28%	0.283	C	S	.	.			trans	-115.4	173	179.2	74.4	0	0	0	0	110.2	E49 Y50 P51	S47-E49 PolarHBondContact O-N 3.44Å; S47-E49 PolarHBondContact OG-N 2.85Å; S47-Y50 PolarHBondContact N-O 2.95Å; S47-Y50 VanDerWaalsContact N-O 3.17Å; S47-Y50 CarbonylContact O-C 3.58Å; S47-Y50 PolarHBondContact O-N 2.86Å; S47-Y50 VanDerWaalsContact O-N 3.15Å; S47-Y50 VanDerWaalsContact O-O 3.04Å; S47-Y50 PolarHBondContact OG-N 3.41Å; S47-P51 WeakPolarHBondContact O-CA 3.34Å
48	P	59.4	Low	66.7	Low	133 Å²	133	57.7 Å²	57.7	86%	0.864	30%	0.301	S	S	*	.	S	Bend	trans	-56.9	-26.5	170.7	-24.3	35	0	0	0	113.3
49	E	58.3	Low	65.2	Low	183 Å²	183	67.7 Å²	67.7	86%	0.855	35%	0.345	S	S	*	.	S	Bend	trans	-81.4	-30.7	178.5	-62.8	151.9	-176.1	0	0	112.1	S47	S47-E49 PolarHBondContact O-N 3.44Å; S47-E49 PolarHBondContact OG-N 2.85Å
50	Y	64.6	Low	64	Low	65 Å²	65	72 Å²	72	26%	0.255	37%	0.371	S	S	.	.	S	Bend	trans	-127.9	81.5	172.9	-170	-104.9	0	0	0	110.5	Y46 S47 R56	Y46-Y50 WeakPolarHBondContact CA-O 3.41Å; Y46-Y50 HydrophobicContact CD1-CD1 4.01Å; Y46-Y50 HydrophobicContact CD1-CE1 4.17Å; Y46-Y50 HydrophobicContact CE1-CD1 4.31Å; Y46-Y50 AromaticContact CE1-CE1 4Å; Y46-Y50 HydrophobicContact CE1-CE1 4Å; S47-Y50 PolarHBondContact N-O 2.95Å; S47-Y50 VanDerWaalsContact N-O 3.17Å; S47-Y50 CarbonylContact O-C 3.58Å; S47-Y50 PolarHBondContact O-N 2.86Å; S47-Y50 VanDerWaalsContact O-N 3.15Å; S47-Y50 VanDerWaalsContact O-O 3.04Å; S47-Y50 PolarHBondContact OG-N 3.41Å; Y50-R56 VanDerWaalsContact CZ-CZ 3.44Å; Y50-R56 VanDerWaalsContact CZ-NH2 3.34Å; Y50-R56 PolarHBondContact OH-NH1 3.04Å
51	P	66.5	Low	63.5	Low	45 Å²	45	73.2 Å²	73.2	29%	0.292	38%	0.378	S	S	.	.			trans	-70.4	161.1	-170.7	28.1	-34.8	0	0	0	112.1	S47 H55 R56	S47-P51 WeakPolarHBondContact O-CA 3.34Å; P51-H55 HydrophobicContact CB-CB 3.93Å; P51-H55 HydrophobicContact CG-CB 4.48Å; P51-R56 HydrophobicContact CG-CG 4.06Å; P51-R56 PolarHBondContact O-NE 3.46Å; P51-R56 PolarHBondContact O-NH2 3.29Å
52	G	64.3	Low	63.5	Low	8 Å²	8	75.8 Å²	75.8	8%	0.082	39%	0.39	C	S	.	.			trans	-59.9	162.7	-179.2	0	0	0	0	0	114.4	S34 S54 H55 R56	S34-G52 WeakPolarHBondContact OG-CA 3.42Å; G52-S54 PolarHBondContact O-N 3.09Å; G52-S54 VanDerWaalsContact O-N 3.09Å; G52-H55 PolarHBondContact O-N 2.91Å; G52-R56 PolarHBondContact O-N 3.27Å
53	P	60.1	Low	63.9	Low	2 Å²	2	73.1 Å²	73.1	1%	0.013	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-55.5	-30.9	179.9	-27.1	36.8	0	0	0	113.6	S34 H55 R56 D83 P85	S34-P53 WeakPolarHBondContact OG-CD 3.41Å; P53-H55 PolarHBondContact O-N 3.43Å; P53-R56 PolarHBondContact O-N 2.95Å; P53-D83 HydrophobicContact CB-CB 4.46Å; P53-D83 HydrophobicContact CG-CB 3.79Å; P53-D83 VanDerWaalsContact CG-CG 3.47Å; P53-P85 HydrophobicContact CB-CB 4.24Å
54	S	66.4	Low	64.5	Low	35 Å²	35	72.3 Å²	72.3	25%	0.245	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-65.5	-22.6	176.8	-45.7	0	0	0	0	114.2	S29 G30 G52 I57	S29-S54 WeakPolarHBondContact OG-CA 3.32Å; S29-S54 WeakPolarHBondContact OG-CB 3.05Å; S29-S54 PolarHBondContact OG-OG 3.38Å; G30-S54 PolarHBondContact N-OG 3.37Å; G52-S54 PolarHBondContact O-N 3.09Å; G52-S54 VanDerWaalsContact O-N 3.09Å; S54-I57 WeakPolarHBondContact O-CD1 3.4Å; S54-I57 WeakPolarHBondContact O-CG1 3.41Å
55	H	61.3	Low	65.4	Low	158 Å²	158	71 Å²	71	73%	0.731	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-98.3	-7	176.6	-70.4	-64.4	0	0	0	112.5	P51 G52 P53	P51-H55 HydrophobicContact CB-CB 3.93Å; P51-H55 HydrophobicContact CG-CB 4.48Å; G52-H55 PolarHBondContact O-N 2.91Å; P53-H55 PolarHBondContact O-N 3.43Å
56	R	60.8	Low	66.1	Low	34 Å²	34	71.4 Å²	71.4	13%	0.128	36%	0.364	C	S	.	.	S	Bend	trans	-109.1	31.1	178	-69.2	-176.1	-76.9	159.4	-10	112	Y50 P51 G52 P53 K58 E64 D83 P85	Y50-R56 VanDerWaalsContact CZ-CZ 3.44Å; Y50-R56 VanDerWaalsContact CZ-NH2 3.34Å; Y50-R56 PolarHBondContact OH-NH1 3.04Å; P51-R56 HydrophobicContact CG-CG 4.06Å; P51-R56 PolarHBondContact O-NE 3.46Å; P51-R56 PolarHBondContact O-NH2 3.29Å; G52-R56 PolarHBondContact O-N 3.27Å; P53-R56 PolarHBondContact O-N 2.95Å; R56-K58 PolarHBondContact O-N 3.46Å; R56-E64 IonicContact CZ-OE2 2.81Å; R56-E64 IonicContact NE-OE2 3.48Å; R56-E64 IonicContact NH1-OE2 3Å; R56-E64 PolarHBondContact NH1-OE2 3.31Å; R56-D83 IonicContact NH2-OD2 3.04Å; R56-P85 WeakPolarHBondContact O-CB 3.48Å
57	I	61	Low	66.9	Low	85 Å²	85	75.2 Å²	75.2	44%	0.436	38%	0.381	S	S	.	.			trans	-67.5	119.1	179.3	-58.2	168.9	0	0	0	108.7	S54	S54-I57 WeakPolarHBondContact O-CD1 3.4Å; S54-I57 WeakPolarHBondContact O-CG1 3.41Å
58	K	61.4	Low	67.4	Low	94 Å²	94	75.3 Å²	75.3	41%	0.409	38%	0.38	S	S	.	.			trans	-104.8	165.1	169	-65.9	171.5	-170.2	161.4	0	108.6	R56 T60 Q62 E64	R56-K58 PolarHBondContact O-N 3.46Å; K58-T60 PolarHBondContact O-N 2.9Å; K58-T60 VanDerWaalsContact O-N 3.07Å; K58-Q62 HydrophobicContact CD-CG 4.23Å; K58-Q62 VanDerWaalsContact CD-OE1 3.25Å; K58-E64 IonicContact NZ-OE1 2.66Å; K58-E64 PolarHBondContact NZ-OE1 2.55Å
59	K	51	Low	68.3	Low	219 Å²	219	73.4 Å²	73.4	95%	0.952	36%	0.363	S	S	*	.	S	Bend	trans	-58.6	-20.6	179.8	-76.1	-173	177.7	-178.2	0	114.1
60	T	58.9	Low	69.1	Low	93 Å²	93	65.2 Å²	65.2	57%	0.571	33%	0.325	S	S	*	.	S	Bend	trans	-124.8	148.9	177.7	53.2	0	0	0	0	110.3	K58 Q62	K58-T60 PolarHBondContact O-N 2.9Å; K58-T60 VanDerWaalsContact O-N 3.07Å; T60-Q62 PolarHBondContact O-N 3.35Å
61	V	72.5	Confident	69.5	Low	25 Å²	25	69.5 Å²	69.5	15%	0.152	35%	0.345	C	S	.	.			trans	-60.3	121.7	173.5	-177.8	0	0	0	0	108.5	C96 P99	V61-C96 HydrophobicContact CG2-CB 4.02Å; V61-P99 HydrophobicContact CB-CG 4.35Å
62	Q	72.8	Confident	69.6	Low	69 Å²	69	69.7 Å²	69.7	32%	0.322	34%	0.341	S	S	.	.			trans	-114.3	158.2	174.3	-64	-160.4	-5.9	0	0	110.4	K58 T60 T84 P85	K58-Q62 HydrophobicContact CD-CG 4.23Å; K58-Q62 VanDerWaalsContact CD-OE1 3.25Å; T60-Q62 PolarHBondContact O-N 3.35Å; Q62-T84 WeakPolarHBondContact O-CA 3.44Å; Q62-P85 HydrophobicContact CB-CG 4.38Å; Q62-P85 PolarHBondContact N-O 3.31Å; Q62-P85 VanDerWaalsContact O-CD 3.24Å; Q62-P85 WeakPolarHBondContact O-CD 3.26Å
63	V	80.9	Confident	69.6	Low	38 Å²	38	72.9 Å²	72.9	23%	0.23	38%	0.375	C	S	.	.			trans	-113.2	114.5	173.9	-173.5	0	0	0	0	107.7	R24 V82 D83 T84 P99 Y103	R24-V63 VanDerWaalsContact NH2-CG1 3.29Å; V63-V82 HydrophobicContact CG1-CG1 3.33Å; V63-D83 WeakPolarHBondContact CA-O 3.48Å; V63-T84 HydrophobicContact CG2-CG2 4.45Å; V63-P99 HydrophobicContact CG2-CB 4.21Å; V63-P99 WeakPolarHBondContact CG2-O 3.35Å; V63-Y103 HydrophobicContact CB-CD2 4.19Å; V63-Y103 HydrophobicContact CB-CG 4.39Å; V63-Y103 HydrophobicContact CG1-CD1 4.13Å; V63-Y103 HydrophobicContact CG1-CD2 3.58Å; V63-Y103 HydrophobicContact CG1-CE1 4.48Å; V63-Y103 HydrophobicContact CG1-CE2 3.97Å; V63-Y103 HydrophobicContact CG1-CG 3.66Å
64	E	78.5	Confident	70	Confident	38 Å²	38	75.7 Å²	75.7	18%	0.178	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	138.5	-179.6	-65.4	-174	173.7	0	0	109.1	R56 K58 D83 P85	R56-E64 IonicContact CZ-OE2 2.81Å; R56-E64 IonicContact NE-OE2 3.48Å; R56-E64 IonicContact NH1-OE2 3Å; R56-E64 PolarHBondContact NH1-OE2 3.31Å; K58-E64 IonicContact NZ-OE1 2.66Å; K58-E64 PolarHBondContact NZ-OE1 2.55Å; E64-D83 PolarHBondContact N-O 3.26Å; E64-D83 PolarHBondContact O-N 3.32Å; E64-P85 HydrophobicContact CG-CG 4.47Å
65	Q	81.8	Confident	70.2	Confident	99 Å²	99	76.6 Å²	76.6	46%	0.463	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.9	-179.5	66.3	-179.2	16.1	0	0	110.3	T80 I81 Y103	Q65-T80 HydrophobicContact CB-CG2 4.46Å; Q65-I81 CarbonylContact C-O 3.31Å; Q65-I81 WeakPolarHBondContact CA-O 3.49Å; Q65-Y103 PolarHBondContact OE1-OH 2.97Å
66	S	77.4	Confident	70.9	Confident	25 Å²	25	73.4 Å²	73.4	18%	0.175	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134.2	170.9	-174.8	0	0	0	0	109.4	T80 I81	S66-T80 CarbonylContact O-C 3.48Å; S66-T80 WeakPolarHBondContact O-CA 3.26Å; S66-I81 PolarHBondContact N-O 3.32Å; S66-I81 PolarHBondContact O-N 3.48Å
67	K	80.5	Confident	71.5	Confident	100 Å²	100	72.4 Å²	72.4	44%	0.435	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.4	178.8	-65.4	-169.1	173.3	-167.7	0	109	L78 L79 T80 N126	K67-L78 HydrophobicContact CB-CD1 4.44Å; K67-L79 CarbonylContact C-O 3.6Å; K67-L79 WeakPolarHBondContact CA-O 3.24Å; K67-T80 HydrophobicContact CG-CG2 4.02Å; K67-N126 PolarHBondContact NZ-OD1 3.23Å
68	V	76.4	Confident	72.5	Confident	33 Å²	33	70.9 Å²	70.9	20%	0.2	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.2	177.7	-179.4	0	0	0	0	110.5	L45 I70 L79	L45-V68 HydrophobicContact CD2-CB 3.45Å; L45-V68 VanDerWaalsContact CD2-CB 3.45Å; L45-V68 HydrophobicContact CD2-CG1 3.43Å; L45-V68 VanDerWaalsContact CD2-CG1 3.43Å; L45-V68 HydrophobicContact CD2-CG2 3.31Å; V68-I70 HydrophobicContact CG1-CG1 4.21Å; V68-L79 PolarHBondContact N-O 2.87Å; V68-L79 PolarHBondContact O-N 2.74Å
69	L	79.3	Confident	73.3	Confident	94 Å²	94	66.4 Å²	66.4	49%	0.492	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119	174.6	-172.2	67.5	0	0	0	109.1	L18 Q76 L78	L18-L69 HydrophobicContact CD2-CD1 3.38Å; L69-Q76 HydrophobicContact CD1-CB 4.19Å; L69-L78 HydrophobicContact CD1-CB 4.42Å
70	I	74.9	Confident	74.7	Confident	11 Å²	11	56.2 Å²	56.2	6%	0.056	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.4	-178.5	-58.4	172.6	0	0	0	108	F41 V68 Q76 L77 L79	F41-I70 HydrophobicContact CB-CD1 3.73Å; F41-I70 HydrophobicContact CD1-CD1 3.3Å; F41-I70 HydrophobicContact CD2-CD1 4.38Å; F41-I70 HydrophobicContact CE1-CD1 3.98Å; F41-I70 HydrophobicContact CG-CD1 3.52Å; V68-I70 HydrophobicContact CG1-CG1 4.21Å; I70-Q76 CarbonylContact O-C 3.59Å; I70-Q76 WeakPolarHBondContact O-CA 3.44Å; I70-L77 PolarHBondContact N-O 3.14Å; I70-L77 PolarHBondContact O-N 3.13Å; I70-L79 HydrophobicContact CD1-CB 3.85Å; I70-L79 HydrophobicContact CD1-CD2 3.67Å; I70-L79 HydrophobicContact CD1-CG 4.41Å
71	K	73.2	Confident	75.8	Confident	155 Å²	155	51.9 Å²	51.9	67%	0.674	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	109.7	174.8	-169.4	178.4	-179	-179.7	0	109.1	V75	K71-V75 WeakPolarHBondContact CA-O 3.4Å
72	E	67.3	Low	76.2	Confident	48 Å²	48	50.7 Å²	50.7	22%	0.224	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.4	178.6	-162.3	158.8	-176.6	0	0	109.6	G74 V75 R256 I260	E72-G74 PolarHBondContact O-N 2.87Å; E72-G74 VanDerWaalsContact O-N 3.12Å; E72-V75 PolarHBondContact N-O 3.16Å; E72-V75 PolarHBondContact O-N 3.13Å; E72-V75 VanDerWaalsContact O-N 3.12Å; E72-R256 IonicContact OE1-CZ 2.72Å; E72-R256 IonicContact OE1-NE 2.68Å; E72-R256 IonicContact OE1-NH2 2.71Å; E72-R256 PolarHBondContact OE1-NH2 3.36Å; E72-I260 WeakPolarHBondContact OE2-CG2 3.27Å
73	G	64.3	Low	76.6	Confident	76 Å²	76	47.5 Å²	47.5	78%	0.784	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	18.7	179	0	0	0	0	0	115.8
74	G	69.5	Low	76.5	Confident	60 Å²	60	45.8 Å²	45.8	62%	0.619	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	-10.9	-177	0	0	0	0	0	114.5	E72	E72-G74 PolarHBondContact O-N 2.87Å; E72-G74 VanDerWaalsContact O-N 3.12Å
75	V	71.6	Confident	76.3	Confident	55 Å²	55	44 Å²	44	33%	0.333	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	139.1	174.5	-177.9	0	0	0	0	109.8	K71 E72	K71-V75 WeakPolarHBondContact CA-O 3.4Å; E72-V75 PolarHBondContact N-O 3.16Å; E72-V75 PolarHBondContact O-N 3.13Å; E72-V75 VanDerWaalsContact O-N 3.12Å
76	Q	74.4	Confident	75.7	Confident	91 Å²	91	39.7 Å²	39.7	43%	0.425	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.8	172.7	-65.3	-174.1	14.6	0	0	110	L18 A19 L69 I70	L18-Q76 HydrophobicContact CD2-CB 3.83Å; A19-Q76 PolarHBondContact N-O 2.68Å; L69-Q76 HydrophobicContact CD1-CB 4.19Å; I70-Q76 CarbonylContact O-C 3.59Å; I70-Q76 WeakPolarHBondContact O-CA 3.44Å
77	L	74.4	Confident	75.8	Confident	13 Å²	13	38.6 Å²	38.6	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.6	178.6	-175.4	73.9	0	0	0	109.3	A19 Q21 I70 L79 M264	A19-L77 HydrophobicContact CB-CD1 3.89Å; A19-L77 CarbonylContact O-C 3.59Å; A19-L77 VanDerWaalsContact O-CA 3.31Å; A19-L77 WeakPolarHBondContact O-CA 3.38Å; Q21-L77 HydrophobicContact CB-CD1 3.92Å; Q21-L77 HydrophobicContact CB-CG 4.42Å; I70-L77 PolarHBondContact N-O 3.14Å; I70-L77 PolarHBondContact O-N 3.13Å; L77-L79 PolarHBondContact O-N 3.31Å; L77-M264 HydrophobicContact CD1-CE 4.38Å; L77-M264 HydrophobicContact CD1-SD 3.7Å
78	L	80.6	Confident	75.6	Confident	52 Å²	52	34.5 Å²	34.5	27%	0.272	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	101.6	168	-177.3	67.2	0	0	0	108.7	A19 S20 Q21 K67 L69	A19-L78 PolarHBondContact O-N 2.86Å; S20-L78 WeakPolarHBondContact CA-O 3.49Å; Q21-L78 PolarHBondContact N-O 3.47Å; K67-L78 HydrophobicContact CB-CD1 4.44Å; L69-L78 HydrophobicContact CD1-CB 4.42Å
79	L	78.4	Confident	75.6	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124	176.6	-177.1	74	0	0	0	110.3	Q21 A23 F41 K67 V68 I70 L77 I81	Q21-L79 HydrophobicContact CB-CD1 4.25Å; Q21-L79 HydrophobicContact CG-CD1 4.33Å; Q21-L79 CarbonylContact O-C 3.49Å; Q21-L79 VanDerWaalsContact O-CA 3.28Å; Q21-L79 WeakPolarHBondContact O-CA 3.41Å; A23-L79 HydrophobicContact CB-CD1 4.31Å; F41-L79 HydrophobicContact CD1-CD2 4.03Å; F41-L79 HydrophobicContact CD2-CD2 3.63Å; F41-L79 HydrophobicContact CE1-CD1 4.34Å; F41-L79 HydrophobicContact CE1-CD2 3.64Å; F41-L79 HydrophobicContact CE2-CD2 3.23Å; F41-L79 HydrophobicContact CG-CD2 4.01Å; F41-L79 HydrophobicContact CZ-CD1 3.92Å; F41-L79 HydrophobicContact CZ-CD2 3.23Å; F41-L79 HydrophobicContact CZ-CG 4.2Å; K67-L79 CarbonylContact C-O 3.6Å; K67-L79 WeakPolarHBondContact CA-O 3.24Å; V68-L79 PolarHBondContact N-O 2.87Å; V68-L79 PolarHBondContact O-N 2.74Å; I70-L79 HydrophobicContact CD1-CB 3.85Å; I70-L79 HydrophobicContact CD1-CD2 3.67Å; I70-L79 HydrophobicContact CD1-CG 4.41Å; L77-L79 PolarHBondContact O-N 3.31Å; L79-I81 HydrophobicContact CD2-CD1 3.71Å; L79-I81 HydrophobicContact CD2-CG1 3.73Å; L79-I81 HydrophobicContact CG-CD1 4.46Å; L79-I81 HydrophobicContact CG-CG1 4.02Å
80	T	82.1	Confident	75.6	Confident	4 Å²	4	34 Å²	34	3%	0.025	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.9	168.1	-55.4	0	0	0	0	109	Q21 S22 A23 Q65 S66 K67 V82	Q21-T80 PolarHBondContact O-N 3.34Å; S22-T80 CarbonylContact C-O 3.58Å; S22-T80 WeakPolarHBondContact CA-O 3.33Å; A23-T80 PolarHBondContact N-O 2.98Å; A23-T80 VanDerWaalsContact O-O 3.11Å; Q65-T80 HydrophobicContact CB-CG2 4.46Å; S66-T80 CarbonylContact O-C 3.48Å; S66-T80 WeakPolarHBondContact O-CA 3.26Å; K67-T80 HydrophobicContact CG-CG2 4.02Å; T80-V82 HydrophobicContact CG2-CG2 4.37Å
81	I	80.9	Confident	75.8	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.3	174.7	-66.7	161.6	0	0	0	108.5	A23 I25 I37 L45 Q65 S66 L79	A23-I81 WeakPolarHBondContact O-CA 3.47Å; I25-I81 HydrophobicContact CD1-CG2 3.42Å; I25-I81 VanDerWaalsContact CD1-CG2 3.42Å; I25-I81 HydrophobicContact CG1-CG2 4.13Å; I37-I81 HydrophobicContact CG2-CD1 3.66Å; L45-I81 HydrophobicContact CD1-CD1 3.72Å; Q65-I81 CarbonylContact C-O 3.31Å; Q65-I81 WeakPolarHBondContact CA-O 3.49Å; S66-I81 PolarHBondContact N-O 3.32Å; S66-I81 PolarHBondContact O-N 3.48Å; L79-I81 HydrophobicContact CD2-CD1 3.71Å; L79-I81 HydrophobicContact CD2-CG1 3.73Å; L79-I81 HydrophobicContact CG-CD1 4.46Å; L79-I81 HydrophobicContact CG-CG1 4.02Å
82	V	81.9	Confident	76.1	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	112.5	175.3	-177.5	0	0	0	0	109.1	A23 R24 I25 V63 T80 Y103	A23-V82 PolarHBondContact O-N 3.47Å; R24-V82 HydrophobicContact CB-CB 4.09Å; R24-V82 HydrophobicContact CG-CB 4Å; R24-V82 HydrophobicContact CG-CG1 4.14Å; I25-V82 PolarHBondContact N-O 2.99Å; V63-V82 HydrophobicContact CG1-CG1 3.33Å; T80-V82 HydrophobicContact CG2-CG2 4.37Å; V82-Y103 HydrophobicContact CB-CE1 4.41Å; V82-Y103 HydrophobicContact CG1-CD1 4.17Å; V82-Y103 HydrophobicContact CG1-CE1 3.72Å; V82-Y103 HydrophobicContact CG2-CE1 3.86Å; V82-Y103 WeakPolarHBondContact CG2-OH 3.42Å
83	D	79.9	Confident	76.8	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	153.8	-179.6	-71.1	-35.8	0	0	0	112.1	Y46 P53 R56 V63 E64	Y46-D83 WeakPolarHBondContact CE1-OD2 3.48Å; Y46-D83 VanDerWaalsContact OH-CG 3.23Å; Y46-D83 PolarHBondContact OH-OD1 3.25Å; Y46-D83 PolarHBondContact OH-OD2 3.27Å; P53-D83 HydrophobicContact CB-CB 4.46Å; P53-D83 HydrophobicContact CG-CB 3.79Å; P53-D83 VanDerWaalsContact CG-CG 3.47Å; R56-D83 IonicContact NH2-OD2 3.04Å; V63-D83 WeakPolarHBondContact CA-O 3.48Å; E64-D83 PolarHBondContact N-O 3.26Å; E64-D83 PolarHBondContact O-N 3.32Å
84	T	78.9	Confident	77.7	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	24%	0.243	C	C	.	.			trans	-126.2	69.8	177	46.2	0	0	0	0	111.5	I25 Q62 V63 G86 F87 V100	I25-T84 PolarHBondContact O-OG1 3.03Å; I25-T84 VanDerWaalsContact O-OG1 3.11Å; Q62-T84 WeakPolarHBondContact O-CA 3.44Å; V63-T84 HydrophobicContact CG2-CG2 4.45Å; T84-G86 PolarHBondContact O-N 2.97Å; T84-F87 PolarHBondContact O-N 3.42Å; T84-V100 HydrophobicContact CG2-CG2 3.73Å
85	P	74.6	Confident	78.3	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.013	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	137.7	175.1	24.7	-35.5	0	0	0	111.7	P53 R56 Q62 E64	P53-P85 HydrophobicContact CB-CB 4.24Å; R56-P85 WeakPolarHBondContact O-CB 3.48Å; Q62-P85 HydrophobicContact CB-CG 4.38Å; Q62-P85 PolarHBondContact N-O 3.31Å; Q62-P85 VanDerWaalsContact O-CD 3.24Å; Q62-P85 WeakPolarHBondContact O-CD 3.26Å; E64-P85 HydrophobicContact CG-CG 4.47Å
86	G	69.9	Low	78.9	Confident	8 Å²	8	37.9 Å²	37.9	8%	0.082	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	2.3	179	0	0	0	0	0	115.7	T84 G88 D89	T84-G86 PolarHBondContact O-N 2.97Å; G86-G88 PolarHBondContact O-N 2.93Å; G86-D89 WeakPolarHBondContact CA-OD2 3.01Å
87	F	79.2	Confident	79.5	Confident	1 Å²	1	34.5 Å²	34.5	0%	0.004	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	120.3	175.8	-177.6	-91.5	0	0	0	111.3	T26 E28 T84 D89 C96 Y133 L145 F149	T26-F87 HydrophobicContact CG2-CD1 4.3Å; T26-F87 HydrophobicContact CG2-CD2 4.13Å; T26-F87 HydrophobicContact CG2-CE1 4.43Å; T26-F87 HydrophobicContact CG2-CE2 4.28Å; T26-F87 HydrophobicContact CG2-CG 4.14Å; T26-F87 HydrophobicContact CG2-CZ 4.42Å; E28-F87 WeakPolarHBondContact CA-O 3.25Å; T84-F87 PolarHBondContact O-N 3.42Å; F87-D89 VanDerWaalsContact C-N 3.29Å; F87-D89 PolarHBondContact O-N 2.9Å; F87-C96 HydrophobicContact CD2-CB 4.37Å; F87-C96 HydrophobicContact CE2-CB 4.42Å; F87-C96 WeakPolarHBondContact CE2-SG 3.42Å; F87-Y133 HydrophobicContact CE1-CE2 4.4Å; F87-L145 HydrophobicContact CE1-CD2 4.44Å; F87-L145 HydrophobicContact CZ-CG 4.45Å; F87-F149 HydrophobicContact CD2-CD2 4.42Å; F87-F149 HydrophobicContact CD2-CE2 4.24Å; F87-F149 AromaticContact CE2-CD2 3.26Å; F87-F149 HydrophobicContact CE2-CD2 3.26Å; F87-F149 AromaticContact CE2-CE2 3.44Å; F87-F149 HydrophobicContact CE2-CE2 3.44Å; F87-F149 VanDerWaalsContact CE2-CE2 3.44Å; F87-F149 HydrophobicContact CE2-CG 4.11Å; F87-F149 HydrophobicContact CE2-CZ 4.4Å; F87-F149 HydrophobicContact CZ-CB 4.18Å; F87-F149 AromaticContact CZ-CD2 3.41Å; F87-F149 HydrophobicContact CZ-CD2 3.41Å; F87-F149 VanDerWaalsContact CZ-CD2 3.41Å; F87-F149 AromaticContact CZ-CE2 3.9Å; F87-F149 HydrophobicContact CZ-CE2 3.9Å; F87-F149 AromaticContact CZ-CG 3.78Å; F87-F149 HydrophobicContact CZ-CG 3.78Å
88	G	75	Confident	80.3	Confident	15 Å²	15	37.5 Å²	37.5	16%	0.155	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	3.8	176.7	0	0	0	0	0	115.3	G86 N93	G86-G88 PolarHBondContact O-N 2.93Å; G88-N93 WeakPolarHBondContact CA-OD1 3.48Å
89	D	77.7	Confident	80.7	Confident	67 Å²	67	37 Å²	37	36%	0.358	22%	0.221	S	C	.	.			trans	-93	-14.3	-175.2	-63.6	-27	0	0	0	113.4	S29 G86 F87	S29-D89 VanDerWaalsContact CB-CG 3.45Å; S29-D89 WeakPolarHBondContact CB-OD1 3.44Å; S29-D89 WeakPolarHBondContact CB-OD2 3.15Å; S29-D89 PolarHBondContact N-OD1 2.67Å; G86-D89 WeakPolarHBondContact CA-OD2 3.01Å; F87-D89 VanDerWaalsContact C-N 3.29Å; F87-D89 PolarHBondContact O-N 2.9Å
90	A	78.5	Confident	81.2	Confident	49 Å²	49	37 Å²	37	41%	0.405	22%	0.221	S	C	.	.	S	Bend	trans	-83.8	156	-178.5	0	0	0	0	0	111.7	D92 N93	A90-D92 VanDerWaalsContact C-N 3.29Å; A90-D92 WeakPolarHBondContact CB-O 3.39Å; A90-N93 PolarHBondContact N-OD1 3.17Å; A90-N93 PolarHBondContact O-ND2 3.14Å; A90-N93 PolarHBondContact O-OD1 2.97Å
91	V	79.3	Confident	81.6	Confident	160 Å²	160	37.5 Å²	37.5	97%	0.97	22%	0.223	S	C	*	.	S	Bend	trans	-65.1	-39.3	171.8	179	0	0	0	0	110.4
92	D	80.5	Confident	82.2	Confident	114 Å²	114	41.6 Å²	41.6	61%	0.61	25%	0.245	S	C	*	.			trans	-107.7	108.8	170.5	-177.2	13.3	0	0	0	109.4	A90 S94	A90-D92 VanDerWaalsContact C-N 3.29Å; A90-D92 WeakPolarHBondContact CB-O 3.39Å; D92-S94 WeakPolarHBondContact OD1-CB 3.43Å; D92-S94 PolarHBondContact OD1-N 2.85Å; D92-S94 PolarHBondContact OD1-OG 3.26Å
93	N	80.7	Confident	82.6	Confident	37 Å²	37	43.3 Å²	43.3	20%	0.198	25%	0.252	C	S	.	.			trans	-98.1	16.4	176.5	-68	-60	0	0	0	112.4	G88 A90 N95 C96 L145	G88-N93 WeakPolarHBondContact CA-OD1 3.48Å; A90-N93 PolarHBondContact N-OD1 3.17Å; A90-N93 PolarHBondContact O-ND2 3.14Å; A90-N93 PolarHBondContact O-OD1 2.97Å; N93-N95 PolarHBondContact O-N 3Å; N93-C96 HydrophobicContact CB-CB 4.44Å; N93-C96 WeakPolarHBondContact O-CB 3.34Å; N93-C96 PolarHBondContact O-N 2.75Å; N93-C96 PolarHBondContact O-SG 3.24Å; N93-C96 VanDerWaalsContact O-SG 3.36Å; N93-L145 HydrophobicContact CB-CD1 4.05Å; N93-L145 HydrophobicContact CB-CD2 4.38Å
94	S	82.8	Confident	83.1	Confident	76 Å²	76	43.3 Å²	43.3	53%	0.531	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	128.2	175.3	-61.5	0	0	0	0	110.4	D92 C96	D92-S94 WeakPolarHBondContact OD1-CB 3.43Å; D92-S94 PolarHBondContact OD1-N 2.85Å; D92-S94 PolarHBondContact OD1-OG 3.26Å; S94-C96 PolarHBondContact O-N 3.02Å
95	N	83.4	Confident	83.8	Confident	92 Å²	92	44.9 Å²	44.9	49%	0.492	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	20.7	179.2	-52.7	-53.6	0	0	0	115.7	N93 W97 Q98	N93-N95 PolarHBondContact O-N 3Å; N95-W97 PolarHBondContact O-N 3.29Å; N95-W97 VanDerWaalsContact O-N 3.08Å; N95-Q98 HydrophobicContact CB-CB 4.38Å; N95-Q98 WeakPolarHBondContact O-CB 3.47Å; N95-Q98 PolarHBondContact O-N 3.12Å
96	C	84.6	Confident	84.6	Confident	8 Å²	8	47.3 Å²	47.3	5%	0.054	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.4	176.4	70.6	0	0	0	0	113.4	V61 F87 N93 S94	V61-C96 HydrophobicContact CG2-CB 4.02Å; F87-C96 HydrophobicContact CD2-CB 4.37Å; F87-C96 HydrophobicContact CE2-CB 4.42Å; F87-C96 WeakPolarHBondContact CE2-SG 3.42Å; N93-C96 HydrophobicContact CB-CB 4.44Å; N93-C96 WeakPolarHBondContact O-CB 3.34Å; N93-C96 PolarHBondContact O-N 2.75Å; N93-C96 PolarHBondContact O-SG 3.24Å; N93-C96 VanDerWaalsContact O-SG 3.36Å; S94-C96 PolarHBondContact O-N 3.02Å
97	W	87	Confident	85.6	Confident	20 Å²	20	48.6 Å²	48.6	8%	0.076	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.7	172.4	50.1	75.6	0	0	0	114	N95 V100 I101 L145 E148 F149 R152	N95-W97 PolarHBondContact O-N 3.29Å; N95-W97 VanDerWaalsContact O-N 3.08Å; W97-V100 WeakPolarHBondContact O-CA 3.39Å; W97-V100 VanDerWaalsContact O-CB 3.26Å; W97-V100 WeakPolarHBondContact O-CB 3.33Å; W97-V100 PolarHBondContact O-N 3.06Å; W97-V100 VanDerWaalsContact O-N 3.09Å; W97-I101 HydrophobicContact CB-CD1 4.42Å; W97-I101 HydrophobicContact CG-CD1 4.44Å; W97-I101 WeakPolarHBondContact O-CG1 3.39Å; W97-I101 PolarHBondContact O-N 3.27Å; W97-L145 HydrophobicContact CZ3-CD1 4.22Å; W97-E148 HydrophobicContact CE3-CG 4.22Å; W97-E148 HydrophobicContact CH2-CB 4.49Å; W97-E148 HydrophobicContact CH2-CG 3.52Å; W97-E148 HydrophobicContact CZ2-CG 4.05Å; W97-E148 HydrophobicContact CZ3-CB 4.18Å; W97-E148 HydrophobicContact CZ3-CG 3.62Å; W97-F149 HydrophobicContact CB-CD2 3.71Å; W97-F149 HydrophobicContact CB-CE2 4Å; W97-R152 VanDerWaalsContact CD1-CD 3.43Å; W97-R152 VanDerWaalsContact CE2-CZ 3.43Å; W97-R152 VanDerWaalsContact CZ2-CZ 3.44Å; W97-R152 VanDerWaalsContact NE1-CD 3.32Å; W97-R152 VanDerWaalsContact NE1-CZ 3.26Å
98	Q	90.2	Very high	86.3	Confident	75 Å²	75	48.6 Å²	48.6	35%	0.35	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-47.2	-172.9	-167.6	63.2	45.8	0	0	112.7	N95 V100 I101 D102	N95-Q98 HydrophobicContact CB-CB 4.38Å; N95-Q98 WeakPolarHBondContact O-CB 3.47Å; N95-Q98 PolarHBondContact O-N 3.12Å; Q98-V100 PolarHBondContact O-N 3.02Å; Q98-V100 VanDerWaalsContact O-N 3.13Å; Q98-I101 PolarHBondContact O-N 3.16Å; Q98-I101 VanDerWaalsContact O-N 3.12Å; Q98-D102 PolarHBondContact NE2-OD1 3.39Å; Q98-D102 WeakPolarHBondContact O-CB 3.41Å; Q98-D102 PolarHBondContact O-N 3.37Å
99	P	89.4	Confident	87	Confident	43 Å²	43	50.5 Å²	50.5	28%	0.279	29%	0.285	S	S	.	.	H	α-helix	trans	-60.2	-29	176.1	-23.5	35.6	0	0	0	112.9	V61 V63 Y103	V61-P99 HydrophobicContact CB-CG 4.35Å; V63-P99 HydrophobicContact CG2-CB 4.21Å; V63-P99 WeakPolarHBondContact CG2-O 3.35Å; P99-Y103 WeakPolarHBondContact O-CB 3.45Å; P99-Y103 PolarHBondContact O-N 3.06Å; P99-Y103 VanDerWaalsContact O-N 3.17Å
100	V	88.8	Confident	87.6	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.4	-48.7	177.3	178.3	0	0	0	0	110.8	R24 T84 W97 Q98 Y103 I104 F149 L153	R24-V100 PolarHBondContact NH1-O 3.25Å; T84-V100 HydrophobicContact CG2-CG2 3.73Å; W97-V100 WeakPolarHBondContact O-CA 3.39Å; W97-V100 VanDerWaalsContact O-CB 3.26Å; W97-V100 WeakPolarHBondContact O-CB 3.33Å; W97-V100 PolarHBondContact O-N 3.06Å; W97-V100 VanDerWaalsContact O-N 3.09Å; Q98-V100 PolarHBondContact O-N 3.02Å; Q98-V100 VanDerWaalsContact O-N 3.13Å; V100-Y103 PolarHBondContact O-N 3.17Å; V100-I104 HydrophobicContact CG1-CD1 4.29Å; V100-I104 WeakPolarHBondContact O-CG1 3.37Å; V100-I104 PolarHBondContact O-N 3.15Å; V100-I104 VanDerWaalsContact O-N 3.16Å; V100-F149 HydrophobicContact CB-CE2 4.36Å; V100-F149 HydrophobicContact CG1-CE2 4.19Å; V100-F149 HydrophobicContact CG1-CZ 3.97Å; V100-F149 HydrophobicContact CG2-CE2 4.16Å; V100-L153 HydrophobicContact CG1-CD1 4.05Å; V100-L153 HydrophobicContact CG1-CD2 3.76Å; V100-L153 HydrophobicContact CG1-CG 4.42Å
101	I	91.2	Very high	88.2	Confident	15 Å²	15	50.7 Å²	50.7	8%	0.077	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-48.8	177.8	-65.1	170	0	0	0	110.2	W97 Q98 Y103 I104 D105 R152 L153 K156	W97-I101 HydrophobicContact CB-CD1 4.42Å; W97-I101 HydrophobicContact CG-CD1 4.44Å; W97-I101 WeakPolarHBondContact O-CG1 3.39Å; W97-I101 PolarHBondContact O-N 3.27Å; Q98-I101 PolarHBondContact O-N 3.16Å; Q98-I101 VanDerWaalsContact O-N 3.12Å; I101-Y103 PolarHBondContact O-N 3.36Å; I101-I104 PolarHBondContact O-N 3.29Å; I101-D105 PolarHBondContact O-N 3.41Å; I101-R152 HydrophobicContact CD1-CB 3.99Å; I101-L153 HydrophobicContact CD1-CD1 4.32Å; I101-L153 HydrophobicContact CG1-CD1 3.64Å; I101-K156 HydrophobicContact CG2-CD 3.98Å
102	D	91.8	Very high	88.7	Confident	88 Å²	88	43.7 Å²	43.7	47%	0.471	23%	0.234	S	C	.	.	H	α-helix	trans	-58.4	-39.5	-179.1	-65.7	-17.6	0	0	0	111.5	Q98 S106	Q98-D102 PolarHBondContact NE2-OD1 3.39Å; Q98-D102 WeakPolarHBondContact O-CB 3.41Å; Q98-D102 PolarHBondContact O-N 3.37Å; D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.18Å
103	Y	90.9	Very high	89	Confident	36 Å²	36	41.8 Å²	41.8	14%	0.141	22%	0.224	C	C	.	.	H	α-helix	trans	-65.1	-45.4	175	179	-86.7	0	0	0	112.3	V63 Q65 V82 P99 V100 I101 S106 K107 V128	V63-Y103 HydrophobicContact CB-CD2 4.19Å; V63-Y103 HydrophobicContact CB-CG 4.39Å; V63-Y103 HydrophobicContact CG1-CD1 4.13Å; V63-Y103 HydrophobicContact CG1-CD2 3.58Å; V63-Y103 HydrophobicContact CG1-CE1 4.48Å; V63-Y103 HydrophobicContact CG1-CE2 3.97Å; V63-Y103 HydrophobicContact CG1-CG 3.66Å; Q65-Y103 PolarHBondContact OE1-OH 2.97Å; V82-Y103 HydrophobicContact CB-CE1 4.41Å; V82-Y103 HydrophobicContact CG1-CD1 4.17Å; V82-Y103 HydrophobicContact CG1-CE1 3.72Å; V82-Y103 HydrophobicContact CG2-CE1 3.86Å; V82-Y103 WeakPolarHBondContact CG2-OH 3.42Å; P99-Y103 WeakPolarHBondContact O-CB 3.45Å; P99-Y103 PolarHBondContact O-N 3.06Å; P99-Y103 VanDerWaalsContact O-N 3.17Å; V100-Y103 PolarHBondContact O-N 3.17Å; I101-Y103 PolarHBondContact O-N 3.36Å; Y103-S106 PolarHBondContact O-N 3.05Å; Y103-K107 HydrophobicContact CD1-CG 4.37Å; Y103-K107 HydrophobicContact CE1-CG 3.97Å; Y103-K107 VanDerWaalsContact CZ-CE 3.5Å; Y103-K107 WeakPolarHBondContact O-CG 3.43Å; Y103-K107 PolarHBondContact O-N 3.22Å; Y103-K107 VanDerWaalsContact O-N 3.1Å; Y103-K107 WeakPolarHBondContact OH-CE 3.18Å; Y103-V128 HydrophobicContact CD1-CG2 4.25Å; Y103-V128 HydrophobicContact CE1-CG2 3.84Å
104	I	91.4	Very high	89.3	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-47.6	179.6	-66.7	166.5	0	0	0	110	V100 I101 S106 K107 F108 V128 L153 K156 V157	V100-I104 HydrophobicContact CG1-CD1 4.29Å; V100-I104 WeakPolarHBondContact O-CG1 3.37Å; V100-I104 PolarHBondContact O-N 3.15Å; V100-I104 VanDerWaalsContact O-N 3.16Å; I101-I104 PolarHBondContact O-N 3.29Å; I104-S106 VanDerWaalsContact C-N 3.33Å; I104-S106 PolarHBondContact O-N 3.05Å; I104-K107 PolarHBondContact O-N 3.25Å; I104-K107 VanDerWaalsContact O-N 3.08Å; I104-F108 HydrophobicContact CG2-CD2 4Å; I104-F108 HydrophobicContact CG2-CE2 3.51Å; I104-F108 HydrophobicContact CG2-CZ 3.99Å; I104-F108 PolarHBondContact O-N 3.27Å; I104-V128 HydrophobicContact CG1-CB 4.48Å; I104-V128 HydrophobicContact CG1-CG2 4.21Å; I104-L153 HydrophobicContact CD1-CD2 4.14Å; I104-L153 HydrophobicContact CD1-CG 4.26Å; I104-K156 HydrophobicContact CG2-CB 4.18Å; I104-V157 HydrophobicContact CD1-CB 4.31Å; I104-V157 HydrophobicContact CD1-CG1 4.11Å
105	D	92.6	Very high	89.4	Confident	35 Å²	35	39.2 Å²	39.2	19%	0.187	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-38.6	179	-75.9	-7.7	0	0	0	111.3	I101 K107 F108 E109 K156 Y279	I101-D105 PolarHBondContact O-N 3.41Å; D105-K107 VanDerWaalsContact C-N 3.3Å; D105-K107 PolarHBondContact O-N 3.44Å; D105-F108 PolarHBondContact O-N 3.08Å; D105-E109 WeakPolarHBondContact O-CB 3.39Å; D105-E109 PolarHBondContact O-N 3.01Å; D105-K156 IonicContact OD1-NZ 3.59Å; D105-K156 PolarHBondContact OD1-NZ 3.41Å; D105-K156 IonicContact OD2-NZ 2.73Å; D105-K156 PolarHBondContact OD2-NZ 2.74Å; D105-Y279 HydrophobicContact CB-CE2 3.85Å; D105-Y279 PolarHBondContact O-OH 3.1Å
106	S	92.3	Very high	89.3	Confident	54 Å²	54	38.7 Å²	38.7	38%	0.378	21%	0.208	S	C	.	.	H	α-helix	trans	-59.6	-37.8	172.3	171.8	0	0	0	0	112.4	D102 Y103 I104 E109 D110	D102-S106 WeakPolarHBondContact O-CB 3.48Å; D102-S106 PolarHBondContact O-N 3.18Å; Y103-S106 PolarHBondContact O-N 3.05Å; I104-S106 VanDerWaalsContact C-N 3.33Å; I104-S106 PolarHBondContact O-N 3.05Å; S106-E109 PolarHBondContact O-N 3.48Å; S106-D110 WeakPolarHBondContact O-CB 3.41Å; S106-D110 PolarHBondContact O-N 3.24Å
107	K	90.9	Very high	89.2	Confident	34 Å²	34	46.2 Å²	46.2	15%	0.148	24%	0.235	C	C	.	.	H	α-helix	trans	-71.9	-33.4	175.9	-62.2	-51.4	172.2	-162	0	113.1	Y103 I104 D105 D110 Y111 N126	Y103-K107 HydrophobicContact CD1-CG 4.37Å; Y103-K107 HydrophobicContact CE1-CG 3.97Å; Y103-K107 VanDerWaalsContact CZ-CE 3.5Å; Y103-K107 WeakPolarHBondContact O-CG 3.43Å; Y103-K107 PolarHBondContact O-N 3.22Å; Y103-K107 VanDerWaalsContact O-N 3.1Å; Y103-K107 WeakPolarHBondContact OH-CE 3.18Å; I104-K107 PolarHBondContact O-N 3.25Å; I104-K107 VanDerWaalsContact O-N 3.08Å; D105-K107 VanDerWaalsContact C-N 3.3Å; D105-K107 PolarHBondContact O-N 3.44Å; K107-D110 IonicContact NZ-OD2 3.87Å; K107-Y111 PolarHBondContact O-N 3.01Å; K107-N126 HydrophobicContact CD-CB 4.28Å; K107-N126 WeakPolarHBondContact CG-O 3.39Å
108	F	92.5	Very high	88.7	Confident	1 Å²	1	52.7 Å²	52.7	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-67.9	-39.5	170.4	-66.8	-36.2	0	0	0	112	I104 D105 Y111 L112 R127 K156 T271 H275 Y276 Y279	I104-F108 HydrophobicContact CG2-CD2 4Å; I104-F108 HydrophobicContact CG2-CE2 3.51Å; I104-F108 HydrophobicContact CG2-CZ 3.99Å; I104-F108 PolarHBondContact O-N 3.27Å; D105-F108 PolarHBondContact O-N 3.08Å; F108-Y111 PolarHBondContact O-N 2.69Å; F108-L112 WeakPolarHBondContact O-CB 2.95Å; F108-L112 PolarHBondContact O-N 3.48Å; F108-R127 HydrophobicContact CD1-CB 4.34Å; F108-R127 HydrophobicContact CD1-CG 3.85Å; F108-R127 HydrophobicContact CE1-CB 4.15Å; F108-R127 HydrophobicContact CE1-CG 4.13Å; F108-K156 WeakPolarHBondContact CE2-O 3.41Å; F108-K156 VanDerWaalsContact CZ-O 3.3Å; F108-K156 WeakPolarHBondContact CZ-O 3.2Å; F108-T271 HydrophobicContact CE1-CG2 4.21Å; F108-H275 HydrophobicContact CZ-CB 3.93Å; F108-Y276 HydrophobicContact CB-CD2 4.19Å; F108-Y276 AromaticContact CD1-CD2 3.82Å; F108-Y276 HydrophobicContact CD1-CD2 3.82Å; F108-Y276 HydrophobicContact CD1-CG 4.46Å; F108-Y276 HydrophobicContact CG-CD2 4.26Å; F108-Y279 HydrophobicContact CB-CD1 3.46Å; F108-Y279 VanDerWaalsContact CB-CD1 3.46Å; F108-Y279 HydrophobicContact CB-CD2 4.16Å; F108-Y279 HydrophobicContact CB-CE1 3.64Å; F108-Y279 HydrophobicContact CB-CE2 4.33Å; F108-Y279 HydrophobicContact CB-CG 3.73Å; F108-Y279 HydrophobicContact CD2-CD2 4Å; F108-Y279 AromaticContact CD2-CG 3.91Å; F108-Y279 HydrophobicContact CD2-CG 3.91Å; F108-Y279 HydrophobicContact CG-CD1 4.31Å; F108-Y279 HydrophobicContact CG-CG 4.15Å
109	E	91.1	Very high	88	Confident	55 Å²	55	54.7 Å²	54.7	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-45.4	175.1	-167.4	65.9	-150.6	0	0	111.8	D105 S106 Y111 L112 N113 Y279 K283	D105-E109 WeakPolarHBondContact O-CB 3.39Å; D105-E109 PolarHBondContact O-N 3.01Å; S106-E109 PolarHBondContact O-N 3.48Å; E109-Y111 VanDerWaalsContact C-N 3.26Å; E109-Y111 PolarHBondContact O-N 2.88Å; E109-L112 PolarHBondContact O-N 3.4Å; E109-N113 WeakPolarHBondContact O-CB 3.41Å; E109-N113 VanDerWaalsContact O-CG 3.31Å; E109-N113 PolarHBondContact O-N 3.4Å; E109-N113 PolarHBondContact O-ND2 3.38Å; E109-Y279 PolarHBondContact OE2-OH 3.07Å; E109-K283 VanDerWaalsContact OE2-CE 3.27Å; E109-K283 WeakPolarHBondContact OE2-CE 3.44Å; E109-K283 IonicContact OE2-NZ 2.8Å; E109-K283 PolarHBondContact OE2-NZ 2.96Å
110	D	90.4	Very high	87.3	Confident	79 Å²	79	60 Å²	60	42%	0.422	30%	0.304	S	S	.	.	H	α-helix	trans	-56.5	-42.8	175.5	-73.5	-19.5	0	0	0	111.1	S106 K107 A114	S106-D110 WeakPolarHBondContact O-CB 3.41Å; S106-D110 PolarHBondContact O-N 3.24Å; K107-D110 IonicContact NZ-OD2 3.87Å; D110-A114 WeakPolarHBondContact O-CB 3.45Å; D110-A114 PolarHBondContact O-N 2.93Å
111	Y	90	Very high	86.3	Confident	42 Å²	42	71.1 Å²	71.1	17%	0.165	35%	0.346	C	S	.	.	H	α-helix	trans	-70.1	-43.5	179.4	-166.9	-86	0	0	0	112.1	K107 F108 E109 N113 A114 E115 M123 D125 R127 Y276	K107-Y111 PolarHBondContact O-N 3.01Å; F108-Y111 PolarHBondContact O-N 2.69Å; E109-Y111 VanDerWaalsContact C-N 3.26Å; E109-Y111 PolarHBondContact O-N 2.88Å; Y111-N113 VanDerWaalsContact C-N 3.33Å; Y111-N113 PolarHBondContact O-N 3.31Å; Y111-A114 WeakPolarHBondContact O-CB 3.41Å; Y111-A114 PolarHBondContact O-N 2.68Å; Y111-A114 VanDerWaalsContact O-N 3.14Å; Y111-E115 PolarHBondContact O-N 2.72Å; Y111-M123 HydrophobicContact CD1-CE 4.22Å; Y111-M123 HydrophobicContact CD2-CE 4.42Å; Y111-M123 HydrophobicContact CE1-CE 3.87Å; Y111-M123 HydrophobicContact CE2-CE 4.08Å; Y111-D125 HydrophobicContact CE2-CB 4.23Å; Y111-R127 HydrophobicContact CD2-CG 4.4Å; Y111-R127 HydrophobicContact CG-CG 4.41Å; Y111-Y276 HydrophobicContact CD1-CD1 4.5Å; Y111-Y276 HydrophobicContact CD1-CD2 4.23Å; Y111-Y276 AromaticContact CD1-CE1 3.9Å; Y111-Y276 HydrophobicContact CD1-CE1 3.9Å; Y111-Y276 AromaticContact CD1-CE2 3.6Å; Y111-Y276 HydrophobicContact CD1-CE2 3.6Å; Y111-Y276 AromaticContact CD1-CZ 3.42Å; Y111-Y276 VanDerWaalsContact CD1-CZ 3.42Å; Y111-Y276 AromaticContact CE1-CE1 3.95Å; Y111-Y276 HydrophobicContact CE1-CE1 3.95Å; Y111-Y276 HydrophobicContact CE1-CE2 4.44Å; Y111-Y276 AromaticContact CE1-CZ 3.93Å; Y111-Y276 HydrophobicContact CG-CE2 4.33Å
112	L	90.3	Very high	85.1	Confident	12 Å²	12	79.2 Å²	79.2	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-40.8	176.1	-179.2	61.9	0	0	0	112	F108 E109 A114 E115 S116 Y276 R280 K283	F108-L112 WeakPolarHBondContact O-CB 2.95Å; F108-L112 PolarHBondContact O-N 3.48Å; E109-L112 PolarHBondContact O-N 3.4Å; L112-A114 VanDerWaalsContact C-N 3.32Å; L112-E115 WeakPolarHBondContact O-CB 3.32Å; L112-E115 PolarHBondContact O-N 2.71Å; L112-S116 WeakPolarHBondContact O-CB 3.46Å; L112-S116 PolarHBondContact O-N 3.43Å; L112-S116 PolarHBondContact O-OG 3.34Å; L112-Y276 VanDerWaalsContact CA-OH 3.32Å; L112-Y276 WeakPolarHBondContact CA-OH 3.28Å; L112-Y276 HydrophobicContact CB-CE2 4.26Å; L112-Y276 WeakPolarHBondContact CD1-OH 3.43Å; L112-R280 HydrophobicContact CD1-CG 3.85Å; L112-K283 HydrophobicContact CD2-CB 4.24Å
113	N	87.7	Confident	84.1	Confident	75 Å²	75	77.8 Å²	77.8	40%	0.401	38%	0.375	S	S	.	.	H	α-helix	trans	-64.8	-38.6	174.6	-77.2	-41.3	0	0	0	111.4	E109 Y111 S116 R117	E109-N113 WeakPolarHBondContact O-CB 3.41Å; E109-N113 VanDerWaalsContact O-CG 3.31Å; E109-N113 PolarHBondContact O-N 3.4Å; E109-N113 PolarHBondContact O-ND2 3.38Å; Y111-N113 VanDerWaalsContact C-N 3.33Å; Y111-N113 PolarHBondContact O-N 3.31Å; N113-S116 PolarHBondContact O-N 3.37Å; N113-R117 WeakPolarHBondContact O-CG 3.15Å; N113-R117 PolarHBondContact O-N 2.82Å
114	A	86.5	Confident	83.3	Confident	14 Å²	14	80.4 Å²	80.4	12%	0.116	40%	0.396	C	S	.	.	H	α-helix	trans	-66.8	-39	174	0	0	0	0	0	112.3	D110 Y111 L112 S116 R117 M123	D110-A114 WeakPolarHBondContact O-CB 3.45Å; D110-A114 PolarHBondContact O-N 2.93Å; Y111-A114 WeakPolarHBondContact O-CB 3.41Å; Y111-A114 PolarHBondContact O-N 2.68Å; Y111-A114 VanDerWaalsContact O-N 3.14Å; L112-A114 VanDerWaalsContact C-N 3.32Å; A114-S116 VanDerWaalsContact C-N 3.27Å; A114-S116 PolarHBondContact O-N 3.32Å; A114-R117 WeakPolarHBondContact O-CB 3.33Å; A114-R117 PolarHBondContact O-N 2.92Å; A114-M123 HydrophobicContact CB-CE 3.97Å; A114-M123 HydrophobicContact CB-CG 4.41Å
115	E	84.6	Confident	82.7	Confident	45 Å²	45	82.5 Å²	82.5	21%	0.21	41%	0.407	C	S	.	.	H	α-helix	trans	-62.3	-36.4	174.8	-166.3	-167.5	143	0	0	111.3	Y111 L112 R117 R120 M123 Y276 R280	Y111-E115 PolarHBondContact O-N 2.72Å; L112-E115 WeakPolarHBondContact O-CB 3.32Å; L112-E115 PolarHBondContact O-N 2.71Å; E115-R117 VanDerWaalsContact C-N 3.3Å; E115-R117 PolarHBondContact O-N 3.18Å; E115-R120 PolarHBondContact O-NE 3.37Å; E115-R120 PolarHBondContact O-NH2 2.82Å; E115-R120 VanDerWaalsContact O-NH2 3.09Å; E115-M123 HydrophobicContact CB-CE 3.84Å; E115-Y276 PolarHBondContact OE2-OH 3.08Å; E115-R280 IonicContact OE1-CZ 3.41Å; E115-R280 IonicContact OE1-NE 2.65Å; E115-R280 PolarHBondContact OE1-NE 3.45Å; E115-R280 VanDerWaalsContact OE1-NE 3.14Å; E115-R280 IonicContact OE1-NH2 2.82Å; E115-R280 PolarHBondContact OE1-NH2 3.38Å; E115-R280 IonicContact OE2-NE 3.6Å; E115-R280 PolarHBondContact OE2-NE 3.08Å
116	S	81.6	Confident	82.3	Confident	81 Å²	81	83.1 Å²	83.1	57%	0.566	41%	0.411	S	S	*	.	H	α-helix	trans	-76.2	-13.4	-178.6	-58.5	0	0	0	0	113.8	L112 N113 A114	L112-S116 WeakPolarHBondContact O-CB 3.46Å; L112-S116 PolarHBondContact O-N 3.43Å; L112-S116 PolarHBondContact O-OG 3.34Å; N113-S116 PolarHBondContact O-N 3.37Å; A114-S116 VanDerWaalsContact C-N 3.27Å; A114-S116 PolarHBondContact O-N 3.32Å
117	R	82.2	Confident	82.2	Confident	166 Å²	166	80.9 Å²	80.9	63%	0.626	39%	0.394	S	S	*	.	S	Bend	trans	-67.2	146.3	178.4	-71.7	171.5	-170.8	-165.1	0.9	111.1	N113 A114 E115 N119 R120	N113-R117 WeakPolarHBondContact O-CG 3.15Å; N113-R117 PolarHBondContact O-N 2.82Å; A114-R117 WeakPolarHBondContact O-CB 3.33Å; A114-R117 PolarHBondContact O-N 2.92Å; E115-R117 VanDerWaalsContact C-N 3.3Å; E115-R117 PolarHBondContact O-N 3.18Å; R117-N119 VanDerWaalsContact C-N 3.34Å; R117-R120 WeakPolarHBondContact O-CG 3.19Å; R117-R120 PolarHBondContact O-NE 2.94Å
118	V	77.5	Confident	82.2	Confident	155 Å²	155	79.3 Å²	79.3	94%	0.939	39%	0.388	S	S	*	.	S	Bend	trans	-66.2	-36.8	176.3	-179.3	0	0	0	0	111.4
119	N	73.6	Confident	82	Confident	118 Å²	118	79.5 Å²	79.5	63%	0.631	39%	0.388	S	S	*	.			trans	-103.1	110.4	175.3	-172.7	4.3	0	0	0	110.5	R117 R121	R117-N119 VanDerWaalsContact C-N 3.34Å; N119-R121 WeakPolarHBondContact OD1-CG 3.44Å
120	R	74.9	Confident	81.9	Confident	155 Å²	155	76.9 Å²	76.9	59%	0.585	38%	0.376	S	S	*	.			trans	-108.6	14.6	-170.8	-57.6	178.6	-177.4	176.6	-6.5	114.5	E115 R117 Q122	E115-R120 PolarHBondContact O-NE 3.37Å; E115-R120 PolarHBondContact O-NH2 2.82Å; E115-R120 VanDerWaalsContact O-NH2 3.09Å; R117-R120 WeakPolarHBondContact O-CG 3.19Å; R117-R120 PolarHBondContact O-NE 2.94Å; R120-Q122 VanDerWaalsContact C-N 3.32Å; R120-Q122 PolarHBondContact O-N 3.47Å
121	R	68.6	Low	81.9	Confident	232 Å²	232	73.1 Å²	73.1	88%	0.875	36%	0.356	S	S	*	.	S	Bend	trans	-61.6	-29	-168.4	-76.2	-176.8	177.4	-175.1	-0.3	115.7	N119	N119-R121 WeakPolarHBondContact OD1-CG 3.44Å
122	Q	65.9	Low	82	Confident	186 Å²	186	71.3 Å²	71.3	87%	0.869	35%	0.349	S	S	*	.			trans	-137.7	113.5	173	-82.7	-176.5	-11.6	0	0	109.5	R120 P124	R120-Q122 VanDerWaalsContact C-N 3.32Å; R120-Q122 PolarHBondContact O-N 3.47Å; Q122-P124 WeakPolarHBondContact O-CD 3.4Å
123	M	71.6	Confident	82.1	Confident	57 Å²	57	70.7 Å²	70.7	28%	0.281	35%	0.346	S	S	.	.			trans	-108.5	100.9	175.1	-69.2	-175.4	60.7	0	0	108.9	Y111 A114 E115 D125	Y111-M123 HydrophobicContact CD1-CE 4.22Å; Y111-M123 HydrophobicContact CD2-CE 4.42Å; Y111-M123 HydrophobicContact CE1-CE 3.87Å; Y111-M123 HydrophobicContact CE2-CE 4.08Å; A114-M123 HydrophobicContact CB-CE 3.97Å; A114-M123 HydrophobicContact CB-CG 4.41Å; E115-M123 HydrophobicContact CB-CE 3.84Å; M123-D125 PolarHBondContact O-N 3.22Å; M123-D125 VanDerWaalsContact O-N 3.15Å
124	P	72.4	Confident	82.4	Confident	91 Å²	91	67.3 Å²	67.3	59%	0.591	33%	0.328	S	S	*	.			trans	-69	112.7	178.8	27.3	-32.5	0	0	0	110	Q122 N126	Q122-P124 WeakPolarHBondContact O-CD 3.4Å; P124-N126 PolarHBondContact O-N 2.89Å
125	D	80.6	Confident	82.7	Confident	45 Å²	45	66.6 Å²	66.6	24%	0.241	32%	0.322	C	S	.	.			trans	-82.8	103	175.8	-165.3	-8.5	0	0	0	110.6	Y111 M123 R127	Y111-D125 HydrophobicContact CE2-CB 4.23Å; M123-D125 PolarHBondContact O-N 3.22Å; M123-D125 VanDerWaalsContact O-N 3.15Å; D125-R127 VanDerWaalsContact OD1-CB 3.27Å; D125-R127 WeakPolarHBondContact OD1-CB 3.13Å; D125-R127 VanDerWaalsContact OD1-CG 3.31Å; D125-R127 WeakPolarHBondContact OD1-CG 3.04Å; D125-R127 IonicContact OD1-CZ 3.4Å; D125-R127 PolarHBondContact OD1-N 2.72Å; D125-R127 IonicContact OD1-NE 3.96Å; D125-R127 PolarHBondContact OD1-NE 3.05Å; D125-R127 IonicContact OD1-NH2 2.89Å; D125-R127 IonicContact OD2-CZ 3.26Å; D125-R127 IonicContact OD2-NE 4Å; D125-R127 PolarHBondContact OD2-NE 3.3Å; D125-R127 IonicContact OD2-NH2 3.14Å; D125-R127 PolarHBondContact OD2-NH2 2.97Å
126	N	83.7	Confident	83	Confident	49 Å²	49	65.1 Å²	65.1	26%	0.262	32%	0.318	S	S	.	.			trans	-110	17	174	-60.2	-70.4	0	0	0	111.8	K67 K107 P124	K67-N126 PolarHBondContact NZ-OD1 3.23Å; K107-N126 HydrophobicContact CD-CB 4.28Å; K107-N126 WeakPolarHBondContact CG-O 3.39Å; P124-N126 PolarHBondContact O-N 2.89Å
127	R	90.1	Very high	83.5	Confident	7 Å²	7	62.8 Å²	62.8	3%	0.026	30%	0.301	C	S	.	.			trans	-68.6	145.9	179.2	-62.5	174.6	-66	179.2	3.6	109.9	S22 F108 Y111 D125 Q129 T271 N272 Y276	S22-R127 VanDerWaalsContact CB-O 3.24Å; S22-R127 WeakPolarHBondContact CB-O 3.09Å; F108-R127 HydrophobicContact CD1-CB 4.34Å; F108-R127 HydrophobicContact CD1-CG 3.85Å; F108-R127 HydrophobicContact CE1-CB 4.15Å; F108-R127 HydrophobicContact CE1-CG 4.13Å; Y111-R127 HydrophobicContact CD2-CG 4.4Å; Y111-R127 HydrophobicContact CG-CG 4.41Å; D125-R127 VanDerWaalsContact OD1-CB 3.27Å; D125-R127 WeakPolarHBondContact OD1-CB 3.13Å; D125-R127 VanDerWaalsContact OD1-CG 3.31Å; D125-R127 WeakPolarHBondContact OD1-CG 3.04Å; D125-R127 IonicContact OD1-CZ 3.4Å; D125-R127 PolarHBondContact OD1-N 2.72Å; D125-R127 IonicContact OD1-NE 3.96Å; D125-R127 PolarHBondContact OD1-NE 3.05Å; D125-R127 IonicContact OD1-NH2 2.89Å; D125-R127 IonicContact OD2-CZ 3.26Å; D125-R127 IonicContact OD2-NE 4Å; D125-R127 PolarHBondContact OD2-NE 3.3Å; D125-R127 IonicContact OD2-NH2 3.14Å; D125-R127 PolarHBondContact OD2-NH2 2.97Å; R127-Q129 PolarHBondContact O-N 3.46Å; R127-T271 HydrophobicContact CB-CG2 4.34Å; R127-N272 PolarHBondContact NH1-OD1 3.29Å; R127-N272 PolarHBondContact NH2-OD1 2.68Å; R127-Y276 VanDerWaalsContact NH1-CG 3.28Å
128	V	89.8	Confident	83.8	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.006	29%	0.289	C	S	.	.			trans	-75.9	118.6	177.5	-179.4	0	0	0	0	108.9	R24 Y103 I104 C130 V157 T271	R24-V128 HydrophobicContact CB-CG1 3.36Å; R24-V128 HydrophobicContact CG-CG1 4.46Å; Y103-V128 HydrophobicContact CD1-CG2 4.25Å; Y103-V128 HydrophobicContact CE1-CG2 3.84Å; I104-V128 HydrophobicContact CG1-CB 4.48Å; I104-V128 HydrophobicContact CG1-CG2 4.21Å; V128-C130 WeakPolarHBondContact CG1-O 3.35Å; V128-V157 HydrophobicContact CB-CG2 4.42Å; V128-V157 HydrophobicContact CG1-CG2 3.75Å; V128-T271 WeakPolarHBondContact O-CG2 3.33Å
129	Q	88.3	Confident	84.1	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.019	26%	0.259	C	S	.	.			trans	-92	-32.6	-172.7	-64.4	151.7	-1.5	0	0	112.6	Q21 S22 R127 N158 K268 T271	Q21-Q129 VanDerWaalsContact CG-OE1 3.26Å; S22-Q129 WeakPolarHBondContact O-CB 3.39Å; S22-Q129 PolarHBondContact O-N 3.37Å; R127-Q129 PolarHBondContact O-N 3.46Å; Q129-N158 WeakPolarHBondContact O-CB 3.44Å; Q129-N158 PolarHBondContact O-ND2 2.95Å; Q129-K268 HydrophobicContact CG-CG 3.91Å; Q129-T271 WeakPolarHBondContact CA-OG1 3.15Å; Q129-T271 PolarHBondContact O-OG1 2.99Å
130	C	89.5	Confident	84.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.4	175.3	69.4	0	0	0	0	111.3	R24 V128 N158 I160 L267	R24-C130 PolarHBondContact N-O 2.98Å; V128-C130 WeakPolarHBondContact CG1-O 3.35Å; C130-N158 CarbonylContact C-O 3.54Å; C130-N158 WeakPolarHBondContact CA-O 3.36Å; C130-I160 HydrophobicContact CB-CD1 4.41Å; C130-L267 HydrophobicContact CB-CD1 4.09Å; C130-L267 HydrophobicContact CB-CD2 4.08Å
131	C	91.7	Very high	85.5	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	108.6	173.7	-177.7	0	0	0	0	109.1	R24 Y133 V157 N158 I160	R24-C131 CarbonylContact O-C 3.55Å; R24-C131 WeakPolarHBondContact O-CA 3.43Å; C131-Y133 PolarHBondContact O-N 2.93Å; C131-V157 HydrophobicContact CB-CB 4.47Å; C131-V157 HydrophobicContact CB-CG1 3.75Å; C131-V157 HydrophobicContact CB-CG2 3.82Å; C131-N158 PolarHBondContact N-O 3.49Å; C131-I160 PolarHBondContact O-N 2.84Å
132	L	91.8	Very high	86.6	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	112.7	171	-56.3	-175.4	0	0	0	108.2	R24 T26 F134 I160 L162 L255 L259	R24-L132 PolarHBondContact O-N 3.01Å; T26-L132 PolarHBondContact N-O 3.39Å; L132-F134 HydrophobicContact CB-CE2 4.09Å; L132-I160 HydrophobicContact CD2-CB 4.04Å; L132-I160 HydrophobicContact CD2-CD1 4.05Å; L132-I160 HydrophobicContact CD2-CG2 4.38Å; L132-L162 HydrophobicContact CB-CD1 4.02Å; L132-L162 HydrophobicContact CD1-CD1 4.44Å; L132-L162 HydrophobicContact CD2-CD1 4.34Å; L132-L162 HydrophobicContact CG-CD1 4.5Å; L132-L255 HydrophobicContact CD2-CD1 4.41Å; L132-L259 HydrophobicContact CD1-CD1 3.97Å; L132-L259 HydrophobicContact CD2-CD1 3.94Å; L132-L259 HydrophobicContact CD2-CD2 4.04Å
133	Y	92.6	Very high	87.9	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.4	-177.9	-170.8	-101.3	0	0	0	110.9	T26 F87 C131 I135 D146 F149 M150 I160 L162	T26-Y133 WeakPolarHBondContact O-CA 3.44Å; F87-Y133 HydrophobicContact CE1-CE2 4.4Å; C131-Y133 PolarHBondContact O-N 2.93Å; Y133-I135 HydrophobicContact CD1-CG1 3.86Å; Y133-I135 HydrophobicContact CE1-CG1 3.94Å; Y133-D146 HydrophobicContact CE1-CB 3.85Å; Y133-D146 WeakPolarHBondContact OH-CA 3.46Å; Y133-D146 VanDerWaalsContact OH-CB 3.32Å; Y133-D146 WeakPolarHBondContact OH-CB 3.4Å; Y133-D146 VanDerWaalsContact OH-CG 3.27Å; Y133-D146 PolarHBondContact OH-OD1 3.37Å; Y133-F149 AromaticContact CD2-CD1 3.58Å; Y133-F149 HydrophobicContact CD2-CD1 3.58Å; Y133-F149 AromaticContact CD2-CE1 3.54Å; Y133-F149 HydrophobicContact CD2-CE1 3.54Å; Y133-F149 HydrophobicContact CE2-CB 4.48Å; Y133-F149 AromaticContact CE2-CD1 3.21Å; Y133-F149 HydrophobicContact CE2-CD1 3.21Å; Y133-F149 AromaticContact CE2-CE1 3.56Å; Y133-F149 HydrophobicContact CE2-CE1 3.56Å; Y133-F149 AromaticContact CE2-CG 3.96Å; Y133-F149 HydrophobicContact CE2-CG 3.96Å; Y133-M150 HydrophobicContact CD1-CG 4.07Å; Y133-M150 HydrophobicContact CD1-SD 3.85Å; Y133-M150 HydrophobicContact CE1-CE 4.3Å; Y133-M150 HydrophobicContact CE1-CG 4.21Å; Y133-M150 HydrophobicContact CE1-SD 4.17Å; Y133-M150 HydrophobicContact CG-CG 4.33Å; Y133-M150 HydrophobicContact CG-SD 4.5Å; Y133-I160 PolarHBondContact N-O 3.31Å; Y133-L162 PolarHBondContact O-N 2.68Å
134	F	92.6	Very high	88.8	Confident	3 Å²	3	33.5 Å²	33.5	1%	0.013	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	117.2	-177.5	-71.3	-115.7	0	0	0	110.4	I25 T26 L31 K33 L36 L132 L162 A164	I25-F134 HydrophobicContact CG2-CD2 4.23Å; I25-F134 HydrophobicContact CG2-CE2 3.67Å; I25-F134 HydrophobicContact CG2-CZ 4.46Å; T26-F134 PolarHBondContact O-N 3.37Å; L31-F134 HydrophobicContact CB-CB 4.28Å; L31-F134 HydrophobicContact CB-CD1 4.39Å; L31-F134 HydrophobicContact CD1-CB 3.74Å; L31-F134 WeakPolarHBondContact CD1-O 3.4Å; K33-F134 HydrophobicContact CB-CZ 4.31Å; K33-F134 HydrophobicContact CD-CD2 4.49Å; K33-F134 HydrophobicContact CG-CD1 4.12Å; K33-F134 HydrophobicContact CG-CD2 4.05Å; K33-F134 HydrophobicContact CG-CE1 4.16Å; K33-F134 HydrophobicContact CG-CE2 4.13Å; K33-F134 HydrophobicContact CG-CG 4.05Å; K33-F134 HydrophobicContact CG-CZ 4.15Å; L36-F134 HydrophobicContact CB-CE1 4.21Å; L36-F134 HydrophobicContact CB-CZ 4.15Å; L36-F134 HydrophobicContact CD2-CE1 3.66Å; L36-F134 HydrophobicContact CD2-CE2 4.43Å; L36-F134 HydrophobicContact CD2-CZ 3.37Å; L36-F134 HydrophobicContact CG-CZ 4.38Å; L132-F134 HydrophobicContact CB-CE2 4.09Å; F134-L162 WeakPolarHBondContact CA-O 3.35Å; F134-L162 HydrophobicContact CE2-CD1 4.2Å; F134-L162 HydrophobicContact CZ-CD1 4.3Å; F134-A164 HydrophobicContact CB-CB 4.41Å; F134-A164 HydrophobicContact CD1-CB 3.95Å
135	I	92.9	Very high	89.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.4	175	-58.2	164.5	0	0	0	108.1	Y133 L142 P161 L162 A164 F177 I181	Y133-I135 HydrophobicContact CD1-CG1 3.86Å; Y133-I135 HydrophobicContact CE1-CG1 3.94Å; I135-L142 HydrophobicContact CD1-CD2 3.66Å; I135-L142 HydrophobicContact CG1-CD2 4.02Å; I135-L142 HydrophobicContact CG2-CD2 4.07Å; I135-P161 HydrophobicContact CD1-CB 3.85Å; I135-L162 PolarHBondContact N-O 2.76Å; I135-A164 WeakPolarHBondContact O-CB 3.4Å; I135-A164 PolarHBondContact O-N 3.17Å; I135-F177 HydrophobicContact CG2-CZ 4.08Å; I135-I181 HydrophobicContact CD1-CD1 4.17Å; I135-I181 HydrophobicContact CD1-CG2 4.08Å; I135-I181 HydrophobicContact CG2-CD1 4.22Å
136	A	91.6	Very high	90.2	Very high	14 Å²	14	28.6 Å²	28.6	12%	0.116	17%	0.166	C	C	.	.	P	Polyproline II helix	trans	-65.9	137.6	175.7	0	0	0	0	0	110.7	L31 S138 F177	L31-A136 HydrophobicContact CD2-CB 3.95Å; A136-S138 PolarHBondContact O-N 3.42Å; A136-F177 WeakPolarHBondContact O-CZ 3.4Å
137	P	91.5	Very high	90.6	Very high	32 Å²	32	27.3 Å²	27.3	21%	0.208	16%	0.159	C	C	.	.			trans	-77	71	179.9	33.6	-36.7	0	0	0	110.8	I163 A164 K165 T168 L169	P137-I163 HydrophobicContact CB-CG2 4.27Å; P137-A164 WeakPolarHBondContact CB-O 3.49Å; P137-A164 WeakPolarHBondContact CD-O 3.43Å; P137-A164 VanDerWaalsContact CG-O 3.26Å; P137-A164 WeakPolarHBondContact CG-O 3.47Å; P137-K165 HydrophobicContact CG-CB 4.33Å; P137-T168 WeakPolarHBondContact CB-OG1 3.38Å; P137-T168 VanDerWaalsContact CG-OG1 3.26Å; P137-T168 WeakPolarHBondContact CG-OG1 3.47Å; P137-L169 HydrophobicContact CB-CD1 3.88Å; P137-L169 HydrophobicContact CB-CD2 4.44Å; P137-L169 HydrophobicContact CB-CG 4.05Å
138	S	88.2	Confident	90.7	Very high	55 Å²	55	29.9 Å²	29.9	39%	0.385	17%	0.172	S	C	.	.			trans	-78.9	-24.7	178.6	65.4	0	0	0	0	112.9	A136 H140 G141	A136-S138 PolarHBondContact O-N 3.42Å; S138-H140 PolarHBondContact O-N 3.09Å; S138-H140 PolarHBondContact OG-N 3.32Å; S138-G141 PolarHBondContact OG-O 2.93Å
139	G	83.5	Confident	90.8	Very high	31 Å²	31	29.9 Å²	29.9	32%	0.32	17%	0.172	S	C	.	.	S	Bend	trans	75.3	2.4	-174.8	0	0	0	0	0	114.5
140	H	86.9	Confident	91	Very high	162 Å²	162	29.7 Å²	29.7	75%	0.75	17%	0.171	S	C	*	.	S	Bend	trans	-107.2	-61.1	-178.8	-65.2	-5.3	0	0	0	112.3	S138 Q180	S138-H140 PolarHBondContact O-N 3.09Å; S138-H140 PolarHBondContact OG-N 3.32Å; H140-Q180 WeakPolarHBondContact O-CG 3.32Å
141	G	91	Very high	91.3	Very high	9 Å²	9	33.2 Å²	33.2	9%	0.093	19%	0.186	C	C	.	.			trans	-177.9	-164.7	-179.1	0	0	0	0	0	111.6	S138	S138-G141 PolarHBondContact OG-O 2.93Å
142	L	93.4	Very high	91.3	Very high	14 Å²	14	37.8 Å²	37.8	7%	0.073	20%	0.203	C	C	.	.			trans	-74.2	140.6	173	-64.3	171.7	0	0	0	110.5	I135 D146 I147 M150 I181 E184 I185	I135-L142 HydrophobicContact CD1-CD2 3.66Å; I135-L142 HydrophobicContact CG1-CD2 4.02Å; I135-L142 HydrophobicContact CG2-CD2 4.07Å; L142-D146 HydrophobicContact CB-CB 4.34Å; L142-D146 HydrophobicContact CD2-CB 4.28Å; L142-I147 HydrophobicContact CB-CD1 4.18Å; L142-I147 HydrophobicContact CB-CG1 3.79Å; L142-I147 HydrophobicContact CD1-CG1 4.1Å; L142-M150 HydrophobicContact CD1-CE 3.58Å; L142-M150 HydrophobicContact CD2-CE 3.77Å; L142-M150 HydrophobicContact CG-CE 4.27Å; L142-I181 HydrophobicContact CD1-CG2 4.37Å; L142-I181 HydrophobicContact CD2-CG1 4.18Å; L142-I181 HydrophobicContact CD2-CG2 3.93Å; L142-I181 HydrophobicContact CG-CG1 4.32Å; L142-I181 HydrophobicContact CG-CG2 4.17Å; L142-E184 WeakPolarHBondContact CA-OE2 3.38Å; L142-E184 WeakPolarHBondContact CB-OE2 3.33Å; L142-E184 HydrophobicContact CD1-CB 4.03Å; L142-E184 WeakPolarHBondContact CG-OE2 3.17Å; L142-E184 PolarHBondContact N-OE2 3.38Å; L142-I185 HydrophobicContact CD1-CG1 3.99Å
143	K	92	Very high	91.3	Very high	72 Å²	72	37.6 Å²	37.6	31%	0.313	20%	0.202	S	C	.	.			trans	-70.3	153	170.3	-64.6	174.5	172.2	179.4	0	109.4	E28 L145 D146 I147	E28-K143 WeakPolarHBondContact OE1-CD 3.35Å; E28-K143 IonicContact OE1-NZ 3.94Å; E28-K143 PolarHBondContact OE1-NZ 3.33Å; E28-K143 IonicContact OE2-NZ 3.55Å; E28-K143 PolarHBondContact OE2-NZ 3.45Å; K143-L145 PolarHBondContact O-N 2.79Å; K143-L145 VanDerWaalsContact O-N 3.15Å; K143-D146 WeakPolarHBondContact CB-OD2 3.35Å; K143-D146 PolarHBondContact N-OD2 3.14Å; K143-D146 WeakPolarHBondContact O-CA 3.44Å; K143-D146 WeakPolarHBondContact O-CB 3.48Å; K143-D146 PolarHBondContact O-N 2.93Å; K143-I147 PolarHBondContact O-N 2.81Å; K143-I147 VanDerWaalsContact O-N 3.11Å
144	P	91.3	Very high	91.3	Very high	110 Å²	110	39 Å²	39	71%	0.714	21%	0.209	S	C	*	.	H	α-helix	trans	-54.2	-35.2	172.8	-27.1	35.1	0	0	0	113.1	D146 I147 E148	P144-D146 VanDerWaalsContact C-N 3.34Å; P144-I147 PolarHBondContact O-N 2.91Å; P144-E148 PolarHBondContact O-N 3.19Å
145	L	90	Very high	91.3	Very high	30 Å²	30	43.2 Å²	43.2	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-42.4	174.2	-175.4	63.2	0	0	0	112	F87 N93 W97 K143 E148 F149	F87-L145 HydrophobicContact CE1-CD2 4.44Å; F87-L145 HydrophobicContact CZ-CG 4.45Å; N93-L145 HydrophobicContact CB-CD1 4.05Å; N93-L145 HydrophobicContact CB-CD2 4.38Å; W97-L145 HydrophobicContact CZ3-CD1 4.22Å; K143-L145 PolarHBondContact O-N 2.79Å; K143-L145 VanDerWaalsContact O-N 3.15Å; L145-E148 PolarHBondContact O-N 2.79Å; L145-F149 VanDerWaalsContact O-CB 3.24Å; L145-F149 WeakPolarHBondContact O-CB 3.47Å; L145-F149 PolarHBondContact O-N 2.72Å
146	D	92.1	Very high	91.2	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-66.8	-42.9	-178.8	-51.9	-19.9	0	0	0	111.2	Y133 L142 K143 P144 F149 M150	Y133-D146 HydrophobicContact CE1-CB 3.85Å; Y133-D146 WeakPolarHBondContact OH-CA 3.46Å; Y133-D146 VanDerWaalsContact OH-CB 3.32Å; Y133-D146 WeakPolarHBondContact OH-CB 3.4Å; Y133-D146 VanDerWaalsContact OH-CG 3.27Å; Y133-D146 PolarHBondContact OH-OD1 3.37Å; L142-D146 HydrophobicContact CB-CB 4.34Å; L142-D146 HydrophobicContact CD2-CB 4.28Å; K143-D146 WeakPolarHBondContact CB-OD2 3.35Å; K143-D146 PolarHBondContact N-OD2 3.14Å; K143-D146 WeakPolarHBondContact O-CA 3.44Å; K143-D146 WeakPolarHBondContact O-CB 3.48Å; K143-D146 PolarHBondContact O-N 2.93Å; P144-D146 VanDerWaalsContact C-N 3.34Å; D146-F149 PolarHBondContact O-N 3.17Å; D146-M150 HydrophobicContact CB-CE 4.14Å; D146-M150 WeakPolarHBondContact O-CB 3.4Å; D146-M150 WeakPolarHBondContact O-CE 3.37Å; D146-M150 WeakPolarHBondContact O-CG 3.29Å; D146-M150 PolarHBondContact O-N 3.06Å
147	I	92.9	Very high	91.3	Very high	22 Å²	22	44.1 Å²	44.1	11%	0.113	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-51.1	177.1	-64.9	167.4	0	0	0	110.2	L142 K143 P144 F149 M150 K151 H188 I190	L142-I147 HydrophobicContact CB-CD1 4.18Å; L142-I147 HydrophobicContact CB-CG1 3.79Å; L142-I147 HydrophobicContact CD1-CG1 4.1Å; K143-I147 PolarHBondContact O-N 2.81Å; K143-I147 VanDerWaalsContact O-N 3.11Å; P144-I147 PolarHBondContact O-N 2.91Å; I147-F149 VanDerWaalsContact C-N 3.34Å; I147-F149 PolarHBondContact O-N 3.28Å; I147-M150 PolarHBondContact O-N 3.06Å; I147-K151 HydrophobicContact CG2-CD 4.04Å; I147-K151 HydrophobicContact CG2-CG 4.45Å; I147-K151 WeakPolarHBondContact O-CB 3.46Å; I147-K151 VanDerWaalsContact O-CG 3.25Å; I147-K151 WeakPolarHBondContact O-CG 3.46Å; I147-K151 PolarHBondContact O-N 2.84Å; I147-H188 HydrophobicContact CG2-CB 4.18Å; I147-I190 HydrophobicContact CG2-CD1 4.37Å
148	E	91.8	Very high	91.3	Very high	62 Å²	62	42.9 Å²	42.9	29%	0.29	22%	0.221	S	C	.	.	H	α-helix	trans	-64.7	-40	-178.5	-171.5	61.2	-161.5	0	0	111.6	W97 P144 L145 R152	W97-E148 HydrophobicContact CE3-CG 4.22Å; W97-E148 HydrophobicContact CH2-CB 4.49Å; W97-E148 HydrophobicContact CH2-CG 3.52Å; W97-E148 HydrophobicContact CZ2-CG 4.05Å; W97-E148 HydrophobicContact CZ3-CB 4.18Å; W97-E148 HydrophobicContact CZ3-CG 3.62Å; P144-E148 PolarHBondContact O-N 3.19Å; L145-E148 PolarHBondContact O-N 2.79Å; E148-R152 WeakPolarHBondContact O-CG 3.1Å; E148-R152 PolarHBondContact O-N 2.91Å; E148-R152 IonicContact OE1-CZ 2.68Å; E148-R152 IonicContact OE1-NE 2.79Å; E148-R152 PolarHBondContact OE1-NE 3.13Å; E148-R152 IonicContact OE1-NH2 3.72Å; E148-R152 PolarHBondContact OE1-NH2 3.21Å
149	F	91.5	Very high	91.6	Very high	1 Å²	1	40.3 Å²	40.3	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-52.1	176.6	-176.2	-92.5	0	0	0	112	T26 F87 W97 V100 Y133 L145 D146 I147 K151 R152 L153	T26-F149 HydrophobicContact CG2-CE1 3.73Å; T26-F149 HydrophobicContact CG2-CE2 3.75Å; T26-F149 HydrophobicContact CG2-CZ 3.19Å; F87-F149 HydrophobicContact CD2-CD2 4.42Å; F87-F149 HydrophobicContact CD2-CE2 4.24Å; F87-F149 AromaticContact CE2-CD2 3.26Å; F87-F149 HydrophobicContact CE2-CD2 3.26Å; F87-F149 AromaticContact CE2-CE2 3.44Å; F87-F149 HydrophobicContact CE2-CE2 3.44Å; F87-F149 VanDerWaalsContact CE2-CE2 3.44Å; F87-F149 HydrophobicContact CE2-CG 4.11Å; F87-F149 HydrophobicContact CE2-CZ 4.4Å; F87-F149 HydrophobicContact CZ-CB 4.18Å; F87-F149 AromaticContact CZ-CD2 3.41Å; F87-F149 HydrophobicContact CZ-CD2 3.41Å; F87-F149 VanDerWaalsContact CZ-CD2 3.41Å; F87-F149 AromaticContact CZ-CE2 3.9Å; F87-F149 HydrophobicContact CZ-CE2 3.9Å; F87-F149 AromaticContact CZ-CG 3.78Å; F87-F149 HydrophobicContact CZ-CG 3.78Å; W97-F149 HydrophobicContact CB-CD2 3.71Å; W97-F149 HydrophobicContact CB-CE2 4Å; V100-F149 HydrophobicContact CB-CE2 4.36Å; V100-F149 HydrophobicContact CG1-CE2 4.19Å; V100-F149 HydrophobicContact CG1-CZ 3.97Å; V100-F149 HydrophobicContact CG2-CE2 4.16Å; Y133-F149 AromaticContact CD2-CD1 3.58Å; Y133-F149 HydrophobicContact CD2-CD1 3.58Å; Y133-F149 AromaticContact CD2-CE1 3.54Å; Y133-F149 HydrophobicContact CD2-CE1 3.54Å; Y133-F149 HydrophobicContact CE2-CB 4.48Å; Y133-F149 AromaticContact CE2-CD1 3.21Å; Y133-F149 HydrophobicContact CE2-CD1 3.21Å; Y133-F149 AromaticContact CE2-CE1 3.56Å; Y133-F149 HydrophobicContact CE2-CE1 3.56Å; Y133-F149 AromaticContact CE2-CG 3.96Å; Y133-F149 HydrophobicContact CE2-CG 3.96Å; L145-F149 VanDerWaalsContact O-CB 3.24Å; L145-F149 WeakPolarHBondContact O-CB 3.47Å; L145-F149 PolarHBondContact O-N 2.72Å; D146-F149 PolarHBondContact O-N 3.17Å; I147-F149 VanDerWaalsContact C-N 3.34Å; I147-F149 PolarHBondContact O-N 3.28Å; F149-K151 PolarHBondContact O-N 3.39Å; F149-R152 PolarHBondContact O-N 3.17Å; F149-L153 HydrophobicContact CE1-CD2 3.64Å; F149-L153 HydrophobicContact CE1-CG 4.5Å; F149-L153 HydrophobicContact CE2-CD1 4.22Å; F149-L153 HydrophobicContact CE2-CD2 4.4Å; F149-L153 HydrophobicContact CZ-CD1 4.1Å; F149-L153 HydrophobicContact CZ-CD2 3.5Å; F149-L153 VanDerWaalsContact CZ-CD2 3.5Å; F149-L153 HydrophobicContact CZ-CG 4.37Å; F149-L153 PolarHBondContact O-N 3.38Å; F149-L153 VanDerWaalsContact O-N 3.16Å
150	M	93.3	Very high	92	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-38.1	-178	-71.4	-172.9	-74.5	0	0	112.1	Y133 L142 D146 I147 R152 L153 H154 I159 I190	Y133-M150 HydrophobicContact CD1-CG 4.07Å; Y133-M150 HydrophobicContact CD1-SD 3.85Å; Y133-M150 HydrophobicContact CE1-CE 4.3Å; Y133-M150 HydrophobicContact CE1-CG 4.21Å; Y133-M150 HydrophobicContact CE1-SD 4.17Å; Y133-M150 HydrophobicContact CG-CG 4.33Å; Y133-M150 HydrophobicContact CG-SD 4.5Å; L142-M150 HydrophobicContact CD1-CE 3.58Å; L142-M150 HydrophobicContact CD2-CE 3.77Å; L142-M150 HydrophobicContact CG-CE 4.27Å; D146-M150 HydrophobicContact CB-CE 4.14Å; D146-M150 WeakPolarHBondContact O-CB 3.4Å; D146-M150 WeakPolarHBondContact O-CE 3.37Å; D146-M150 WeakPolarHBondContact O-CG 3.29Å; D146-M150 PolarHBondContact O-N 3.06Å; I147-M150 PolarHBondContact O-N 3.06Å; M150-R152 VanDerWaalsContact C-N 3.26Å; M150-R152 PolarHBondContact O-N 3.46Å; M150-L153 PolarHBondContact O-N 3.09Å; M150-H154 VanDerWaalsContact O-CB 3.27Å; M150-H154 WeakPolarHBondContact O-CB 3.48Å; M150-H154 PolarHBondContact O-N 3.24Å; M150-I159 HydrophobicContact CB-CD1 4.22Å; M150-I159 HydrophobicContact CG-CD1 4.35Å; M150-I159 HydrophobicContact CG-CG2 4.45Å; M150-I159 HydrophobicContact SD-CG2 4.49Å; M150-I190 HydrophobicContact CB-CD1 4.04Å; M150-I190 HydrophobicContact CB-CG2 3.84Å; M150-I190 HydrophobicContact CE-CD1 4.36Å
151	K	93.8	Very high	92.4	Very high	74 Å²	74	31.3 Å²	31.3	32%	0.322	15%	0.154	S	C	.	.	H	α-helix	trans	-57.7	-36.9	173.9	-81.5	180	177.7	-178.6	0	113	I147 F149 H154 H188 I190	I147-K151 HydrophobicContact CG2-CD 4.04Å; I147-K151 HydrophobicContact CG2-CG 4.45Å; I147-K151 WeakPolarHBondContact O-CB 3.46Å; I147-K151 VanDerWaalsContact O-CG 3.25Å; I147-K151 WeakPolarHBondContact O-CG 3.46Å; I147-K151 PolarHBondContact O-N 2.84Å; F149-K151 PolarHBondContact O-N 3.39Å; K151-H154 PolarHBondContact O-CD2 3.5Å; K151-H154 PolarHBondContact O-NE2 2.78Å; K151-H188 PolarHBondContact NZ-CD2 3.12Å; K151-I190 HydrophobicContact CG-CD1 4.06Å; K151-I190 HydrophobicContact CG-CG1 3.71Å
152	R	92	Very high	92.5	Very high	96 Å²	96	30.9 Å²	30.9	36%	0.362	15%	0.149	S	C	.	.	H	α-helix	trans	-82.1	-27.9	-179	-68	-175.3	-175.7	-140.9	7.9	113.3	W97 I101 E148 F149 M150	W97-R152 VanDerWaalsContact CD1-CD 3.43Å; W97-R152 VanDerWaalsContact CE2-CZ 3.43Å; W97-R152 VanDerWaalsContact CZ2-CZ 3.44Å; W97-R152 VanDerWaalsContact NE1-CD 3.32Å; W97-R152 VanDerWaalsContact NE1-CZ 3.26Å; I101-R152 HydrophobicContact CD1-CB 3.99Å; E148-R152 WeakPolarHBondContact O-CG 3.1Å; E148-R152 PolarHBondContact O-N 2.91Å; E148-R152 IonicContact OE1-CZ 2.68Å; E148-R152 IonicContact OE1-NE 2.79Å; E148-R152 PolarHBondContact OE1-NE 3.13Å; E148-R152 IonicContact OE1-NH2 3.72Å; E148-R152 PolarHBondContact OE1-NH2 3.21Å; F149-R152 PolarHBondContact O-N 3.17Å; M150-R152 VanDerWaalsContact C-N 3.26Å; M150-R152 PolarHBondContact O-N 3.46Å
153	L	92	Very high	92.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-91.8	-23.5	-176.3	-106.4	73.7	0	0	0	114.5	V100 I101 I104 F149 M150 E155 K156 V157 I159	V100-L153 HydrophobicContact CG1-CD1 4.05Å; V100-L153 HydrophobicContact CG1-CD2 3.76Å; V100-L153 HydrophobicContact CG1-CG 4.42Å; I101-L153 HydrophobicContact CD1-CD1 4.32Å; I101-L153 HydrophobicContact CG1-CD1 3.64Å; I104-L153 HydrophobicContact CD1-CD2 4.14Å; I104-L153 HydrophobicContact CD1-CG 4.26Å; F149-L153 HydrophobicContact CE1-CD2 3.64Å; F149-L153 HydrophobicContact CE1-CG 4.5Å; F149-L153 HydrophobicContact CE2-CD1 4.22Å; F149-L153 HydrophobicContact CE2-CD2 4.4Å; F149-L153 HydrophobicContact CZ-CD1 4.1Å; F149-L153 HydrophobicContact CZ-CD2 3.5Å; F149-L153 VanDerWaalsContact CZ-CD2 3.5Å; F149-L153 HydrophobicContact CZ-CG 4.37Å; F149-L153 PolarHBondContact O-N 3.38Å; F149-L153 VanDerWaalsContact O-N 3.16Å; M150-L153 PolarHBondContact O-N 3.09Å; L153-E155 PolarHBondContact O-N 2.92Å; L153-K156 PolarHBondContact O-N 3.24Å; L153-V157 HydrophobicContact CB-CG1 4.19Å; L153-V157 HydrophobicContact CD2-CG1 3.85Å; L153-V157 HydrophobicContact CG-CG1 4.12Å; L153-V157 PolarHBondContact O-N 3.01Å; L153-V157 VanDerWaalsContact O-N 3.13Å; L153-I159 HydrophobicContact CB-CD1 3.87Å
154	H	93.4	Very high	92.6	Very high	29 Å²	29	26.9 Å²	26.9	13%	0.134	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20	-168.2	63.3	-179.5	0	0	0	115.9	M150 K151 I159 K189 I190 K191	M150-H154 VanDerWaalsContact O-CB 3.27Å; M150-H154 WeakPolarHBondContact O-CB 3.48Å; M150-H154 PolarHBondContact O-N 3.24Å; K151-H154 PolarHBondContact O-CD2 3.5Å; K151-H154 PolarHBondContact O-NE2 2.78Å; H154-I159 HydrophobicContact CB-CD1 3.94Å; H154-K189 PolarHBondContact CE1-O 2.96Å; H154-I190 HydrophobicContact CB-CG2 4.4Å; H154-I190 WeakPolarHBondContact ND1-CA 3.41Å; H154-K191 HydrophobicContact CB-CB 4.43Å; H154-K191 WeakPolarHBondContact CB-O 3.44Å; H154-K191 PolarHBondContact ND1-N 2.77Å; H154-K191 VanDerWaalsContact ND1-N 3.17Å
155	E	91.6	Very high	92.6	Very high	92 Å²	92	25.3 Å²	25.3	43%	0.43	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.7	176.2	-73.4	-171.2	176.6	0	0	112.7	L153 H275 R282	L153-E155 PolarHBondContact O-N 2.92Å; E155-H275 VanDerWaalsContact C-ND1 3.27Å; E155-H275 PolarHBondContact O-ND1 2.78Å; E155-R282 IonicContact OE2-NH1 2.96Å; E155-R282 PolarHBondContact OE2-NH1 3.37Å
156	K	91.4	Very high	92.7	Very high	31 Å²	31	24.3 Å²	24.3	14%	0.135	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-23.5	-171.3	-65.4	179.8	176.1	-75.3	0	113.1	I101 I104 D105 F108 L153	I101-K156 HydrophobicContact CG2-CD 3.98Å; I104-K156 HydrophobicContact CG2-CB 4.18Å; D105-K156 IonicContact OD1-NZ 3.59Å; D105-K156 PolarHBondContact OD1-NZ 3.41Å; D105-K156 IonicContact OD2-NZ 2.73Å; D105-K156 PolarHBondContact OD2-NZ 2.74Å; F108-K156 WeakPolarHBondContact CE2-O 3.41Å; F108-K156 VanDerWaalsContact CZ-O 3.3Å; F108-K156 WeakPolarHBondContact CZ-O 3.2Å; L153-K156 PolarHBondContact O-N 3.24Å
157	V	93.2	Very high	92.8	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	12%	0.119	C	C	.	.	S	Bend	trans	-152.6	150	-178.3	65.2	0	0	0	0	111.3	I104 V128 C131 L153 I159 H275	I104-V157 HydrophobicContact CD1-CB 4.31Å; I104-V157 HydrophobicContact CD1-CG1 4.11Å; V128-V157 HydrophobicContact CB-CG2 4.42Å; V128-V157 HydrophobicContact CG1-CG2 3.75Å; C131-V157 HydrophobicContact CB-CB 4.47Å; C131-V157 HydrophobicContact CB-CG1 3.75Å; C131-V157 HydrophobicContact CB-CG2 3.82Å; L153-V157 HydrophobicContact CB-CG1 4.19Å; L153-V157 HydrophobicContact CD2-CG1 3.85Å; L153-V157 HydrophobicContact CG-CG1 4.12Å; L153-V157 PolarHBondContact O-N 3.01Å; L153-V157 VanDerWaalsContact O-N 3.13Å; V157-I159 HydrophobicContact CG1-CG1 4.25Å; V157-I159 PolarHBondContact O-N 3.45Å; V157-I159 VanDerWaalsContact O-N 3.15Å; V157-H275 VanDerWaalsContact C-NE2 3.33Å
158	N	92.7	Very high	92.7	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.032	14%	0.137	C	C	.	.			trans	-66.4	107.1	172.2	-64.6	-55.3	0	0	0	110.7	Q129 C130 C131 Y193 L267 V270 T271 H275	Q129-N158 WeakPolarHBondContact O-CB 3.44Å; Q129-N158 PolarHBondContact O-ND2 2.95Å; C130-N158 CarbonylContact C-O 3.54Å; C130-N158 WeakPolarHBondContact CA-O 3.36Å; C131-N158 PolarHBondContact N-O 3.49Å; N158-Y193 HydrophobicContact CB-CD2 3.96Å; N158-Y193 HydrophobicContact CB-CG 4.35Å; N158-L267 HydrophobicContact CB-CD2 3.67Å; N158-L267 PolarHBondContact ND2-O 3.48Å; N158-V270 WeakPolarHBondContact OD1-CG1 3.36Å; N158-T271 PolarHBondContact ND2-OG1 3.38Å; N158-T271 VanDerWaalsContact ND2-OG1 3.1Å; N158-H275 PolarHBondContact N-NE2 3.31Å; N158-H275 PolarHBondContact OD1-NE2 3.32Å
159	I	93.6	Very high	92.7	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	126.9	179.8	-57.6	179.1	0	0	0	110.1	M150 L153 H154 V157 Y193	M150-I159 HydrophobicContact CB-CD1 4.22Å; M150-I159 HydrophobicContact CG-CD1 4.35Å; M150-I159 HydrophobicContact CG-CG2 4.45Å; M150-I159 HydrophobicContact SD-CG2 4.49Å; L153-I159 HydrophobicContact CB-CD1 3.87Å; H154-I159 HydrophobicContact CB-CD1 3.94Å; V157-I159 HydrophobicContact CG1-CG1 4.25Å; V157-I159 PolarHBondContact O-N 3.45Å; V157-I159 VanDerWaalsContact O-N 3.15Å; I159-Y193 PolarHBondContact O-N 2.91Å
160	I	93.2	Very high	92.8	Very high	3 Å²	3	30 Å²	30	2%	0.015	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106.3	171.8	-59.6	169.1	0	0	0	108	C130 C131 L132 Y133 L162 L255 M258 L259	C130-I160 HydrophobicContact CB-CD1 4.41Å; C131-I160 PolarHBondContact O-N 2.84Å; L132-I160 HydrophobicContact CD2-CB 4.04Å; L132-I160 HydrophobicContact CD2-CD1 4.05Å; L132-I160 HydrophobicContact CD2-CG2 4.38Å; Y133-I160 PolarHBondContact N-O 3.31Å; I160-L162 HydrophobicContact CG2-CD2 3.95Å; I160-L255 HydrophobicContact CG2-CD1 4.44Å; I160-M258 HydrophobicContact CD1-CE 3.57Å; I160-M258 HydrophobicContact CD1-SD 4.35Å; I160-M258 HydrophobicContact CG1-CE 4.05Å; I160-L259 HydrophobicContact CD1-CD2 3.74Å
161	P	93.9	Very high	92.7	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.013	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.7	178.9	30.4	-34	0	0	0	111.1	I135 I185 I192 P215 L216	I135-P161 HydrophobicContact CD1-CB 3.85Å; P161-I185 HydrophobicContact CG-CD1 4.4Å; P161-I192 HydrophobicContact CG-CD1 4.16Å; P161-I192 HydrophobicContact CG-CG2 4.23Å; P161-P215 HydrophobicContact CB-CB 4.02Å; P161-P215 HydrophobicContact CG-CB 4.02Å; P161-L216 PolarHBondContact O-N 2.97Å
162	L	94	Very high	92.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.3	-179.8	-57.2	-178.6	0	0	0	110.1	L36 L132 Y133 F134 I135 I160 A164 L216 V218 L255	L36-L162 HydrophobicContact CD2-CD1 4.01Å; L132-L162 HydrophobicContact CB-CD1 4.02Å; L132-L162 HydrophobicContact CD1-CD1 4.44Å; L132-L162 HydrophobicContact CD2-CD1 4.34Å; L132-L162 HydrophobicContact CG-CD1 4.5Å; Y133-L162 PolarHBondContact O-N 2.68Å; F134-L162 WeakPolarHBondContact CA-O 3.35Å; F134-L162 HydrophobicContact CE2-CD1 4.2Å; F134-L162 HydrophobicContact CZ-CD1 4.3Å; I135-L162 PolarHBondContact N-O 2.76Å; I160-L162 HydrophobicContact CG2-CD2 3.95Å; L162-A164 PolarHBondContact O-N 2.9Å; L162-L216 CarbonylContact C-O 3.01Å; L162-L216 WeakPolarHBondContact CA-O 3.47Å; L162-L216 HydrophobicContact CD2-CB 3.85Å; L162-L216 HydrophobicContact CD2-CD1 4.26Å; L162-L216 HydrophobicContact CD2-CG 4.49Å; L162-V218 HydrophobicContact CB-CG2 4.26Å; L162-V218 HydrophobicContact CD2-CG1 4.48Å; L162-L255 HydrophobicContact CD1-CD1 4.45Å; L162-L255 HydrophobicContact CD1-CD2 3.78Å; L162-L255 HydrophobicContact CD2-CD1 3.82Å; L162-L255 HydrophobicContact CD2-CD2 4.01Å; L162-L255 HydrophobicContact CD2-CG 4.48Å
163	I	95	Very high	92.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.2	167.2	-60.8	163.4	0	0	0	107.5	P137 L169 F177 K178 I181 P215 L216 A217 V218	P137-I163 HydrophobicContact CB-CG2 4.27Å; I163-L169 HydrophobicContact CG2-CD1 4.17Å; I163-F177 HydrophobicContact CD1-CD1 3.77Å; I163-F177 HydrophobicContact CD1-CE1 4.17Å; I163-F177 HydrophobicContact CG1-CD1 4.14Å; I163-F177 HydrophobicContact CG1-CE1 4.01Å; I163-F177 HydrophobicContact CG2-CD1 4.17Å; I163-F177 HydrophobicContact CG2-CE1 3.92Å; I163-K178 HydrophobicContact CD1-CG 3.65Å; I163-I181 HydrophobicContact CD1-CD1 4Å; I163-I181 HydrophobicContact CG1-CD1 3.88Å; I163-P215 HydrophobicContact CD1-CG 3.82Å; I163-P215 HydrophobicContact CG1-CB 4.38Å; I163-P215 HydrophobicContact CG1-CG 4.06Å; I163-L216 PolarHBondContact N-O 3.23Å; I163-A217 HydrophobicContact CB-CB 4.29Å; I163-A217 HydrophobicContact CD1-CB 4.42Å; I163-V218 PolarHBondContact O-N 3.41Å
164	A	92.6	Very high	92.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.008	20%	0.199	C	C	.	.	S	Bend	trans	-75.6	150.4	179.7	0	0	0	0	0	111.6	L31 F134 I135 P137 L162 A166	L31-A164 HydrophobicContact CB-CB 3.84Å; L31-A164 HydrophobicContact CD1-CB 4.38Å; L31-A164 HydrophobicContact CD2-CB 4.15Å; L31-A164 HydrophobicContact CG-CB 4.35Å; F134-A164 HydrophobicContact CB-CB 4.41Å; F134-A164 HydrophobicContact CD1-CB 3.95Å; I135-A164 WeakPolarHBondContact O-CB 3.4Å; I135-A164 PolarHBondContact O-N 3.17Å; P137-A164 WeakPolarHBondContact CB-O 3.49Å; P137-A164 WeakPolarHBondContact CD-O 3.43Å; P137-A164 VanDerWaalsContact CG-O 3.26Å; P137-A164 WeakPolarHBondContact CG-O 3.47Å; L162-A164 PolarHBondContact O-N 2.9Å; A164-A166 VanDerWaalsContact C-N 3.3Å; A164-A166 PolarHBondContact O-N 3.25Å
165	K	90.9	Very high	92.8	Very high	78 Å²	78	41.8 Å²	41.8	34%	0.339	22%	0.218	S	C	.	.			trans	46.4	52.6	176	-58.3	-178.9	-178.2	174	0	112.1	G30 P137 D167 T168 V218	G30-K165 WeakPolarHBondContact O-CE 3.5Å; G30-K165 PolarHBondContact O-NZ 3.25Å; P137-K165 HydrophobicContact CG-CB 4.33Å; K165-D167 WeakPolarHBondContact CA-OD1 3.37Å; K165-D167 PolarHBondContact O-N 3.43Å; K165-T168 HydrophobicContact CB-CG2 4.04Å; K165-T168 WeakPolarHBondContact O-CB 3.24Å; K165-T168 WeakPolarHBondContact O-CG2 3.46Å; K165-T168 PolarHBondContact O-N 2.92Å; K165-T168 PolarHBondContact O-OG1 2.86Å; K165-V218 PolarHBondContact N-O 2.97Å
166	A	92.8	Very high	92.9	Very high	8 Å²	8	44 Å²	44	7%	0.066	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-58	-20.5	-176.8	0	0	0	0	0	113.8	A164 T168 L169 A217 V218 V219	A164-A166 VanDerWaalsContact C-N 3.3Å; A164-A166 PolarHBondContact O-N 3.25Å; A166-T168 PolarHBondContact O-N 3.32Å; A166-T168 VanDerWaalsContact O-N 3.14Å; A166-L169 PolarHBondContact O-N 2.99Å; A166-A217 HydrophobicContact CB-CB 3.68Å; A166-V218 PolarHBondContact N-O 3.49Å; A166-V218 VanDerWaalsContact N-O 3.12Å; A166-V219 HydrophobicContact CB-CG2 4.01Å
167	D	92.4	Very high	93.1	Very high	42 Å²	42	42.6 Å²	42.6	23%	0.225	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-67.4	-2.7	173.4	58.6	-35.3	0	0	0	114.6	K165 V219 R235 Y237 A242	K165-D167 WeakPolarHBondContact CA-OD1 3.37Å; K165-D167 PolarHBondContact O-N 3.43Å; D167-V219 HydrophobicContact CB-CG1 4.43Å; D167-V219 HydrophobicContact CB-CG2 3.88Å; D167-R235 VanDerWaalsContact CG-NH1 3.35Å; D167-R235 IonicContact OD1-NH1 3.13Å; D167-R235 PolarHBondContact OD1-NH1 3.44Å; D167-R235 VanDerWaalsContact OD1-NH1 3.13Å; D167-R235 WeakPolarHBondContact OD2-CD 3.42Å; D167-R235 IonicContact OD2-CZ 3.3Å; D167-R235 VanDerWaalsContact OD2-CZ 3.3Å; D167-R235 IonicContact OD2-NE 3.42Å; D167-R235 IonicContact OD2-NH1 2.74Å; D167-R235 PolarHBondContact OD2-NH1 3.4Å; D167-Y237 PolarHBondContact OD2-OH 3.02Å; D167-A242 HydrophobicContact CB-CB 4.21Å
168	T	91.8	Very high	93.1	Very high	79 Å²	79	44 Å²	44	49%	0.485	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-88.6	-13.3	172.2	57.8	0	0	0	0	113.8	P137 K165 A166	P137-T168 WeakPolarHBondContact CB-OG1 3.38Å; P137-T168 VanDerWaalsContact CG-OG1 3.26Å; P137-T168 WeakPolarHBondContact CG-OG1 3.47Å; K165-T168 HydrophobicContact CB-CG2 4.04Å; K165-T168 WeakPolarHBondContact O-CB 3.24Å; K165-T168 WeakPolarHBondContact O-CG2 3.46Å; K165-T168 PolarHBondContact O-N 2.92Å; K165-T168 PolarHBondContact O-OG1 2.86Å; A166-T168 PolarHBondContact O-N 3.32Å; A166-T168 VanDerWaalsContact O-N 3.14Å
169	L	92.3	Very high	93.1	Very high	26 Å²	26	50.1 Å²	50.1	14%	0.136	26%	0.255	C	S	.	.	S	Bend	trans	-112.1	144.6	-177.7	-60.5	170.8	0	0	0	109.5	P137 I163 A166 E173 C174 F177	P137-L169 HydrophobicContact CB-CD1 3.88Å; P137-L169 HydrophobicContact CB-CD2 4.44Å; P137-L169 HydrophobicContact CB-CG 4.05Å; I163-L169 HydrophobicContact CG2-CD1 4.17Å; A166-L169 PolarHBondContact O-N 2.99Å; L169-E173 HydrophobicContact CB-CB 4.33Å; L169-E173 HydrophobicContact CD2-CB 4.46Å; L169-C174 HydrophobicContact CB-CB 4.22Å; L169-F177 HydrophobicContact CD1-CD1 3.8Å; L169-F177 HydrophobicContact CD1-CE1 4.36Å
170	T	92.8	Very high	93.2	Very high	62 Å²	62	53.1 Å²	53.1	38%	0.38	27%	0.269	S	S	.	.			trans	-70	161.3	167.8	71.7	0	0	0	0	110.7	E172 E173 C174	T170-E172 PolarHBondContact O-N 3.37Å; T170-E172 PolarHBondContact OG1-OE2 3.45Å; T170-E173 PolarHBondContact N-OE2 3.23Å; T170-E173 PolarHBondContact O-N 3.31Å; T170-E173 VanDerWaalsContact OG1-CG 3.27Å; T170-E173 WeakPolarHBondContact OG1-CG 3.43Å; T170-E173 PolarHBondContact OG1-N 2.78Å; T170-E173 PolarHBondContact OG1-OE2 3.44Å; T170-C174 VanDerWaalsContact O-CB 3.25Å; T170-C174 WeakPolarHBondContact O-CB 3.45Å; T170-C174 PolarHBondContact O-N 3.49Å
171	P	91.6	Very high	93.3	Very high	102 Å²	102	53 Å²	53	66%	0.662	27%	0.268	S	S	*	.	H	α-helix	trans	-54.8	-38.5	176.2	-27	36.5	0	0	0	113.3	Q175	P171-Q175 WeakPolarHBondContact O-CB 3.23Å; P171-Q175 PolarHBondContact O-N 2.91Å
172	E	93.2	Very high	93.3	Very high	117 Å²	117	55.9 Å²	55.9	55%	0.547	28%	0.282	S	S	.	.	H	α-helix	trans	-69	-46.6	179.1	-61.5	71.9	-153.5	0	0	111.6	T170 C174 Q175 Q176	T170-E172 PolarHBondContact O-N 3.37Å; T170-E172 PolarHBondContact OG1-OE2 3.45Å; E172-C174 VanDerWaalsContact C-N 3.35Å; E172-Q175 PolarHBondContact O-N 2.94Å; E172-Q176 WeakPolarHBondContact O-CG 3.42Å; E172-Q176 PolarHBondContact O-N 3.28Å
173	E	94.3	Very high	93.3	Very high	92 Å²	92	61.7 Å²	61.7	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-62.1	-44	176.4	-72	171.4	161.3	0	0	110.9	L169 T170 Q175 Q176 F177	L169-E173 HydrophobicContact CB-CB 4.33Å; L169-E173 HydrophobicContact CD2-CB 4.46Å; T170-E173 PolarHBondContact N-OE2 3.23Å; T170-E173 PolarHBondContact O-N 3.31Å; T170-E173 VanDerWaalsContact OG1-CG 3.27Å; T170-E173 WeakPolarHBondContact OG1-CG 3.43Å; T170-E173 PolarHBondContact OG1-N 2.78Å; T170-E173 PolarHBondContact OG1-OE2 3.44Å; E173-Q175 VanDerWaalsContact C-N 3.33Å; E173-Q175 PolarHBondContact O-N 3.45Å; E173-Q176 PolarHBondContact O-N 3.01Å; E173-F177 WeakPolarHBondContact O-CB 3.42Å; E173-F177 PolarHBondContact O-N 2.81Å
174	C	92.9	Very high	93.4	Very high	18 Å²	18	62.8 Å²	62.8	12%	0.122	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-43.7	176.9	-175.5	0	0	0	0	111.2	L169 T170 E172 F177 K178	L169-C174 HydrophobicContact CB-CB 4.22Å; T170-C174 VanDerWaalsContact O-CB 3.25Å; T170-C174 WeakPolarHBondContact O-CB 3.45Å; T170-C174 PolarHBondContact O-N 3.49Å; E172-C174 VanDerWaalsContact C-N 3.35Å; C174-F177 PolarHBondContact O-N 2.83Å; C174-K178 WeakPolarHBondContact O-CB 3.38Å; C174-K178 VanDerWaalsContact O-CG 3.28Å; C174-K178 WeakPolarHBondContact O-CG 3.34Å; C174-K178 PolarHBondContact O-N 3.33Å
175	Q	92.2	Very high	93.5	Very high	116 Å²	116	63.1 Å²	63.1	54%	0.542	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-42	178.4	-167.1	-176.5	31.9	0	0	112.4	P171 E172 E173 K179	P171-Q175 WeakPolarHBondContact O-CB 3.23Å; P171-Q175 PolarHBondContact O-N 2.91Å; E172-Q175 PolarHBondContact O-N 2.94Å; E173-Q175 VanDerWaalsContact C-N 3.33Å; E173-Q175 PolarHBondContact O-N 3.45Å; Q175-K179 WeakPolarHBondContact O-CG 3.49Å; Q175-K179 PolarHBondContact O-N 2.75Å
176	Q	93.9	Very high	93.6	Very high	138 Å²	138	66.9 Å²	66.9	65%	0.645	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-43.5	175.7	-69.9	178	7.9	0	0	111.1	E172 E173 K178 K179 Q180	E172-Q176 WeakPolarHBondContact O-CG 3.42Å; E172-Q176 PolarHBondContact O-N 3.28Å; E173-Q176 PolarHBondContact O-N 3.01Å; Q176-K178 PolarHBondContact O-N 2.96Å; Q176-K179 PolarHBondContact O-N 2.78Å; Q176-Q180 PolarHBondContact O-N 3.35Å
177	F	95	Very high	93.8	Very high	2 Å²	2	72.9 Å²	72.9	1%	0.009	36%	0.359	C	S	.	.	H	α-helix	trans	-63.3	-42.5	179.5	-172.7	-135.1	0	0	0	112	I135 A136 I163 L169 E173 C174 K179 Q180 I181	I135-F177 HydrophobicContact CG2-CZ 4.08Å; A136-F177 WeakPolarHBondContact O-CZ 3.4Å; I163-F177 HydrophobicContact CD1-CD1 3.77Å; I163-F177 HydrophobicContact CD1-CE1 4.17Å; I163-F177 HydrophobicContact CG1-CD1 4.14Å; I163-F177 HydrophobicContact CG1-CE1 4.01Å; I163-F177 HydrophobicContact CG2-CD1 4.17Å; I163-F177 HydrophobicContact CG2-CE1 3.92Å; L169-F177 HydrophobicContact CD1-CD1 3.8Å; L169-F177 HydrophobicContact CD1-CE1 4.36Å; E173-F177 WeakPolarHBondContact O-CB 3.42Å; E173-F177 PolarHBondContact O-N 2.81Å; C174-F177 PolarHBondContact O-N 2.83Å; F177-K179 PolarHBondContact O-N 3Å; F177-Q180 PolarHBondContact O-N 3.06Å; F177-I181 HydrophobicContact CD1-CD1 3.87Å; F177-I181 HydrophobicContact CD2-CD1 4.08Å; F177-I181 HydrophobicContact CD2-CG1 4.24Å; F177-I181 HydrophobicContact CE1-CD1 3.63Å; F177-I181 HydrophobicContact CE2-CD1 3.85Å; F177-I181 HydrophobicContact CE2-CG1 4.02Å; F177-I181 HydrophobicContact CG-CD1 4.08Å; F177-I181 HydrophobicContact CZ-CD1 3.63Å; F177-I181 HydrophobicContact CZ-CG1 4.25Å; F177-I181 WeakPolarHBondContact O-CG1 3.36Å; F177-I181 PolarHBondContact O-N 2.82Å
178	K	94.1	Very high	93.9	Very high	30 Å²	30	73.6 Å²	73.6	13%	0.13	36%	0.361	C	S	.	.	H	α-helix	trans	-56.6	-48.4	172.8	-76.3	-177.3	-179.5	-154.7	0	112.1	I163 C174 Q176 Q180 I181 M182 R213 P215 D251	I163-K178 HydrophobicContact CD1-CG 3.65Å; C174-K178 WeakPolarHBondContact O-CB 3.38Å; C174-K178 VanDerWaalsContact O-CG 3.28Å; C174-K178 WeakPolarHBondContact O-CG 3.34Å; C174-K178 PolarHBondContact O-N 3.33Å; Q176-K178 PolarHBondContact O-N 2.96Å; K178-Q180 VanDerWaalsContact C-N 3.31Å; K178-Q180 PolarHBondContact O-N 3.13Å; K178-I181 PolarHBondContact O-N 2.89Å; K178-M182 WeakPolarHBondContact O-CG 3.41Å; K178-M182 PolarHBondContact O-N 3.37Å; K178-R213 PolarHBondContact NZ-O 3.18Å; K178-P215 HydrophobicContact CB-CG 4.44Å; K178-P215 WeakPolarHBondContact CE-O 3.12Å; K178-P215 HydrophobicContact CG-CG 4.11Å; K178-P215 PolarHBondContact NZ-O 3.38Å; K178-D251 IonicContact NZ-OD2 2.69Å; K178-D251 PolarHBondContact NZ-OD2 3.18Å
179	K	93.6	Very high	94.1	Very high	135 Å²	135	78.1 Å²	78.1	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-60.3	-42.8	178.2	-73.2	175.4	179.7	175.8	0	111.6	Q175 Q176 F177 M182 K183	Q175-K179 WeakPolarHBondContact O-CG 3.49Å; Q175-K179 PolarHBondContact O-N 2.75Å; Q176-K179 PolarHBondContact O-N 2.78Å; F177-K179 PolarHBondContact O-N 3Å; K179-M182 PolarHBondContact O-N 2.8Å; K179-K183 WeakPolarHBondContact O-CB 3.24Å; K179-K183 PolarHBondContact O-N 3.42Å
180	Q	94.8	Very high	94.2	Very high	64 Å²	64	77.3 Å²	77.3	30%	0.299	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-43	-179.6	-174.3	54.7	28.5	0	0	112.2	H140 Q176 F177 K178 M182 K183 E184	H140-Q180 WeakPolarHBondContact O-CG 3.32Å; Q176-Q180 PolarHBondContact O-N 3.35Å; F177-Q180 PolarHBondContact O-N 3.06Å; K178-Q180 VanDerWaalsContact C-N 3.31Å; K178-Q180 PolarHBondContact O-N 3.13Å; Q180-M182 PolarHBondContact O-N 3.31Å; Q180-K183 WeakPolarHBondContact O-CB 3.36Å; Q180-K183 PolarHBondContact O-N 2.97Å; Q180-E184 PolarHBondContact NE2-OE1 2.65Å; Q180-E184 WeakPolarHBondContact O-CG 3.48Å; Q180-E184 PolarHBondContact O-N 3.4Å
181	I	95.2	Very high	94.2	Very high	0 Å²	0	81 Å²	81	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-59	-47.6	173.6	-69.6	163.8	0	0	0	110.9	I135 L142 I163 F177 K178 K183 E184 I185 P215	I135-I181 HydrophobicContact CD1-CD1 4.17Å; I135-I181 HydrophobicContact CD1-CG2 4.08Å; I135-I181 HydrophobicContact CG2-CD1 4.22Å; L142-I181 HydrophobicContact CD1-CG2 4.37Å; L142-I181 HydrophobicContact CD2-CG1 4.18Å; L142-I181 HydrophobicContact CD2-CG2 3.93Å; L142-I181 HydrophobicContact CG-CG1 4.32Å; L142-I181 HydrophobicContact CG-CG2 4.17Å; I163-I181 HydrophobicContact CD1-CD1 4Å; I163-I181 HydrophobicContact CG1-CD1 3.88Å; F177-I181 HydrophobicContact CD1-CD1 3.87Å; F177-I181 HydrophobicContact CD2-CD1 4.08Å; F177-I181 HydrophobicContact CD2-CG1 4.24Å; F177-I181 HydrophobicContact CE1-CD1 3.63Å; F177-I181 HydrophobicContact CE2-CD1 3.85Å; F177-I181 HydrophobicContact CE2-CG1 4.02Å; F177-I181 HydrophobicContact CG-CD1 4.08Å; F177-I181 HydrophobicContact CZ-CD1 3.63Å; F177-I181 HydrophobicContact CZ-CG1 4.25Å; F177-I181 WeakPolarHBondContact O-CG1 3.36Å; F177-I181 PolarHBondContact O-N 2.82Å; K178-I181 PolarHBondContact O-N 2.89Å; I181-K183 VanDerWaalsContact C-N 3.32Å; I181-K183 PolarHBondContact O-N 3.4Å; I181-E184 PolarHBondContact O-N 3.08Å; I181-I185 HydrophobicContact CG2-CD1 3.76Å; I181-I185 HydrophobicContact CG2-CG1 4.29Å; I181-I185 WeakPolarHBondContact O-CG1 3.48Å; I181-I185 PolarHBondContact O-N 2.82Å; I181-P215 HydrophobicContact CB-CG 4.06Å; I181-P215 HydrophobicContact CD1-CG 3.88Å; I181-P215 HydrophobicContact CG2-CB 4.49Å; I181-P215 HydrophobicContact CG2-CG 3.86Å
182	M	94.1	Very high	94.2	Very high	63 Å²	63	77.1 Å²	77.1	31%	0.31	35%	0.354	S	S	.	.	H	α-helix	trans	-63.7	-38.5	-179.8	-69.9	-56.3	-67.2	0	0	112.2	K178 K179 Q180 I185 Q186 I192 L214	K178-M182 WeakPolarHBondContact O-CG 3.41Å; K178-M182 PolarHBondContact O-N 3.37Å; K179-M182 PolarHBondContact O-N 2.8Å; Q180-M182 PolarHBondContact O-N 3.31Å; M182-I185 PolarHBondContact O-N 3.05Å; M182-I185 HydrophobicContact SD-CD1 4.3Å; M182-Q186 PolarHBondContact O-N 2.9Å; M182-I192 HydrophobicContact CE-CD1 4.16Å; M182-I192 HydrophobicContact SD-CD1 4.37Å; M182-L214 WeakPolarHBondContact CG-O 3.39Å; M182-L214 HydrophobicContact SD-CB 4.23Å
183	K	94.8	Very high	94.1	Very high	122 Å²	122	72 Å²	72	53%	0.53	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-47.3	173.8	-177.6	-174.6	174.5	-171.1	0	111.3	K179 Q180 I181 Q186 E187	K179-K183 WeakPolarHBondContact O-CB 3.24Å; K179-K183 PolarHBondContact O-N 3.42Å; Q180-K183 WeakPolarHBondContact O-CB 3.36Å; Q180-K183 PolarHBondContact O-N 2.97Å; I181-K183 VanDerWaalsContact C-N 3.32Å; I181-K183 PolarHBondContact O-N 3.4Å; K183-Q186 PolarHBondContact O-N 2.92Å; K183-E187 WeakPolarHBondContact O-CB 3.46Å; K183-E187 PolarHBondContact O-N 2.81Å
184	E	95.4	Very high	93.6	Very high	24 Å²	24	74.5 Å²	74.5	11%	0.112	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-38.4	179.4	-72.6	173	-165.5	0	0	112.4	L142 Q180 I181 Q186 E187 H188	L142-E184 WeakPolarHBondContact CA-OE2 3.38Å; L142-E184 WeakPolarHBondContact CB-OE2 3.33Å; L142-E184 HydrophobicContact CD1-CB 4.03Å; L142-E184 WeakPolarHBondContact CG-OE2 3.17Å; L142-E184 PolarHBondContact N-OE2 3.38Å; Q180-E184 PolarHBondContact NE2-OE1 2.65Å; Q180-E184 WeakPolarHBondContact O-CG 3.48Å; Q180-E184 PolarHBondContact O-N 3.4Å; I181-E184 PolarHBondContact O-N 3.08Å; E184-Q186 VanDerWaalsContact C-N 3.3Å; E184-Q186 PolarHBondContact O-N 3.47Å; E184-E187 PolarHBondContact O-N 3.47Å; E184-H188 VanDerWaalsContact O-CB 3.3Å; E184-H188 WeakPolarHBondContact O-CB 3.49Å; E184-H188 PolarHBondContact O-N 2.76Å; E184-H188 PolarHBondContact O-ND1 3.01Å
185	I	94.8	Very high	93.1	Very high	7 Å²	7	73.9 Å²	73.9	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-57.3	-45.9	172.9	-75.2	175	0	0	0	110.3	L142 P161 I181 M182 K189 I190 I192	L142-I185 HydrophobicContact CD1-CG1 3.99Å; P161-I185 HydrophobicContact CG-CD1 4.4Å; I181-I185 HydrophobicContact CG2-CD1 3.76Å; I181-I185 HydrophobicContact CG2-CG1 4.29Å; I181-I185 WeakPolarHBondContact O-CG1 3.48Å; I181-I185 PolarHBondContact O-N 2.82Å; M182-I185 PolarHBondContact O-N 3.05Å; M182-I185 HydrophobicContact SD-CD1 4.3Å; I185-K189 PolarHBondContact O-N 2.59Å; I185-K189 VanDerWaalsContact O-N 3.16Å; I185-I190 HydrophobicContact CG2-CB 4.08Å; I185-I190 HydrophobicContact CG2-CG2 4.47Å; I185-I190 VanDerWaalsContact CG2-O 3.32Å; I185-I190 WeakPolarHBondContact CG2-O 3.5Å; I185-I190 PolarHBondContact O-N 3.1Å; I185-I192 HydrophobicContact CD1-CG2 4.13Å; I185-I192 HydrophobicContact CG2-CG2 4.22Å
186	Q	94.4	Very high	92.6	Very high	158 Å²	158	70.7 Å²	70.7	74%	0.738	33%	0.326	S	S	*	.	H	α-helix	trans	-67.4	-45.8	179	-171.4	179.4	15.2	0	0	112.2	M182 K183 E184 H188 K189	M182-Q186 PolarHBondContact O-N 2.9Å; K183-Q186 PolarHBondContact O-N 2.92Å; E184-Q186 VanDerWaalsContact C-N 3.3Å; E184-Q186 PolarHBondContact O-N 3.47Å; Q186-H188 VanDerWaalsContact C-N 3.3Å; Q186-H188 PolarHBondContact O-N 3.07Å; Q186-K189 PolarHBondContact O-N 2.95Å
187	E	96.1	Very high	91.6	Very high	133 Å²	133	72.1 Å²	72.1	62%	0.621	33%	0.333	S	S	*	.	H	α-helix	trans	-58.9	-42.3	178.6	-177.8	173.7	176.6	0	0	111.8	K183 E184 K189	K183-E187 WeakPolarHBondContact O-CB 3.46Å; K183-E187 PolarHBondContact O-N 2.81Å; E184-E187 PolarHBondContact O-N 3.47Å; E187-K189 PolarHBondContact O-N 3.36Å
188	H	94.9	Very high	90.6	Very high	58 Å²	58	73.8 Å²	73.8	27%	0.269	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.1	178.8	-68.4	94.1	0	0	0	113.8	I147 K151 E184 Q186 I190	I147-H188 HydrophobicContact CG2-CB 4.18Å; K151-H188 PolarHBondContact NZ-CD2 3.12Å; E184-H188 VanDerWaalsContact O-CB 3.3Å; E184-H188 WeakPolarHBondContact O-CB 3.49Å; E184-H188 PolarHBondContact O-N 2.76Å; E184-H188 PolarHBondContact O-ND1 3.01Å; Q186-H188 VanDerWaalsContact C-N 3.3Å; Q186-H188 PolarHBondContact O-N 3.07Å; H188-I190 VanDerWaalsContact C-N 3.26Å; H188-I190 HydrophobicContact CB-CD1 3.86Å; H188-I190 HydrophobicContact CB-CG1 3.97Å; H188-I190 PolarHBondContact O-N 3.12Å
189	K	95.4	Very high	89.7	Confident	173 Å²	173	80.9 Å²	80.9	75%	0.752	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	39.7	-179.3	-57.2	179.1	-179.2	178.1	0	112.9	H154 I185 Q186 E187	H154-K189 PolarHBondContact CE1-O 2.96Å; I185-K189 PolarHBondContact O-N 2.59Å; I185-K189 VanDerWaalsContact O-N 3.16Å; Q186-K189 PolarHBondContact O-N 2.95Å; E187-K189 PolarHBondContact O-N 3.36Å
190	I	94.9	Very high	89.2	Confident	9 Å²	9	78.5 Å²	78.5	5%	0.046	38%	0.376	C	S	.	.			trans	-83.1	121.5	178.4	-63.5	166.5	0	0	0	108.9	I147 M150 K151 H154 I185 H188 I192	I147-I190 HydrophobicContact CG2-CD1 4.37Å; M150-I190 HydrophobicContact CB-CD1 4.04Å; M150-I190 HydrophobicContact CB-CG2 3.84Å; M150-I190 HydrophobicContact CE-CD1 4.36Å; K151-I190 HydrophobicContact CG-CD1 4.06Å; K151-I190 HydrophobicContact CG-CG1 3.71Å; H154-I190 HydrophobicContact CB-CG2 4.4Å; H154-I190 WeakPolarHBondContact ND1-CA 3.41Å; I185-I190 HydrophobicContact CG2-CB 4.08Å; I185-I190 HydrophobicContact CG2-CG2 4.47Å; I185-I190 VanDerWaalsContact CG2-O 3.32Å; I185-I190 WeakPolarHBondContact CG2-O 3.5Å; I185-I190 PolarHBondContact O-N 3.1Å; H188-I190 VanDerWaalsContact C-N 3.26Å; H188-I190 HydrophobicContact CB-CD1 3.86Å; H188-I190 HydrophobicContact CB-CG1 3.97Å; H188-I190 PolarHBondContact O-N 3.12Å; I190-I192 HydrophobicContact CG2-CG2 4.32Å; I190-I192 PolarHBondContact O-N 3.27Å
191	K	92.4	Very high	88.6	Confident	141 Å²	141	81.7 Å²	81.7	61%	0.613	39%	0.391	S	S	*	.			trans	-85.3	107.4	174.4	-59.1	-179.2	-174.8	175.8	0	109.9	H154	H154-K191 HydrophobicContact CB-CB 4.43Å; H154-K191 WeakPolarHBondContact CB-O 3.44Å; H154-K191 PolarHBondContact ND1-N 2.77Å; H154-K191 VanDerWaalsContact ND1-N 3.17Å
192	I	92.8	Very high	88	Confident	20 Å²	20	88.9 Å²	88.9	10%	0.103	43%	0.425	C	S	.	.			trans	-87.8	169.8	169.4	60.2	174.4	0	0	0	109.7	P161 M182 I185 I190 E194 L214	P161-I192 HydrophobicContact CG-CD1 4.16Å; P161-I192 HydrophobicContact CG-CG2 4.23Å; M182-I192 HydrophobicContact CE-CD1 4.16Å; M182-I192 HydrophobicContact SD-CD1 4.37Å; I185-I192 HydrophobicContact CD1-CG2 4.13Å; I185-I192 HydrophobicContact CG2-CG2 4.22Å; I190-I192 HydrophobicContact CG2-CG2 4.32Å; I190-I192 PolarHBondContact O-N 3.27Å; I192-E194 PolarHBondContact O-N 3.2Å; I192-L214 HydrophobicContact CD1-CD1 4.21Å
193	Y	90.7	Very high	87.2	Confident	10 Å²	10	89.5 Å²	89.5	4%	0.039	43%	0.427	C	S	.	.			trans	-60.4	123.1	173.8	173.3	-100.5	0	0	0	110.2	N158 I159 F195 M258 D266 L267 V270	N158-Y193 HydrophobicContact CB-CD2 3.96Å; N158-Y193 HydrophobicContact CB-CG 4.35Å; I159-Y193 PolarHBondContact O-N 2.91Å; Y193-F195 AromaticContact CE1-CD1 3.8Å; Y193-F195 HydrophobicContact CE1-CD1 3.8Å; Y193-F195 AromaticContact CE1-CE1 3.9Å; Y193-F195 HydrophobicContact CE1-CE1 3.9Å; Y193-F195 HydrophobicContact CE1-CG 4.26Å; Y193-F195 HydrophobicContact CE1-CZ 4.38Å; Y193-M258 HydrophobicContact CD1-CE 3.4Å; Y193-M258 VanDerWaalsContact CD1-CE 3.4Å; Y193-M258 HydrophobicContact CE1-CE 3.38Å; Y193-D266 VanDerWaalsContact CE2-OD2 3.29Å; Y193-D266 WeakPolarHBondContact CE2-OD2 3.44Å; Y193-D266 VanDerWaalsContact CZ-OD2 3.26Å; Y193-D266 PolarHBondContact OH-OD2 2.92Å; Y193-L267 HydrophobicContact CD1-CD2 4.27Å; Y193-L267 HydrophobicContact CD2-CD2 3.51Å; Y193-L267 HydrophobicContact CE1-CD2 4.22Å; Y193-L267 HydrophobicContact CE2-CD2 3.45Å; Y193-L267 VanDerWaalsContact CE2-CD2 3.45Å; Y193-L267 HydrophobicContact CE2-CG 4.1Å; Y193-L267 HydrophobicContact CG-CD2 3.91Å; Y193-V270 HydrophobicContact CE2-CG2 4.46Å
194	E	84.3	Confident	86.5	Confident	143 Å²	143	85.8 Å²	85.8	67%	0.668	41%	0.413	S	S	*	.			trans	-107.5	133	174.9	-69.4	-178.3	-166.9	0	0	109	I192	I192-E194 PolarHBondContact O-N 3.2Å
195	F	82	Confident	86	Confident	5 Å²	5	90.5 Å²	90.5	2%	0.022	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-67.6	133.5	175.3	-57.4	-87.2	0	0	0	110.3	Y193 V207 I210 K211 L214 M258 H263	Y193-F195 AromaticContact CE1-CD1 3.8Å; Y193-F195 HydrophobicContact CE1-CD1 3.8Å; Y193-F195 AromaticContact CE1-CE1 3.9Å; Y193-F195 HydrophobicContact CE1-CE1 3.9Å; Y193-F195 HydrophobicContact CE1-CG 4.26Å; Y193-F195 HydrophobicContact CE1-CZ 4.38Å; F195-V207 HydrophobicContact CB-CB 4.38Å; F195-V207 HydrophobicContact CB-CG1 3.35Å; F195-V207 HydrophobicContact CB-CG2 4.2Å; F195-V207 HydrophobicContact CD2-CG1 4.31Å; F195-V207 HydrophobicContact CG-CG1 3.93Å; F195-I210 HydrophobicContact CE1-CD1 4.47Å; F195-I210 HydrophobicContact CE1-CG2 4.14Å; F195-I210 HydrophobicContact CE2-CB 4.16Å; F195-I210 HydrophobicContact CE2-CG2 3.6Å; F195-I210 HydrophobicContact CZ-CB 4.08Å; F195-I210 HydrophobicContact CZ-CG2 3.27Å; F195-K211 HydrophobicContact CD2-CD 4.49Å; F195-K211 HydrophobicContact CD2-CG 3.7Å; F195-K211 HydrophobicContact CE2-CG 4.28Å; F195-K211 PolarHBondContact O-NZ 3.34Å; F195-K211 VanDerWaalsContact O-NZ 3.08Å; F195-L214 HydrophobicContact CE2-CD1 4.25Å; F195-M258 HydrophobicContact CD1-CE 4.49Å; F195-M258 HydrophobicContact CE1-CE 3.47Å; F195-M258 VanDerWaalsContact CE1-CE 3.47Å; F195-M258 HydrophobicContact CE1-CG 3.9Å; F195-M258 HydrophobicContact CE1-SD 3.79Å; F195-M258 HydrophobicContact CE2-CE 4.49Å; F195-M258 HydrophobicContact CZ-CE 3.43Å; F195-M258 VanDerWaalsContact CZ-CE 3.43Å; F195-M258 HydrophobicContact CZ-CG 4.29Å; F195-M258 HydrophobicContact CZ-SD 3.58Å; F195-M258 VanDerWaalsContact CZ-SD 3.58Å; F195-H263 AromaticContact CD1-CD2 3.46Å; F195-H263 VanDerWaalsContact CD1-CD2 3.46Å; F195-H263 WeakPolarHBondContact CD1-CD2 3.41Å; F195-H263 AromaticContact CD1-CE1 3.82Å; F195-H263 AromaticContact CD1-CG 3.95Å; F195-H263 AromaticContact CD1-NE2 3.36Å; F195-H263 WeakPolarHBondContact CD1-NE2 3.32Å; F195-H263 AromaticContact CE1-CE1 3.93Å; F195-H263 AromaticContact CE1-ND1 3.99Å; F195-H263 AromaticContact CE1-NE2 3.93Å
196	P	80	Confident	85.2	Confident	49 Å²	49	94.5 Å²	94.5	32%	0.318	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60.1	148.3	176.6	29.3	-38	0	0	0	110.3	D266	P196-D266 WeakPolarHBondContact CD-OD2 3.41Å; P196-D266 HydrophobicContact CG-CB 4.44Å; P196-D266 WeakPolarHBondContact CG-OD1 3.17Å
197	E	74.9	Confident	84.6	Confident	169 Å²	169	87.3 Å²	87.3	79%	0.79	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-81.7	130.1	168.7	-64	-176.4	170.8	0	0	108.1
198	T	72.9	Confident	84.1	Confident	36 Å²	36	87.5 Å²	87.5	22%	0.221	42%	0.42	C	S	.	.			trans	-107.9	155.8	179.8	54.3	0	0	0	0	109.8	D200 E203 N204	T198-D200 PolarHBondContact O-N 3.49Å; T198-D200 PolarHBondContact OG1-O 2.94Å; T198-E203 HydrophobicContact CG2-CG 4.29Å; T198-N204 PolarHBondContact N-OD1 2.99Å; T198-N204 VanDerWaalsContact N-OD1 3.08Å; T198-N204 PolarHBondContact O-ND2 2.89Å; T198-N204 PolarHBondContact O-OD1 3.24Å; T198-N204 PolarHBondContact OG1-OD1 3.31Å
199	D	76.1	Confident	83.5	Confident	180 Å²	180	91.6 Å²	91.6	96%	0.963	44%	0.437	S	S	*	.	S	Bend	trans	-70.7	-12.2	174.4	-64.4	-34.2	0	0	0	112.5
200	D	82.3	Confident	83	Confident	85 Å²	85	84 Å²	84	46%	0.455	40%	0.404	S	S	.	.			trans	-82.3	114.4	175	-169.5	-26.9	0	0	0	111.5	T198 E202 E203 N204	T198-D200 PolarHBondContact O-N 3.49Å; T198-D200 PolarHBondContact OG1-O 2.94Å; D200-E202 VanDerWaalsContact C-N 3.32Å; D200-E202 PolarHBondContact O-N 3.15Å; D200-E202 WeakPolarHBondContact OD1-CB 3.37Å; D200-E202 PolarHBondContact OD1-N 3.06Å; D200-E203 HydrophobicContact CB-CB 3.92Å; D200-E203 PolarHBondContact O-N 3.47Å; D200-E203 PolarHBondContact OD1-N 3.11Å; D200-N204 WeakPolarHBondContact O-CB 3.34Å; D200-N204 PolarHBondContact O-N 3.44Å
201	E	83.3	Confident	82.6	Confident	131 Å²	131	87 Å²	87	61%	0.612	42%	0.417	S	S	*	.	H	α-helix	trans	-62	-31.6	176.3	-81.7	-75.2	170.1	0	0	113.9	K205	E201-K205 VanDerWaalsContact O-CG 3.29Å; E201-K205 WeakPolarHBondContact O-CG 3.34Å; E201-K205 PolarHBondContact O-N 2.98Å; E201-K205 VanDerWaalsContact O-N 3.14Å
202	E	81.4	Confident	82.3	Confident	151 Å²	151	86 Å²	86	71%	0.706	42%	0.418	S	S	*	.	H	α-helix	trans	-74	-40.1	176.9	-64.6	-141.4	134.8	0	0	111.5	D200 K205 L206	D200-E202 VanDerWaalsContact C-N 3.32Å; D200-E202 PolarHBondContact O-N 3.15Å; D200-E202 WeakPolarHBondContact OD1-CB 3.37Å; D200-E202 PolarHBondContact OD1-N 3.06Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 3.42Å; E202-L206 PolarHBondContact O-N 3.46Å; E202-L206 VanDerWaalsContact O-N 3.13Å
203	E	77.3	Confident	82.1	Confident	75 Å²	75	90 Å²	90	35%	0.35	43%	0.432	S	S	.	.	H	α-helix	trans	-65.8	-43	175.2	-170.7	165.2	-157.2	0	0	110.9	T198 D200 K205 L206 V207	T198-E203 HydrophobicContact CG2-CG 4.29Å; D200-E203 HydrophobicContact CB-CB 3.92Å; D200-E203 PolarHBondContact O-N 3.47Å; D200-E203 PolarHBondContact OD1-N 3.11Å; E203-K205 VanDerWaalsContact C-N 3.3Å; E203-K205 PolarHBondContact O-N 3.47Å; E203-L206 WeakPolarHBondContact O-CA 3.49Å; E203-L206 WeakPolarHBondContact O-CB 3.48Å; E203-L206 PolarHBondContact O-N 3.49Å; E203-V207 WeakPolarHBondContact O-CG2 3.4Å; E203-V207 PolarHBondContact O-N 2.96Å
204	N	81.3	Confident	82	Confident	45 Å²	45	90.5 Å²	90.5	24%	0.241	44%	0.435	C	S	.	.	H	α-helix	trans	-59.8	-37.4	173.5	-82.1	-23.9	0	0	0	113	T198 D200 L206 V207 K208	T198-N204 PolarHBondContact N-OD1 2.99Å; T198-N204 VanDerWaalsContact N-OD1 3.08Å; T198-N204 PolarHBondContact O-ND2 2.89Å; T198-N204 PolarHBondContact O-OD1 3.24Å; T198-N204 PolarHBondContact OG1-OD1 3.31Å; D200-N204 WeakPolarHBondContact O-CB 3.34Å; D200-N204 PolarHBondContact O-N 3.44Å; N204-L206 VanDerWaalsContact C-N 3.33Å; N204-V207 PolarHBondContact O-N 3.49Å; N204-K208 WeakPolarHBondContact O-CB 3.4Å; N204-K208 PolarHBondContact O-N 3.04Å
205	K	83.1	Confident	82.4	Confident	123 Å²	123	83.7 Å²	83.7	54%	0.535	40%	0.403	S	S	.	.	H	α-helix	trans	-64.5	-38.3	173.6	-77.2	169	-171.1	165.5	0	111.9	E201 E202 E203 K209	E201-K205 VanDerWaalsContact O-CG 3.29Å; E201-K205 WeakPolarHBondContact O-CG 3.34Å; E201-K205 PolarHBondContact O-N 2.98Å; E201-K205 VanDerWaalsContact O-N 3.14Å; E202-K205 WeakPolarHBondContact O-CB 3.41Å; E202-K205 PolarHBondContact O-N 3.42Å; E203-K205 VanDerWaalsContact C-N 3.3Å; E203-K205 PolarHBondContact O-N 3.47Å; K205-K209 WeakPolarHBondContact O-CG 3.48Å; K205-K209 PolarHBondContact O-N 3.49Å
206	L	78.7	Confident	83	Confident	91 Å²	91	83.4 Å²	83.4	48%	0.476	40%	0.402	S	S	.	.	H	α-helix	trans	-67.1	-47	175.8	-176	65.2	0	0	0	110.7	E202 E203 N204 K208 K209 I210	E202-L206 PolarHBondContact O-N 3.46Å; E202-L206 VanDerWaalsContact O-N 3.13Å; E203-L206 WeakPolarHBondContact O-CA 3.49Å; E203-L206 WeakPolarHBondContact O-CB 3.48Å; E203-L206 PolarHBondContact O-N 3.49Å; N204-L206 VanDerWaalsContact C-N 3.33Å; L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 3.36Å; L206-K209 WeakPolarHBondContact O-CB 3.34Å; L206-K209 PolarHBondContact O-N 3.41Å; L206-I210 HydrophobicContact CG-CD1 4.44Å; L206-I210 WeakPolarHBondContact O-CG1 3.32Å; L206-I210 PolarHBondContact O-N 2.89Å; L206-I210 VanDerWaalsContact O-N 3.13Å
207	V	83	Confident	83.7	Confident	6 Å²	6	81.3 Å²	81.3	4%	0.036	39%	0.389	C	S	.	.	H	α-helix	trans	-56.5	-45.8	176.2	165.9	0	0	0	0	111.1	F195 E203 N204 K209 I210 K211	F195-V207 HydrophobicContact CB-CB 4.38Å; F195-V207 HydrophobicContact CB-CG1 3.35Å; F195-V207 HydrophobicContact CB-CG2 4.2Å; F195-V207 HydrophobicContact CD2-CG1 4.31Å; F195-V207 HydrophobicContact CG-CG1 3.93Å; E203-V207 WeakPolarHBondContact O-CG2 3.4Å; E203-V207 PolarHBondContact O-N 2.96Å; N204-V207 PolarHBondContact O-N 3.49Å; V207-K209 VanDerWaalsContact C-N 3.34Å; V207-K209 PolarHBondContact O-N 3.3Å; V207-I210 PolarHBondContact O-N 3.34Å; V207-K211 HydrophobicContact CG1-CD 4.09Å; V207-K211 HydrophobicContact CG1-CG 4.3Å; V207-K211 WeakPolarHBondContact O-CG 3.33Å; V207-K211 PolarHBondContact O-N 3.21Å
208	K	84.6	Confident	84.6	Confident	138 Å²	138	73.4 Å²	73.4	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-59.7	-43.2	177.8	-170.4	172.9	-177.4	174.3	0	112.1	N204 L206 I210 K211 D212	N204-K208 WeakPolarHBondContact O-CB 3.4Å; N204-K208 PolarHBondContact O-N 3.04Å; L206-K208 VanDerWaalsContact C-N 3.31Å; L206-K208 PolarHBondContact O-N 3.36Å; K208-I210 PolarHBondContact O-N 2.95Å; K208-K211 PolarHBondContact O-N 2.97Å; K208-D212 VanDerWaalsContact O-CG 3.23Å; K208-D212 PolarHBondContact O-N 3.07Å
209	K	83.2	Confident	85.6	Confident	144 Å²	144	71.9 Å²	71.9	63%	0.626	34%	0.343	S	S	*	.	H	α-helix	trans	-60.2	-35	174.8	-73.8	175.4	179.7	177.3	0	112.6	K205 L206 V207 R213	K205-K209 WeakPolarHBondContact O-CG 3.48Å; K205-K209 PolarHBondContact O-N 3.49Å; L206-K209 WeakPolarHBondContact O-CB 3.34Å; L206-K209 PolarHBondContact O-N 3.41Å; V207-K209 VanDerWaalsContact C-N 3.34Å; V207-K209 PolarHBondContact O-N 3.3Å; K209-R213 WeakPolarHBondContact O-CG 3.48Å
210	I	84.6	Confident	86.2	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-73.9	-45.1	177.1	-57.5	168.7	0	0	0	110.2	F195 L206 V207 K208 D212 R213 L214 I254	F195-I210 HydrophobicContact CE1-CD1 4.47Å; F195-I210 HydrophobicContact CE1-CG2 4.14Å; F195-I210 HydrophobicContact CE2-CB 4.16Å; F195-I210 HydrophobicContact CE2-CG2 3.6Å; F195-I210 HydrophobicContact CZ-CB 4.08Å; F195-I210 HydrophobicContact CZ-CG2 3.27Å; L206-I210 HydrophobicContact CG-CD1 4.44Å; L206-I210 WeakPolarHBondContact O-CG1 3.32Å; L206-I210 PolarHBondContact O-N 2.89Å; L206-I210 VanDerWaalsContact O-N 3.13Å; V207-I210 PolarHBondContact O-N 3.34Å; K208-I210 PolarHBondContact O-N 2.95Å; I210-D212 VanDerWaalsContact C-N 3.29Å; I210-D212 PolarHBondContact O-N 3.49Å; I210-R213 PolarHBondContact O-N 2.94Å; I210-L214 PolarHBondContact O-N 3.05Å; I210-I254 HydrophobicContact CB-CG2 4.43Å; I210-I254 HydrophobicContact CG1-CG2 3.97Å; I210-I254 HydrophobicContact CG2-CG2 3.81Å
211	K	85.8	Confident	86.5	Confident	71 Å²	71	60.4 Å²	60.4	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-54.7	-44.5	175.9	-73.6	-176.6	-178.6	-179.5	0	111.4	F195 V207 K208 R213 L214	F195-K211 HydrophobicContact CD2-CD 4.49Å; F195-K211 HydrophobicContact CD2-CG 3.7Å; F195-K211 HydrophobicContact CE2-CG 4.28Å; F195-K211 PolarHBondContact O-NZ 3.34Å; F195-K211 VanDerWaalsContact O-NZ 3.08Å; V207-K211 HydrophobicContact CG1-CD 4.09Å; V207-K211 HydrophobicContact CG1-CG 4.3Å; V207-K211 WeakPolarHBondContact O-CG 3.33Å; V207-K211 PolarHBondContact O-N 3.21Å; K208-K211 PolarHBondContact O-N 2.97Å; K211-R213 PolarHBondContact O-N 3.45Å; K211-L214 WeakPolarHBondContact O-CB 3.37Å; K211-L214 PolarHBondContact O-N 3.15Å
212	D	86.9	Confident	86.5	Confident	121 Å²	121	57.8 Å²	57.8	65%	0.647	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.8	179.2	-68	-18.9	0	0	0	113.6	K208 I210	K208-D212 VanDerWaalsContact O-CG 3.23Å; K208-D212 PolarHBondContact O-N 3.07Å; I210-D212 VanDerWaalsContact C-N 3.29Å; I210-D212 PolarHBondContact O-N 3.49Å
213	R	87.1	Confident	86.6	Confident	103 Å²	103	54.7 Å²	54.7	39%	0.389	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.5	178.2	-70.7	-147.5	-172.8	-164.3	-2.4	114.3	K178 K209 I210 K211 P215 L216 G247 D251	K178-R213 PolarHBondContact NZ-O 3.18Å; K209-R213 WeakPolarHBondContact O-CG 3.48Å; I210-R213 PolarHBondContact O-N 2.94Å; K211-R213 PolarHBondContact O-N 3.45Å; R213-P215 CarbonylContact O-C 3.55Å; R213-P215 VanDerWaalsContact O-C 3.31Å; R213-L216 HydrophobicContact CB-CD2 4.21Å; R213-G247 PolarHBondContact NH1-O 3.43Å; R213-D251 WeakPolarHBondContact CD-OD1 3.41Å; R213-D251 IonicContact CZ-OD1 3.48Å; R213-D251 IonicContact NE-OD1 3.83Å; R213-D251 IonicContact NH1-OD1 2.78Å; R213-D251 PolarHBondContact NH1-OD1 3.49Å
214	L	90.1	Very high	87	Confident	21 Å²	21	55.4 Å²	55.4	11%	0.11	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-69	143.9	177.4	-66.7	178.7	0	0	0	111.7	M182 I192 F195 I210 K211 L216	M182-L214 WeakPolarHBondContact CG-O 3.39Å; M182-L214 HydrophobicContact SD-CB 4.23Å; I192-L214 HydrophobicContact CD1-CD1 4.21Å; F195-L214 HydrophobicContact CE2-CD1 4.25Å; I210-L214 PolarHBondContact O-N 3.05Å; K211-L214 WeakPolarHBondContact O-CB 3.37Å; K211-L214 PolarHBondContact O-N 3.15Å; L214-L216 HydrophobicContact CD2-CD2 4.15Å; L214-L216 HydrophobicContact CD2-CG 3.93Å
215	P	92.6	Very high	87.4	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.266	C	S	.	.	S	Bend	cis	-67.7	145.6	-12.2	30.3	-37.1	0	0	0	112.2	P161 I163 K178 I181 R213 A217	P161-P215 HydrophobicContact CB-CB 4.02Å; P161-P215 HydrophobicContact CG-CB 4.02Å; I163-P215 HydrophobicContact CD1-CG 3.82Å; I163-P215 HydrophobicContact CG1-CB 4.38Å; I163-P215 HydrophobicContact CG1-CG 4.06Å; K178-P215 HydrophobicContact CB-CG 4.44Å; K178-P215 WeakPolarHBondContact CE-O 3.12Å; K178-P215 HydrophobicContact CG-CG 4.11Å; K178-P215 PolarHBondContact NZ-O 3.38Å; I181-P215 HydrophobicContact CB-CG 4.06Å; I181-P215 HydrophobicContact CD1-CG 3.88Å; I181-P215 HydrophobicContact CG2-CB 4.49Å; I181-P215 HydrophobicContact CG2-CG 3.86Å; R213-P215 CarbonylContact O-C 3.55Å; R213-P215 VanDerWaalsContact O-C 3.31Å; P215-A217 PolarHBondContact O-N 3.11Å
216	L	93.6	Very high	87.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.2	-175.8	-59.1	176.2	0	0	0	110.5	P161 L162 I163 R213 L214 V218 D251 I254 L255	P161-L216 PolarHBondContact O-N 2.97Å; L162-L216 CarbonylContact C-O 3.01Å; L162-L216 WeakPolarHBondContact CA-O 3.47Å; L162-L216 HydrophobicContact CD2-CB 3.85Å; L162-L216 HydrophobicContact CD2-CD1 4.26Å; L162-L216 HydrophobicContact CD2-CG 4.49Å; I163-L216 PolarHBondContact N-O 3.23Å; R213-L216 HydrophobicContact CB-CD2 4.21Å; L214-L216 HydrophobicContact CD2-CD2 4.15Å; L214-L216 HydrophobicContact CD2-CG 3.93Å; L216-V218 HydrophobicContact CB-CG1 4.37Å; L216-D251 HydrophobicContact CB-CB 4.1Å; L216-D251 HydrophobicContact CD2-CB 4.06Å; L216-I254 HydrophobicContact CD1-CG2 4.47Å; L216-I254 HydrophobicContact CD2-CG2 4.01Å; L216-L255 HydrophobicContact CD1-CB 3.94Å; L216-L255 HydrophobicContact CD1-CD1 3.96Å
217	A	94.8	Very high	88.1	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.033	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	113	179.2	0	0	0	0	0	109.8	I163 A166 P215 C250 D251	I163-A217 HydrophobicContact CB-CB 4.29Å; I163-A217 HydrophobicContact CD1-CB 4.42Å; A166-A217 HydrophobicContact CB-CB 3.68Å; P215-A217 PolarHBondContact O-N 3.11Å; A217-C250 WeakPolarHBondContact O-CB 3.3Å; A217-D251 PolarHBondContact N-OD2 3.06Å; A217-D251 PolarHBondContact O-N 2.88Å
218	V	94.4	Very high	88.2	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.018	30%	0.297	C	S	.	.			trans	-119.6	145.7	-168.4	-62.1	0	0	0	0	113.2	L36 L162 I163 K165 A166 L216 L255	L36-V218 HydrophobicContact CD1-CB 4.03Å; L36-V218 HydrophobicContact CD1-CG2 4.02Å; L36-V218 HydrophobicContact CD2-CG2 3.99Å; L162-V218 HydrophobicContact CB-CG2 4.26Å; L162-V218 HydrophobicContact CD2-CG1 4.48Å; I163-V218 PolarHBondContact O-N 3.41Å; K165-V218 PolarHBondContact N-O 2.97Å; A166-V218 PolarHBondContact N-O 3.49Å; A166-V218 VanDerWaalsContact N-O 3.12Å; L216-V218 HydrophobicContact CB-CG1 4.37Å; V218-L255 HydrophobicContact CG1-CB 4.4Å; V218-L255 HydrophobicContact CG1-CD2 3.93Å
219	V	93.3	Very high	88.3	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.03	30%	0.297	C	S	.	.			trans	-121.8	134.5	171.5	-176.6	0	0	0	0	107.5	A166 D167 R235 V244 C250	A166-V219 HydrophobicContact CB-CG2 4.01Å; D167-V219 HydrophobicContact CB-CG1 4.43Å; D167-V219 HydrophobicContact CB-CG2 3.88Å; V219-R235 HydrophobicContact CG1-CG 4.25Å; V219-V244 HydrophobicContact CB-CG2 4.49Å; V219-V244 HydrophobicContact CG1-CG2 4.19Å; V219-V244 WeakPolarHBondContact O-CG1 3.46Å; V219-C250 HydrophobicContact CB-CB 4.27Å; V219-C250 HydrophobicContact CG2-CB 3.83Å
220	G	89.3	Confident	88.5	Confident	17 Å²	17	56.2 Å²	56.2	18%	0.175	30%	0.3	C	S	.	.			trans	-111.3	140.6	174.3	0	0	0	0	0	110.7
221	S	88.1	Confident	88.7	Confident	7 Å²	7	64.7 Å²	64.7	5%	0.049	33%	0.331	C	S	.	.			trans	-153.1	135.4	171.4	-171.7	0	0	0	0	111.7	S39 T223 G234	S39-S221 PolarHBondContact OG-N 2.96Å; S39-S221 PolarHBondContact OG-O 2.87Å; S39-S221 VanDerWaalsContact OG-O 3.05Å; S221-T223 PolarHBondContact OG-N 3.37Å; S221-T223 VanDerWaalsContact OG-N 3.16Å; S221-G234 WeakPolarHBondContact CB-O 3.38Å; S221-G234 PolarHBondContact OG-O 2.81Å
222	N	82.7	Confident	88.8	Confident	75 Å²	75	62.8 Å²	62.8	40%	0.401	33%	0.325	S	S	.	.			trans	-94.6	-4.6	172.2	-61.1	-6.3	0	0	0	111.8	T35 N38	T35-N222 PolarHBondContact O-OD1 2.91Å; N38-N222 WeakPolarHBondContact CB-OD1 3.36Å; N38-N222 PolarHBondContact ND2-ND2 2.94Å
223	T	84.2	Confident	88.9	Confident	87 Å²	87	58.9 Å²	58.9	53%	0.534	30%	0.301	S	S	.	.			trans	-92.4	132.2	-176.7	-50.4	0	0	0	0	110.5	S221 I225 R233 G234	S221-T223 PolarHBondContact OG-N 3.37Å; S221-T223 VanDerWaalsContact OG-N 3.16Å; T223-I225 HydrophobicContact CG2-CG2 4.06Å; T223-R233 WeakPolarHBondContact O-CA 3.48Å; T223-G234 PolarHBondContact O-N 2.93Å; T223-G234 VanDerWaalsContact O-N 3.14Å
224	I	86.4	Confident	89	Confident	89 Å²	89	54 Å²	54	46%	0.456	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.3	171.9	-59.8	170	0	0	0	108.1	R231 V232 R233	I224-R231 HydrophobicContact CG2-CB 3.82Å; I224-R231 HydrophobicContact CG2-CG 4.49Å; I224-V232 WeakPolarHBondContact CA-O 3.5Å; I224-R233 HydrophobicContact CG1-CG 3.77Å
225	I	89.1	Confident	89.1	Confident	19 Å²	19	56.8 Å²	56.8	10%	0.097	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	153.2	-179.6	54.3	-171.2	0	0	0	109.7	T223 V227 R231 V232 Q236 V241	T223-I225 HydrophobicContact CG2-CG2 4.06Å; I225-V227 HydrophobicContact CG1-CG2 4.37Å; I225-R231 WeakPolarHBondContact O-CA 3.39Å; I225-V232 HydrophobicContact CG1-CG2 4.24Å; I225-V232 WeakPolarHBondContact CG1-O 3.29Å; I225-V232 PolarHBondContact N-O 2.87Å; I225-V232 PolarHBondContact O-N 2.8Å; I225-V232 VanDerWaalsContact O-O 3.08Å; I225-Q236 HydrophobicContact CD1-CB 4.43Å; I225-V241 HydrophobicContact CD1-CB 4.24Å; I225-V241 HydrophobicContact CD1-CG1 3.16Å; I225-V241 HydrophobicContact CD1-CG2 4.08Å; I225-V241 HydrophobicContact CG1-CG1 4.16Å
226	E	89.3	Confident	89	Confident	145 Å²	145	63.8 Å²	63.8	68%	0.678	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.7	179.4	-167	174.6	165.8	0	0	109.8	K230	E226-K230 WeakPolarHBondContact CA-O 3.4Å
227	V	86.5	Confident	88.9	Confident	27 Å²	27	66.5 Å²	66.5	16%	0.164	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.2	177.3	-176.3	0	0	0	0	107.4	I225 G229 K230 V232 V241	I225-V227 HydrophobicContact CG1-CG2 4.37Å; V227-G229 PolarHBondContact O-N 3.2Å; V227-K230 PolarHBondContact N-O 3.24Å; V227-K230 PolarHBondContact O-N 3.17Å; V227-V232 HydrophobicContact CB-CG2 3.99Å; V227-V232 HydrophobicContact CG2-CG2 3.66Å; V227-V241 HydrophobicContact CG2-CB 4.22Å; V227-V241 HydrophobicContact CG2-CG1 3.77Å; V227-V241 HydrophobicContact CG2-CG2 4.29Å
228	N	85.4	Confident	88.8	Confident	160 Å²	160	72.5 Å²	72.5	86%	0.856	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	40	-179.9	-58	-35.2	0	0	0	113.7	K230	N228-K230 PolarHBondContact O-N 3.41Å
229	G	86.3	Confident	88.7	Confident	59 Å²	59	82.3 Å²	82.3	61%	0.608	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	4.1	-178.7	0	0	0	0	0	115	V227	V227-G229 PolarHBondContact O-N 3.2Å
230	K	88.4	Confident	88.6	Confident	155 Å²	155	83.6 Å²	83.6	67%	0.674	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.8	174.8	-66.3	-177.3	-177	176.2	0	110.1	E226 V227 N228 V232	E226-K230 WeakPolarHBondContact CA-O 3.4Å; V227-K230 PolarHBondContact N-O 3.24Å; V227-K230 PolarHBondContact O-N 3.17Å; N228-K230 PolarHBondContact O-N 3.41Å; K230-V232 HydrophobicContact CB-CG1 4.36Å; K230-V232 PolarHBondContact O-N 3.05Å
231	R	88	Confident	88.7	Confident	191 Å²	191	85 Å²	85	72%	0.721	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	111.8	173.1	-66.4	-177.5	70.2	-163.8	1.3	109.1	I224 I225	I224-R231 HydrophobicContact CG2-CB 3.82Å; I224-R231 HydrophobicContact CG2-CG 4.49Å; I225-R231 WeakPolarHBondContact O-CA 3.39Å
232	V	88.5	Confident	88.9	Confident	30 Å²	30	85.4 Å²	85.4	18%	0.182	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.8	-178.2	-64.7	0	0	0	0	110	I224 I225 V227 K230 E243	I224-V232 WeakPolarHBondContact CA-O 3.5Å; I225-V232 HydrophobicContact CG1-CG2 4.24Å; I225-V232 WeakPolarHBondContact CG1-O 3.29Å; I225-V232 PolarHBondContact N-O 2.87Å; I225-V232 PolarHBondContact O-N 2.8Å; I225-V232 VanDerWaalsContact O-O 3.08Å; V227-V232 HydrophobicContact CB-CG2 3.99Å; V227-V232 HydrophobicContact CG2-CG2 3.66Å; K230-V232 HydrophobicContact CB-CG1 4.36Å; K230-V232 PolarHBondContact O-N 3.05Å; V232-E243 HydrophobicContact CG2-CG 4.01Å
233	R	88.6	Confident	89.3	Confident	40 Å²	40	83.8 Å²	83.8	15%	0.151	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	129.5	170.7	-85.3	179.6	-81.8	127.9	12	109.4	S39 T223 I224 V244 E245	S39-R233 PolarHBondContact O-NH1 2.83Å; S39-R233 VanDerWaalsContact O-NH1 3.08Å; T223-R233 WeakPolarHBondContact O-CA 3.48Å; I224-R233 HydrophobicContact CG1-CG 3.77Å; R233-V244 PolarHBondContact O-N 2.96Å; R233-E245 IonicContact CZ-OE1 3.52Å; R233-E245 IonicContact NH1-OE1 3.98Å; R233-E245 VanDerWaalsContact NH2-CD 3.32Å; R233-E245 IonicContact NH2-OE1 3.22Å; R233-E245 PolarHBondContact NH2-OE1 3.4Å; R233-E245 IonicContact NH2-OE2 3.38Å
234	G	89.9	Confident	89.7	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	173.3	-174.8	0	0	0	0	0	113.5	S221 T223 A242	S221-G234 WeakPolarHBondContact CB-O 3.38Å; S221-G234 PolarHBondContact OG-O 2.81Å; T223-G234 PolarHBondContact O-N 2.93Å; T223-G234 VanDerWaalsContact O-N 3.14Å; G234-A242 CarbonylContact C-O 3.59Å; G234-A242 WeakPolarHBondContact CA-O 3.39Å
235	R	91.1	Very high	89.8	Confident	79 Å²	79	79.3 Å²	79.3	30%	0.298	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.7	173.9	-59.1	-179.4	69.3	-170.7	1	108.2	D167 V219 Y237 A242	D167-R235 VanDerWaalsContact CG-NH1 3.35Å; D167-R235 IonicContact OD1-NH1 3.13Å; D167-R235 PolarHBondContact OD1-NH1 3.44Å; D167-R235 VanDerWaalsContact OD1-NH1 3.13Å; D167-R235 WeakPolarHBondContact OD2-CD 3.42Å; D167-R235 IonicContact OD2-CZ 3.3Å; D167-R235 VanDerWaalsContact OD2-CZ 3.3Å; D167-R235 IonicContact OD2-NE 3.42Å; D167-R235 IonicContact OD2-NH1 2.74Å; D167-R235 PolarHBondContact OD2-NH1 3.4Å; V219-R235 HydrophobicContact CG1-CG 4.25Å; R235-Y237 HydrophobicContact CB-CE2 3.92Å; R235-Y237 PolarHBondContact NE-OH 3.13Å; R235-Y237 PolarHBondContact NH1-OH 3.32Å; R235-Y237 PolarHBondContact NH2-OH 3.31Å; R235-A242 HydrophobicContact CB-CB 4.42Å; R235-A242 PolarHBondContact N-O 2.85Å; R235-A242 PolarHBondContact O-N 2.88Å
236	Q	91.3	Very high	89.8	Confident	148 Å²	148	80.2 Å²	80.2	69%	0.692	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.5	179.4	-173.5	171.9	14.9	0	0	110.1	I225 V241	I225-Q236 HydrophobicContact CD1-CB 4.43Å; Q236-V241 HydrophobicContact CG-CG2 4.29Å
237	Y	92.4	Very high	89.8	Confident	57 Å²	57	74.7 Å²	74.7	22%	0.224	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	160.8	174.1	-63.1	-72.9	0	0	0	109.9	D167 R235 W239 G240 A242	D167-Y237 PolarHBondContact OD2-OH 3.02Å; R235-Y237 HydrophobicContact CB-CE2 3.92Å; R235-Y237 PolarHBondContact NE-OH 3.13Å; R235-Y237 PolarHBondContact NH1-OH 3.32Å; R235-Y237 PolarHBondContact NH2-OH 3.31Å; Y237-W239 AromaticContact CD1-CH2 3.93Å; Y237-W239 HydrophobicContact CD1-CH2 3.93Å; Y237-W239 AromaticContact CD1-CZ2 3.64Å; Y237-W239 HydrophobicContact CD1-CZ2 3.64Å; Y237-W239 HydrophobicContact CD2-CZ2 4.37Å; Y237-W239 HydrophobicContact CE1-CZ2 4.33Å; Y237-W239 AromaticContact CG-CE2 3.84Å; Y237-W239 HydrophobicContact CG-CH2 4.29Å; Y237-W239 AromaticContact CG-CZ2 3.66Å; Y237-W239 HydrophobicContact CG-CZ2 3.66Å; Y237-W239 PolarHBondContact O-N 3.14Å; Y237-G240 CarbonylContact C-O 3.56Å; Y237-G240 WeakPolarHBondContact CA-O 3.28Å; Y237-G240 WeakPolarHBondContact CB-O 3.37Å; Y237-G240 PolarHBondContact N-O 2.87Å; Y237-G240 PolarHBondContact O-N 2.77Å; Y237-A242 HydrophobicContact CE2-CB 4.24Å
238	P	92.7	Very high	90	Very high	129 Å²	129	81.9 Å²	81.9	84%	0.838	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.2	175.2	-26.2	35.3	0	0	0	113.9
239	W	90.9	Very high	90.2	Very high	209 Å²	209	78.4 Å²	78.4	79%	0.792	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-5.7	-177.9	55.5	85.1	0	0	0	114.4	Y237	Y237-W239 AromaticContact CD1-CH2 3.93Å; Y237-W239 HydrophobicContact CD1-CH2 3.93Å; Y237-W239 AromaticContact CD1-CZ2 3.64Å; Y237-W239 HydrophobicContact CD1-CZ2 3.64Å; Y237-W239 HydrophobicContact CD2-CZ2 4.37Å; Y237-W239 HydrophobicContact CE1-CZ2 4.33Å; Y237-W239 AromaticContact CG-CE2 3.84Å; Y237-W239 HydrophobicContact CG-CH2 4.29Å; Y237-W239 AromaticContact CG-CZ2 3.66Å; Y237-W239 HydrophobicContact CG-CZ2 3.66Å; Y237-W239 PolarHBondContact O-N 3.14Å
240	G	91	Very high	90.5	Very high	32 Å²	32	75.9 Å²	75.9	33%	0.33	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	160.4	-172.7	-178.1	0	0	0	0	0	114.4	Y237	Y237-G240 CarbonylContact C-O 3.56Å; Y237-G240 WeakPolarHBondContact CA-O 3.28Å; Y237-G240 WeakPolarHBondContact CB-O 3.37Å; Y237-G240 PolarHBondContact N-O 2.87Å; Y237-G240 PolarHBondContact O-N 2.77Å
241	V	91.4	Very high	90.7	Very high	46 Å²	46	68.9 Å²	68.9	28%	0.279	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.3	-175.5	170.1	0	0	0	0	110.3	I225 V227 Q236 E243	I225-V241 HydrophobicContact CD1-CB 4.24Å; I225-V241 HydrophobicContact CD1-CG1 3.16Å; I225-V241 HydrophobicContact CD1-CG2 4.08Å; I225-V241 HydrophobicContact CG1-CG1 4.16Å; V227-V241 HydrophobicContact CG2-CB 4.22Å; V227-V241 HydrophobicContact CG2-CG1 3.77Å; V227-V241 HydrophobicContact CG2-CG2 4.29Å; Q236-V241 HydrophobicContact CG-CG2 4.29Å; V241-E243 HydrophobicContact CG1-CG 4.1Å; V241-E243 PolarHBondContact O-N 2.82Å
242	A	91.9	Very high	90.9	Very high	17 Å²	17	59.8 Å²	59.8	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	96.1	171.2	0	0	0	0	0	109.8	D167 G234 R235 Y237	D167-A242 HydrophobicContact CB-CB 4.21Å; G234-A242 CarbonylContact C-O 3.59Å; G234-A242 WeakPolarHBondContact CA-O 3.39Å; R235-A242 HydrophobicContact CB-CB 4.42Å; R235-A242 PolarHBondContact N-O 2.85Å; R235-A242 PolarHBondContact O-N 2.88Å; Y237-A242 HydrophobicContact CE2-CB 4.24Å
243	E	92.3	Very high	91	Very high	41 Å²	41	60.3 Å²	60.3	19%	0.192	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.7	174.3	-58.1	178	-158.5	0	0	112	V232 V241 N246 H249	V232-E243 HydrophobicContact CG2-CG 4.01Å; V241-E243 HydrophobicContact CG1-CG 4.1Å; V241-E243 PolarHBondContact O-N 2.82Å; E243-N246 HydrophobicContact CB-CB 3.67Å; E243-N246 PolarHBondContact OE2-ND2 2.8Å; E243-H249 PolarHBondContact N-ND1 2.78Å; E243-H249 VanDerWaalsContact N-ND1 3.13Å; E243-H249 WeakPolarHBondContact O-CB 3.47Å
244	V	91.4	Very high	91.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-75.4	-36.9	-177.6	170.2	0	0	0	0	111.9	V219 R233 N246 C250 F252	V219-V244 HydrophobicContact CB-CG2 4.49Å; V219-V244 HydrophobicContact CG1-CG2 4.19Å; V219-V244 WeakPolarHBondContact O-CG1 3.46Å; R233-V244 PolarHBondContact O-N 2.96Å; V244-N246 VanDerWaalsContact C-N 3.29Å; V244-N246 PolarHBondContact O-N 3.01Å; V244-C250 PolarHBondContact O-SG 3.22Å; V244-F252 HydrophobicContact CG1-CB 4.03Å; V244-F252 HydrophobicContact CG1-CD1 3.5Å; V244-F252 VanDerWaalsContact CG1-CD1 3.5Å; V244-F252 HydrophobicContact CG1-CD2 3.84Å; V244-F252 HydrophobicContact CG1-CE1 3.87Å; V244-F252 HydrophobicContact CG1-CE2 4.18Å; V244-F252 HydrophobicContact CG1-CG 3.49Å; V244-F252 VanDerWaalsContact CG1-CG 3.49Å; V244-F252 HydrophobicContact CG1-CZ 4.2Å; V244-F252 WeakPolarHBondContact O-CB 3.46Å
245	E	88.9	Confident	91.1	Very high	81 Å²	81	60.1 Å²	60.1	38%	0.379	31%	0.306	S	S	.	.	S	Bend	trans	-89.8	5.6	-177.1	-65	-174.9	145.2	0	0	113.3	R233 F252 T253 R256	R233-E245 IonicContact CZ-OE1 3.52Å; R233-E245 IonicContact NH1-OE1 3.98Å; R233-E245 VanDerWaalsContact NH2-CD 3.32Å; R233-E245 IonicContact NH2-OE1 3.22Å; R233-E245 PolarHBondContact NH2-OE1 3.4Å; R233-E245 IonicContact NH2-OE2 3.38Å; E245-F252 HydrophobicContact CG-CD1 4.35Å; E245-F252 HydrophobicContact CG-CE1 4.35Å; E245-T253 HydrophobicContact CB-CG2 4.21Å; E245-T253 WeakPolarHBondContact O-CG2 3.47Å; E245-R256 IonicContact OE1-NH1 2.78Å; E245-R256 PolarHBondContact OE1-NH1 3.37Å
246	N	90.4	Very high	90.9	Very high	38 Å²	38	57.8 Å²	57.8	20%	0.203	30%	0.297	C	S	.	.			trans	-91.7	117.4	177.9	-171.3	-23.2	0	0	0	110.9	E243 V244 E248 H249 C250	E243-N246 HydrophobicContact CB-CB 3.67Å; E243-N246 PolarHBondContact OE2-ND2 2.8Å; V244-N246 VanDerWaalsContact C-N 3.29Å; V244-N246 PolarHBondContact O-N 3.01Å; N246-E248 PolarHBondContact O-N 3.36Å; N246-E248 WeakPolarHBondContact OD1-CB 3.31Å; N246-E248 PolarHBondContact OD1-N 2.86Å; N246-H249 HydrophobicContact CB-CB 4.29Å; N246-H249 PolarHBondContact O-N 2.77Å; N246-C250 PolarHBondContact O-N 2.8Å
247	G	88.9	Confident	90.6	Very high	30 Å²	30	53.7 Å²	53.7	31%	0.309	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.8	-177.2	0	0	0	0	0	115.6	R213 C250	R213-G247 PolarHBondContact NH1-O 3.43Å; G247-C250 WeakPolarHBondContact CA-O 3.38Å
248	E	89.3	Confident	90.2	Very high	178 Å²	178	51.1 Å²	51.1	83%	0.832	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-25.2	170.2	-62.3	-175.9	171	0	0	111.8	N246	N246-E248 PolarHBondContact O-N 3.36Å; N246-E248 WeakPolarHBondContact OD1-CB 3.31Å; N246-E248 PolarHBondContact OD1-N 2.86Å
249	H	89.8	Confident	89.7	Confident	87 Å²	87	45.4 Å²	45.4	40%	0.403	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-41.1	179.2	-65.3	176.6	0	0	0	112.5	E243 N246	E243-H249 PolarHBondContact N-ND1 2.78Å; E243-H249 VanDerWaalsContact N-ND1 3.13Å; E243-H249 WeakPolarHBondContact O-CB 3.47Å; N246-H249 HydrophobicContact CB-CB 4.29Å; N246-H249 PolarHBondContact O-N 2.77Å
250	C	93.1	Very high	89.1	Confident	6 Å²	6	36.3 Å²	36.3	4%	0.041	20%	0.199	C	C	.	.			trans	-157.9	166.6	178.2	73.2	0	0	0	0	113.2	A217 V219 V244 N246 G247 F252	A217-C250 WeakPolarHBondContact O-CB 3.3Å; V219-C250 HydrophobicContact CB-CB 4.27Å; V219-C250 HydrophobicContact CG2-CB 3.83Å; V244-C250 PolarHBondContact O-SG 3.22Å; N246-C250 PolarHBondContact O-N 2.8Å; G247-C250 WeakPolarHBondContact CA-O 3.38Å; C250-F252 VanDerWaalsContact C-N 3.28Å; C250-F252 PolarHBondContact O-N 3.22Å; C250-F252 VanDerWaalsContact SG-CB 3.6Å
251	D	93.8	Very high	88.4	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	21%	0.213	C	C	.	.	S	Bend	trans	-89.7	19.4	-177.8	-58.6	-49.5	0	0	0	113.3	K178 R213 L216 A217 T253 I254 L255	K178-D251 IonicContact NZ-OD2 2.69Å; K178-D251 PolarHBondContact NZ-OD2 3.18Å; R213-D251 WeakPolarHBondContact CD-OD1 3.41Å; R213-D251 IonicContact CZ-OD1 3.48Å; R213-D251 IonicContact NE-OD1 3.83Å; R213-D251 IonicContact NH1-OD1 2.78Å; R213-D251 PolarHBondContact NH1-OD1 3.49Å; L216-D251 HydrophobicContact CB-CB 4.1Å; L216-D251 HydrophobicContact CD2-CB 4.06Å; A217-D251 PolarHBondContact N-OD2 3.06Å; A217-D251 PolarHBondContact O-N 2.88Å; D251-T253 PolarHBondContact O-N 3.4Å; D251-I254 HydrophobicContact CB-CD1 4.32Å; D251-I254 WeakPolarHBondContact O-CB 3.48Å; D251-I254 PolarHBondContact O-N 3.3Å; D251-L255 PolarHBondContact O-N 2.79Å
252	F	92.4	Very high	87.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-41.5	-176	174.1	-92.7	0	0	0	113	L36 S39 L40 V244 E245 C250 I254 L255 R256	L36-F252 HydrophobicContact CD1-CD2 3.68Å; L36-F252 HydrophobicContact CD1-CE2 3.84Å; S39-F252 WeakPolarHBondContact O-CZ 3.43Å; L40-F252 HydrophobicContact CD2-CE2 4.21Å; L40-F252 HydrophobicContact CD2-CZ 4.37Å; L40-F252 HydrophobicContact CG-CE2 3.94Å; L40-F252 HydrophobicContact CG-CZ 4.29Å; V244-F252 HydrophobicContact CG1-CB 4.03Å; V244-F252 HydrophobicContact CG1-CD1 3.5Å; V244-F252 VanDerWaalsContact CG1-CD1 3.5Å; V244-F252 HydrophobicContact CG1-CD2 3.84Å; V244-F252 HydrophobicContact CG1-CE1 3.87Å; V244-F252 HydrophobicContact CG1-CE2 4.18Å; V244-F252 HydrophobicContact CG1-CG 3.49Å; V244-F252 VanDerWaalsContact CG1-CG 3.49Å; V244-F252 HydrophobicContact CG1-CZ 4.2Å; V244-F252 WeakPolarHBondContact O-CB 3.46Å; E245-F252 HydrophobicContact CG-CD1 4.35Å; E245-F252 HydrophobicContact CG-CE1 4.35Å; C250-F252 VanDerWaalsContact C-N 3.28Å; C250-F252 PolarHBondContact O-N 3.22Å; C250-F252 VanDerWaalsContact SG-CB 3.6Å; F252-I254 VanDerWaalsContact C-N 3.27Å; F252-I254 PolarHBondContact O-N 2.95Å; F252-L255 PolarHBondContact O-N 3.4Å; F252-R256 WeakPolarHBondContact O-CB 3.37Å; F252-R256 PolarHBondContact O-N 3.44Å
253	T	89.8	Confident	87.3	Confident	41 Å²	41	43.3 Å²	43.3	25%	0.252	22%	0.215	S	C	.	.	H	α-helix	trans	-63.3	-35.4	177.8	41	0	0	0	0	112.1	E245 D251 N257	E245-T253 HydrophobicContact CB-CG2 4.21Å; E245-T253 WeakPolarHBondContact O-CG2 3.47Å; D251-T253 PolarHBondContact O-N 3.4Å; T253-N257 WeakPolarHBondContact O-CB 3.27Å; T253-N257 PolarHBondContact O-N 2.89Å; T253-N257 PolarHBondContact O-ND2 3.37Å
254	I	90.5	Very high	86.8	Confident	36 Å²	36	43.2 Å²	43.2	19%	0.185	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-49.3	175.6	-60.9	173.8	0	0	0	109.6	I210 L216 D251 F252 R256 N257 M258	I210-I254 HydrophobicContact CB-CG2 4.43Å; I210-I254 HydrophobicContact CG1-CG2 3.97Å; I210-I254 HydrophobicContact CG2-CG2 3.81Å; L216-I254 HydrophobicContact CD1-CG2 4.47Å; L216-I254 HydrophobicContact CD2-CG2 4.01Å; D251-I254 HydrophobicContact CB-CD1 4.32Å; D251-I254 WeakPolarHBondContact O-CB 3.48Å; D251-I254 PolarHBondContact O-N 3.3Å; F252-I254 VanDerWaalsContact C-N 3.27Å; F252-I254 PolarHBondContact O-N 2.95Å; I254-R256 PolarHBondContact O-N 3.3Å; I254-N257 PolarHBondContact O-N 2.98Å; I254-M258 VanDerWaalsContact O-CB 3.23Å; I254-M258 WeakPolarHBondContact O-CB 3.32Å; I254-M258 PolarHBondContact O-N 3.44Å
255	L	90.1	Very high	86.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-56.7	-47.8	176.6	179.3	63.4	0	0	0	111.9	L36 L40 L132 I160 L162 L216 V218 D251 F252 M258 L259	L36-L255 HydrophobicContact CD2-CD2 3.93Å; L40-L255 HydrophobicContact CD1-CD2 4.37Å; L40-L255 HydrophobicContact CD2-CD2 4.49Å; L40-L255 HydrophobicContact CD2-CG 4.39Å; L132-L255 HydrophobicContact CD2-CD1 4.41Å; I160-L255 HydrophobicContact CG2-CD1 4.44Å; L162-L255 HydrophobicContact CD1-CD1 4.45Å; L162-L255 HydrophobicContact CD1-CD2 3.78Å; L162-L255 HydrophobicContact CD2-CD1 3.82Å; L162-L255 HydrophobicContact CD2-CD2 4.01Å; L162-L255 HydrophobicContact CD2-CG 4.48Å; L216-L255 HydrophobicContact CD1-CB 3.94Å; L216-L255 HydrophobicContact CD1-CD1 3.96Å; V218-L255 HydrophobicContact CG1-CB 4.4Å; V218-L255 HydrophobicContact CG1-CD2 3.93Å; D251-L255 PolarHBondContact O-N 2.79Å; F252-L255 PolarHBondContact O-N 3.4Å; L255-M258 PolarHBondContact O-N 2.93Å; L255-L259 HydrophobicContact CD1-CD1 3.57Å; L255-L259 HydrophobicContact CD1-CG 3.93Å; L255-L259 HydrophobicContact CG-CD1 3.83Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CB 3.32Å; L255-L259 WeakPolarHBondContact O-CG 3.44Å; L255-L259 PolarHBondContact O-N 3.39Å
256	R	87.1	Confident	86.4	Confident	30 Å²	30	45.8 Å²	45.8	11%	0.113	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-48.2	-179	-174.9	-179.8	171	-172.1	-3.6	111.8	L40 E72 E245 F252 I254 M258 L259 I260	L40-R256 HydrophobicContact CD2-CB 3.83Å; L40-R256 HydrophobicContact CD2-CG 4.14Å; E72-R256 IonicContact OE1-CZ 2.72Å; E72-R256 IonicContact OE1-NE 2.68Å; E72-R256 IonicContact OE1-NH2 2.71Å; E72-R256 PolarHBondContact OE1-NH2 3.36Å; E245-R256 IonicContact OE1-NH1 2.78Å; E245-R256 PolarHBondContact OE1-NH1 3.37Å; F252-R256 WeakPolarHBondContact O-CB 3.37Å; F252-R256 PolarHBondContact O-N 3.44Å; I254-R256 PolarHBondContact O-N 3.3Å; R256-M258 VanDerWaalsContact C-N 3.31Å; R256-M258 PolarHBondContact O-N 3.04Å; R256-L259 PolarHBondContact O-N 3.06Å; R256-I260 HydrophobicContact CG-CD1 3.87Å; R256-I260 WeakPolarHBondContact O-CB 3.26Å; R256-I260 PolarHBondContact O-N 3.37Å; R256-I260 VanDerWaalsContact O-N 3.08Å
257	N	84.8	Confident	86.4	Confident	63 Å²	63	44 Å²	44	34%	0.337	22%	0.219	S	C	.	.	I	π-helix	trans	-65.2	-37.7	179.8	-71.5	-21.4	0	0	0	111.8	T253 I254 R261 T262	T253-N257 WeakPolarHBondContact O-CB 3.27Å; T253-N257 PolarHBondContact O-N 2.89Å; T253-N257 PolarHBondContact O-ND2 3.37Å; I254-N257 PolarHBondContact O-N 2.98Å; N257-R261 WeakPolarHBondContact O-CB 3.43Å; N257-R261 PolarHBondContact O-N 3.47Å; N257-R261 VanDerWaalsContact O-N 3.1Å; N257-T262 PolarHBondContact O-N 3.44Å; N257-T262 PolarHBondContact O-OG1 2.94Å
258	M	84	Confident	86.4	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	21%	0.212	C	C	.	.	I	π-helix	trans	-60.9	-55.5	174.8	175.2	-172.6	178.8	0	0	111.4	I160 Y193 F195 I254 L255 R256 T262 H263	I160-M258 HydrophobicContact CD1-CE 3.57Å; I160-M258 HydrophobicContact CD1-SD 4.35Å; I160-M258 HydrophobicContact CG1-CE 4.05Å; Y193-M258 HydrophobicContact CD1-CE 3.4Å; Y193-M258 VanDerWaalsContact CD1-CE 3.4Å; Y193-M258 HydrophobicContact CE1-CE 3.38Å; F195-M258 HydrophobicContact CD1-CE 4.49Å; F195-M258 HydrophobicContact CE1-CE 3.47Å; F195-M258 VanDerWaalsContact CE1-CE 3.47Å; F195-M258 HydrophobicContact CE1-CG 3.9Å; F195-M258 HydrophobicContact CE1-SD 3.79Å; F195-M258 HydrophobicContact CE2-CE 4.49Å; F195-M258 HydrophobicContact CZ-CE 3.43Å; F195-M258 VanDerWaalsContact CZ-CE 3.43Å; F195-M258 HydrophobicContact CZ-CG 4.29Å; F195-M258 HydrophobicContact CZ-SD 3.58Å; F195-M258 VanDerWaalsContact CZ-SD 3.58Å; I254-M258 VanDerWaalsContact O-CB 3.23Å; I254-M258 WeakPolarHBondContact O-CB 3.32Å; I254-M258 PolarHBondContact O-N 3.44Å; L255-M258 PolarHBondContact O-N 2.93Å; R256-M258 VanDerWaalsContact C-N 3.31Å; R256-M258 PolarHBondContact O-N 3.04Å; M258-T262 WeakPolarHBondContact CA-OG1 3.49Å; M258-H263 HydrophobicContact CG-CB 4.27Å; M258-H263 PolarHBondContact O-N 2.9Å
259	L	81.9	Confident	86.4	Confident	9 Å²	9	39 Å²	39	5%	0.047	19%	0.189	C	C	.	.	I	π-helix	trans	-71	-35.3	-171.6	-71.8	175	0	0	0	114.1	Q21 L40 L132 I160 L255 R256 L267	Q21-L259 PolarHBondContact NE2-O 2.97Å; L40-L259 HydrophobicContact CD1-CD1 4.5Å; L40-L259 HydrophobicContact CD2-CD1 4.46Å; L132-L259 HydrophobicContact CD1-CD1 3.97Å; L132-L259 HydrophobicContact CD2-CD1 3.94Å; L132-L259 HydrophobicContact CD2-CD2 4.04Å; I160-L259 HydrophobicContact CD1-CD2 3.74Å; L255-L259 HydrophobicContact CD1-CD1 3.57Å; L255-L259 HydrophobicContact CD1-CG 3.93Å; L255-L259 HydrophobicContact CG-CD1 3.83Å; L255-L259 HydrophobicContact CG-CG 4.46Å; L255-L259 WeakPolarHBondContact O-CB 3.32Å; L255-L259 WeakPolarHBondContact O-CG 3.44Å; L255-L259 PolarHBondContact O-N 3.39Å; R256-L259 PolarHBondContact O-N 3.06Å; L259-L267 HydrophobicContact CD2-CD1 4.25Å
260	I	79.1	Confident	86.5	Confident	18 Å²	18	36.5 Å²	36.5	9%	0.092	18%	0.18	C	C	.	.	I	π-helix	trans	-104.7	-36.9	-168.7	-53.7	178.6	0	0	0	112.1	F41 E72 R256	F41-I260 HydrophobicContact CD1-CD1 4Å; F41-I260 HydrophobicContact CE1-CD1 3.77Å; F41-I260 HydrophobicContact CE1-CG1 4.13Å; E72-I260 WeakPolarHBondContact OE2-CG2 3.27Å; R256-I260 HydrophobicContact CG-CD1 3.87Å; R256-I260 WeakPolarHBondContact O-CB 3.26Å; R256-I260 PolarHBondContact O-N 3.37Å; R256-I260 VanDerWaalsContact O-N 3.08Å
261	R	76.3	Confident	86.4	Confident	163 Å²	163	36.3 Å²	36.3	62%	0.615	18%	0.178	S	C	*	.	I	π-helix	trans	-103.5	-45	-168	-61.5	-177.2	175.8	-175.3	-3.3	114	N257	N257-R261 WeakPolarHBondContact O-CB 3.43Å; N257-R261 PolarHBondContact O-N 3.47Å; N257-R261 VanDerWaalsContact O-N 3.1Å
262	T	77.8	Confident	86.3	Confident	70 Å²	70	38 Å²	38	43%	0.429	19%	0.187	S	C	.	.	I	π-helix	trans	-105.7	-52.4	-164	45.6	0	0	0	0	112.6	N257 M258	N257-T262 PolarHBondContact O-N 3.44Å; N257-T262 PolarHBondContact O-OG1 2.94Å; M258-T262 WeakPolarHBondContact CA-OG1 3.49Å
263	H	81.9	Confident	86.3	Confident	10 Å²	10	42.8 Å²	42.8	5%	0.046	21%	0.213	C	C	.	.	S	Bend	trans	-108.1	12.2	-166.7	-60.2	84.5	0	0	0	113.8	F195 M258 Q265 D266 L267	F195-H263 AromaticContact CD1-CD2 3.46Å; F195-H263 VanDerWaalsContact CD1-CD2 3.46Å; F195-H263 WeakPolarHBondContact CD1-CD2 3.41Å; F195-H263 AromaticContact CD1-CE1 3.82Å; F195-H263 AromaticContact CD1-CG 3.95Å; F195-H263 AromaticContact CD1-NE2 3.36Å; F195-H263 WeakPolarHBondContact CD1-NE2 3.32Å; F195-H263 AromaticContact CE1-CE1 3.93Å; F195-H263 AromaticContact CE1-ND1 3.99Å; F195-H263 AromaticContact CE1-NE2 3.93Å; M258-H263 HydrophobicContact CG-CB 4.27Å; M258-H263 PolarHBondContact O-N 2.9Å; H263-Q265 VanDerWaalsContact C-N 3.34Å; H263-Q265 PolarHBondContact O-N 2.73Å; H263-D266 PolarHBondContact O-N 3.38Å; H263-L267 WeakPolarHBondContact O-CB 3.21Å; H263-L267 VanDerWaalsContact O-CG 3.27Å; H263-L267 WeakPolarHBondContact O-CG 3.4Å; H263-L267 PolarHBondContact O-N 3.08Å
264	M	82.6	Confident	86.4	Confident	39 Å²	39	44 Å²	44	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-43.5	179.1	175.7	177.1	62.4	0	0	112.1	Q21 L77 K268	Q21-M264 HydrophobicContact CB-SD 4.11Å; Q21-M264 HydrophobicContact CG-CG 4.26Å; Q21-M264 HydrophobicContact CG-SD 4.21Å; L77-M264 HydrophobicContact CD1-CE 4.38Å; L77-M264 HydrophobicContact CD1-SD 3.7Å; M264-K268 PolarHBondContact O-N 3.16Å
265	Q	84.5	Confident	86.5	Confident	102 Å²	102	42.9 Å²	42.9	48%	0.477	21%	0.214	S	C	.	.	H	α-helix	trans	-70	-44.4	-178.4	-174.5	55.6	42.6	0	0	110.8	H263 L267 K268 D269	H263-Q265 VanDerWaalsContact C-N 3.34Å; H263-Q265 PolarHBondContact O-N 2.73Å; Q265-L267 VanDerWaalsContact C-N 3.34Å; Q265-L267 PolarHBondContact O-N 3.24Å; Q265-K268 WeakPolarHBondContact O-CA 3.42Å; Q265-K268 VanDerWaalsContact O-CB 3.29Å; Q265-K268 WeakPolarHBondContact O-CB 3.43Å; Q265-K268 PolarHBondContact O-N 3.48Å; Q265-D269 PolarHBondContact NE2-OD1 3Å; Q265-D269 PolarHBondContact O-N 3.25Å
266	D	87.6	Confident	86.7	Confident	33 Å²	33	43 Å²	43	18%	0.176	21%	0.214	C	C	.	.	H	α-helix	trans	-59.8	-42.6	177.2	-179.1	73.3	0	0	0	112.5	Y193 P196 H263 K268 D269 V270	Y193-D266 VanDerWaalsContact CE2-OD2 3.29Å; Y193-D266 WeakPolarHBondContact CE2-OD2 3.44Å; Y193-D266 VanDerWaalsContact CZ-OD2 3.26Å; Y193-D266 PolarHBondContact OH-OD2 2.92Å; P196-D266 WeakPolarHBondContact CD-OD2 3.41Å; P196-D266 HydrophobicContact CG-CB 4.44Å; P196-D266 WeakPolarHBondContact CG-OD1 3.17Å; H263-D266 PolarHBondContact O-N 3.38Å; D266-K268 PolarHBondContact O-N 3.47Å; D266-D269 PolarHBondContact O-N 2.95Å; D266-V270 WeakPolarHBondContact O-CG2 3.44Å; D266-V270 PolarHBondContact O-N 3.33Å
267	L	89.3	Confident	87	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-36.8	173.6	-75.5	166.6	0	0	0	112.4	C130 N158 Y193 L259 H263 Q265 T271	C130-L267 HydrophobicContact CB-CD1 4.09Å; C130-L267 HydrophobicContact CB-CD2 4.08Å; N158-L267 HydrophobicContact CB-CD2 3.67Å; N158-L267 PolarHBondContact ND2-O 3.48Å; Y193-L267 HydrophobicContact CD1-CD2 4.27Å; Y193-L267 HydrophobicContact CD2-CD2 3.51Å; Y193-L267 HydrophobicContact CE1-CD2 4.22Å; Y193-L267 HydrophobicContact CE2-CD2 3.45Å; Y193-L267 VanDerWaalsContact CE2-CD2 3.45Å; Y193-L267 HydrophobicContact CE2-CG 4.1Å; Y193-L267 HydrophobicContact CG-CD2 3.91Å; L259-L267 HydrophobicContact CD2-CD1 4.25Å; H263-L267 WeakPolarHBondContact O-CB 3.21Å; H263-L267 VanDerWaalsContact O-CG 3.27Å; H263-L267 WeakPolarHBondContact O-CG 3.4Å; H263-L267 PolarHBondContact O-N 3.08Å; Q265-L267 VanDerWaalsContact C-N 3.34Å; Q265-L267 PolarHBondContact O-N 3.24Å; L267-T271 WeakPolarHBondContact O-CB 3.47Å; L267-T271 PolarHBondContact O-N 2.9Å; L267-T271 VanDerWaalsContact O-N 3.13Å; L267-T271 PolarHBondContact O-OG1 3Å
268	K	88.6	Confident	87.3	Confident	35 Å²	35	44.9 Å²	44.9	15%	0.152	23%	0.225	C	C	.	.	H	α-helix	trans	-70	-43.8	174.6	-68.7	172.1	175.6	-179.2	0	111.6	S20 Q129 M264 Q265 D266 T271 N272	S20-K268 WeakPolarHBondContact O-CE 3.47Å; S20-K268 PolarHBondContact O-NZ 3.37Å; Q129-K268 HydrophobicContact CG-CG 3.91Å; M264-K268 PolarHBondContact O-N 3.16Å; Q265-K268 WeakPolarHBondContact O-CA 3.42Å; Q265-K268 VanDerWaalsContact O-CB 3.29Å; Q265-K268 WeakPolarHBondContact O-CB 3.43Å; Q265-K268 PolarHBondContact O-N 3.48Å; D266-K268 PolarHBondContact O-N 3.47Å; K268-T271 WeakPolarHBondContact O-CB 3.48Å; K268-T271 PolarHBondContact O-N 3.09Å; K268-N272 WeakPolarHBondContact O-CB 3.49Å; K268-N272 PolarHBondContact O-N 3.21Å
269	D	90.2	Very high	87.7	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.353	23%	0.228	S	C	.	.	H	α-helix	trans	-65.6	-43.5	-177.6	-64.6	-21.6	0	0	0	111	Q265 D266 T271 N272 N273	Q265-D269 PolarHBondContact NE2-OD1 3Å; Q265-D269 PolarHBondContact O-N 3.25Å; D266-D269 PolarHBondContact O-N 2.95Å; D269-T271 VanDerWaalsContact C-N 3.34Å; D269-T271 PolarHBondContact O-N 3.13Å; D269-N272 PolarHBondContact O-N 3.17Å; D269-N273 VanDerWaalsContact O-CB 3.29Å; D269-N273 WeakPolarHBondContact O-CB 3.37Å; D269-N273 VanDerWaalsContact O-CG 3.25Å; D269-N273 PolarHBondContact O-N 2.99Å; D269-N273 PolarHBondContact O-ND2 3.16Å
270	V	91.3	Very high	88.3	Confident	35 Å²	35	48.3 Å²	48.3	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-41.3	172.7	178.3	0	0	0	0	111	N158 Y193 D266 N272 V274 H275	N158-V270 WeakPolarHBondContact OD1-CG1 3.36Å; Y193-V270 HydrophobicContact CE2-CG2 4.46Å; D266-V270 WeakPolarHBondContact O-CG2 3.44Å; D266-V270 PolarHBondContact O-N 3.33Å; V270-N272 VanDerWaalsContact C-N 3.28Å; V270-N272 PolarHBondContact O-N 3.31Å; V270-V274 HydrophobicContact CG1-CB 4.2Å; V270-V274 HydrophobicContact CG1-CG2 4.09Å; V270-V274 WeakPolarHBondContact O-CA 3.48Å; V270-V274 VanDerWaalsContact O-CB 3.26Å; V270-V274 WeakPolarHBondContact O-CB 3.27Å; V270-V274 PolarHBondContact O-N 3.46Å; V270-H275 PolarHBondContact O-N 3.47Å
271	T	91.6	Very high	88.8	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.012	26%	0.256	C	S	.	.	I	π-helix	trans	-60.1	-41	175.8	-59.8	0	0	0	0	111.8	F108 R127 V128 Q129 N158 L267 K268 D269 Y276	F108-T271 HydrophobicContact CE1-CG2 4.21Å; R127-T271 HydrophobicContact CB-CG2 4.34Å; V128-T271 WeakPolarHBondContact O-CG2 3.33Å; Q129-T271 WeakPolarHBondContact CA-OG1 3.15Å; Q129-T271 PolarHBondContact O-OG1 2.99Å; N158-T271 PolarHBondContact ND2-OG1 3.38Å; N158-T271 VanDerWaalsContact ND2-OG1 3.1Å; L267-T271 WeakPolarHBondContact O-CB 3.47Å; L267-T271 PolarHBondContact O-N 2.9Å; L267-T271 VanDerWaalsContact O-N 3.13Å; L267-T271 PolarHBondContact O-OG1 3Å; K268-T271 WeakPolarHBondContact O-CB 3.48Å; K268-T271 PolarHBondContact O-N 3.09Å; D269-T271 VanDerWaalsContact C-N 3.34Å; D269-T271 PolarHBondContact O-N 3.13Å; T271-Y276 VanDerWaalsContact O-CB 3.28Å; T271-Y276 WeakPolarHBondContact O-CB 3.29Å; T271-Y276 PolarHBondContact O-N 2.92Å
272	N	91.2	Very high	89.5	Confident	43 Å²	43	48.2 Å²	48.2	23%	0.23	25%	0.246	C	C	.	.	I	π-helix	trans	-72.8	-54.8	179.4	-169.9	73.5	0	0	0	112	R127 K268 D269 V270 Y276 E277	R127-N272 PolarHBondContact NH1-OD1 3.29Å; R127-N272 PolarHBondContact NH2-OD1 2.68Å; K268-N272 WeakPolarHBondContact O-CB 3.49Å; K268-N272 PolarHBondContact O-N 3.21Å; D269-N272 PolarHBondContact O-N 3.17Å; V270-N272 VanDerWaalsContact C-N 3.28Å; V270-N272 PolarHBondContact O-N 3.31Å; N272-Y276 WeakPolarHBondContact O-CB 3.38Å; N272-E277 PolarHBondContact O-N 3.19Å
273	N	91.5	Very high	90	Very high	100 Å²	100	49.1 Å²	49.1	54%	0.535	24%	0.244	S	C	.	.	I	π-helix	trans	-83.2	-21.8	-166.5	-59.6	-24.1	0	0	0	113.1	D269	D269-N273 VanDerWaalsContact O-CB 3.29Å; D269-N273 WeakPolarHBondContact O-CB 3.37Å; D269-N273 VanDerWaalsContact O-CG 3.25Å; D269-N273 PolarHBondContact O-N 2.99Å; D269-N273 PolarHBondContact O-ND2 3.16Å
274	V	92.6	Very high	90.3	Very high	67 Å²	67	52.1 Å²	52.1	41%	0.406	26%	0.26	S	S	.	.	I	π-helix	trans	-110.3	-66.8	-179.7	-174.7	0	0	0	0	110.2	V270 N278	V270-V274 HydrophobicContact CG1-CB 4.2Å; V270-V274 HydrophobicContact CG1-CG2 4.09Å; V270-V274 WeakPolarHBondContact O-CA 3.48Å; V270-V274 VanDerWaalsContact O-CB 3.26Å; V270-V274 WeakPolarHBondContact O-CB 3.27Å; V270-V274 PolarHBondContact O-N 3.46Å; V274-N278 WeakPolarHBondContact O-CB 3.48Å; V274-N278 PolarHBondContact O-N 3.44Å; V274-N278 PolarHBondContact O-ND2 3.38Å
275	H	93.4	Very high	90.4	Very high	12 Å²	12	52.6 Å²	52.6	6%	0.056	27%	0.271	C	S	.	.	I	π-helix	trans	-68.8	-48.6	-169.7	-62.2	-53	0	0	0	112.6	F108 E155 V157 N158 V270 Y279	F108-H275 HydrophobicContact CZ-CB 3.93Å; E155-H275 VanDerWaalsContact C-ND1 3.27Å; E155-H275 PolarHBondContact O-ND1 2.78Å; V157-H275 VanDerWaalsContact C-NE2 3.33Å; N158-H275 PolarHBondContact N-NE2 3.31Å; N158-H275 PolarHBondContact OD1-NE2 3.32Å; V270-H275 PolarHBondContact O-N 3.47Å; H275-Y279 PolarHBondContact O-N 3.15Å
276	Y	93.8	Very high	90.2	Very high	2 Å²	2	50 Å²	50	1%	0.008	27%	0.266	C	S	.	.	I	π-helix	trans	-68.4	-46.1	178.6	171.4	-103.9	0	0	0	112	F108 Y111 L112 E115 R127 T271 N272 N278 Y279 R280	F108-Y276 HydrophobicContact CB-CD2 4.19Å; F108-Y276 AromaticContact CD1-CD2 3.82Å; F108-Y276 HydrophobicContact CD1-CD2 3.82Å; F108-Y276 HydrophobicContact CD1-CG 4.46Å; F108-Y276 HydrophobicContact CG-CD2 4.26Å; Y111-Y276 HydrophobicContact CD1-CD1 4.5Å; Y111-Y276 HydrophobicContact CD1-CD2 4.23Å; Y111-Y276 AromaticContact CD1-CE1 3.9Å; Y111-Y276 HydrophobicContact CD1-CE1 3.9Å; Y111-Y276 AromaticContact CD1-CE2 3.6Å; Y111-Y276 HydrophobicContact CD1-CE2 3.6Å; Y111-Y276 AromaticContact CD1-CZ 3.42Å; Y111-Y276 VanDerWaalsContact CD1-CZ 3.42Å; Y111-Y276 AromaticContact CE1-CE1 3.95Å; Y111-Y276 HydrophobicContact CE1-CE1 3.95Å; Y111-Y276 HydrophobicContact CE1-CE2 4.44Å; Y111-Y276 AromaticContact CE1-CZ 3.93Å; Y111-Y276 HydrophobicContact CG-CE2 4.33Å; L112-Y276 VanDerWaalsContact CA-OH 3.32Å; L112-Y276 WeakPolarHBondContact CA-OH 3.28Å; L112-Y276 HydrophobicContact CB-CE2 4.26Å; L112-Y276 WeakPolarHBondContact CD1-OH 3.43Å; E115-Y276 PolarHBondContact OE2-OH 3.08Å; R127-Y276 VanDerWaalsContact NH1-CG 3.28Å; T271-Y276 VanDerWaalsContact O-CB 3.28Å; T271-Y276 WeakPolarHBondContact O-CB 3.29Å; T271-Y276 PolarHBondContact O-N 2.92Å; N272-Y276 WeakPolarHBondContact O-CB 3.38Å; Y276-N278 VanDerWaalsContact C-N 3.31Å; Y276-N278 PolarHBondContact O-N 2.92Å; Y276-Y279 CarbonylContact O-C 3.59Å; Y276-Y279 WeakPolarHBondContact O-CA 3.39Å; Y276-Y279 WeakPolarHBondContact O-CB 3.4Å; Y276-Y279 PolarHBondContact O-N 2.89Å; Y276-R280 WeakPolarHBondContact O-CB 3.24Å; Y276-R280 PolarHBondContact O-N 3.18Å
277	E	92.4	Very high	89.5	Confident	60 Å²	60	53.3 Å²	53.3	28%	0.28	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-36.5	177	-76.6	-53.9	132.3	0	0	113	N272 R280 S281	N272-E277 PolarHBondContact O-N 3.19Å; E277-R280 PolarHBondContact O-N 2.49Å; E277-R280 IonicContact OE2-NH1 3.84Å; E277-S281 VanDerWaalsContact O-CB 3.25Å; E277-S281 WeakPolarHBondContact O-CB 3.48Å; E277-S281 PolarHBondContact O-N 3.27Å; E277-S281 PolarHBondContact O-OG 3.25Å
278	N	92.1	Very high	88.4	Confident	73 Å²	73	57.7 Å²	57.7	39%	0.39	32%	0.315	S	S	.	.	H	α-helix	trans	-64.4	-40.2	172.2	-76.3	-32.4	0	0	0	111.9	V274 Y276 R282	V274-N278 WeakPolarHBondContact O-CB 3.48Å; V274-N278 PolarHBondContact O-N 3.44Å; V274-N278 PolarHBondContact O-ND2 3.38Å; Y276-N278 VanDerWaalsContact C-N 3.31Å; Y276-N278 PolarHBondContact O-N 2.92Å; N278-R282 WeakPolarHBondContact O-CB 3.43Å; N278-R282 VanDerWaalsContact O-CG 3.3Å; N278-R282 WeakPolarHBondContact O-CG 3.49Å; N278-R282 PolarHBondContact O-N 3.38Å; N278-R282 VanDerWaalsContact O-N 3.16Å; N278-R282 PolarHBondContact O-NE 3.01Å; N278-R282 VanDerWaalsContact O-NE 3.17Å
279	Y	93	Very high	86.9	Confident	16 Å²	16	63.9 Å²	63.9	6%	0.063	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-50.4	173.7	178.3	-91.2	0	0	0	111.4	D105 F108 E109 H275 Y276 S281 R282 K283	D105-Y279 HydrophobicContact CB-CE2 3.85Å; D105-Y279 PolarHBondContact O-OH 3.1Å; F108-Y279 HydrophobicContact CB-CD1 3.46Å; F108-Y279 VanDerWaalsContact CB-CD1 3.46Å; F108-Y279 HydrophobicContact CB-CD2 4.16Å; F108-Y279 HydrophobicContact CB-CE1 3.64Å; F108-Y279 HydrophobicContact CB-CE2 4.33Å; F108-Y279 HydrophobicContact CB-CG 3.73Å; F108-Y279 HydrophobicContact CD2-CD2 4Å; F108-Y279 AromaticContact CD2-CG 3.91Å; F108-Y279 HydrophobicContact CD2-CG 3.91Å; F108-Y279 HydrophobicContact CG-CD1 4.31Å; F108-Y279 HydrophobicContact CG-CG 4.15Å; E109-Y279 PolarHBondContact OE2-OH 3.07Å; H275-Y279 PolarHBondContact O-N 3.15Å; Y276-Y279 CarbonylContact O-C 3.59Å; Y276-Y279 WeakPolarHBondContact O-CA 3.39Å; Y276-Y279 WeakPolarHBondContact O-CB 3.4Å; Y276-Y279 PolarHBondContact O-N 2.89Å; Y279-S281 PolarHBondContact O-N 2.71Å; Y279-R282 PolarHBondContact O-N 3.19Å; Y279-K283 HydrophobicContact CD1-CG 4.15Å; Y279-K283 HydrophobicContact CE1-CG 3.65Å; Y279-K283 HydrophobicContact CE2-CG 4.24Å; Y279-K283 WeakPolarHBondContact O-CB 3.22Å; Y279-K283 PolarHBondContact O-N 3.48Å; Y279-K283 WeakPolarHBondContact OH-CE 3.5Å
280	R	93	Very high	85	Confident	68 Å²	68	67 Å²	67	26%	0.257	36%	0.355	S	S	.	.	H	α-helix	trans	-57.6	-48.8	179.3	-180	172.5	-175.9	-81	1	111.5	L112 E115 Y276 E277 R282 K283 L284	L112-R280 HydrophobicContact CD1-CG 3.85Å; E115-R280 IonicContact OE1-CZ 3.41Å; E115-R280 IonicContact OE1-NE 2.65Å; E115-R280 PolarHBondContact OE1-NE 3.45Å; E115-R280 VanDerWaalsContact OE1-NE 3.14Å; E115-R280 IonicContact OE1-NH2 2.82Å; E115-R280 PolarHBondContact OE1-NH2 3.38Å; E115-R280 IonicContact OE2-NE 3.6Å; E115-R280 PolarHBondContact OE2-NE 3.08Å; Y276-R280 WeakPolarHBondContact O-CB 3.24Å; Y276-R280 PolarHBondContact O-N 3.18Å; E277-R280 PolarHBondContact O-N 2.49Å; E277-R280 IonicContact OE2-NH1 3.84Å; R280-R282 PolarHBondContact O-N 2.99Å; R280-K283 PolarHBondContact O-N 3.44Å; R280-L284 HydrophobicContact CG-CD1 3.8Å; R280-L284 HydrophobicContact CG-CG 4.34Å; R280-L284 WeakPolarHBondContact O-CB 2.99Å; R280-L284 VanDerWaalsContact O-CG 3.3Å; R280-L284 WeakPolarHBondContact O-CG 3.25Å; R280-L284 PolarHBondContact O-N 3.35Å
281	S	90.9	Very high	83	Confident	68 Å²	68	68 Å²	68	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-59	-45.8	177.3	-62.5	0	0	0	0	111.8	E277 Y279 A285	E277-S281 VanDerWaalsContact O-CB 3.25Å; E277-S281 WeakPolarHBondContact O-CB 3.48Å; E277-S281 PolarHBondContact O-N 3.27Å; E277-S281 PolarHBondContact O-OG 3.25Å; Y279-S281 PolarHBondContact O-N 2.71Å; S281-A285 WeakPolarHBondContact O-CB 3.44Å; S281-A285 PolarHBondContact O-N 3.25Å
282	R	90.1	Very high	80.9	Confident	110 Å²	110	72.1 Å²	72.1	42%	0.415	40%	0.397	S	S	.	.	H	α-helix	trans	-63.3	-43.7	176.7	-75.2	-177.3	-71.6	-146.6	1.4	112.2	E155 N278 Y279 R280 A286	E155-R282 IonicContact OE2-NH1 2.96Å; E155-R282 PolarHBondContact OE2-NH1 3.37Å; N278-R282 WeakPolarHBondContact O-CB 3.43Å; N278-R282 VanDerWaalsContact O-CG 3.3Å; N278-R282 WeakPolarHBondContact O-CG 3.49Å; N278-R282 PolarHBondContact O-N 3.38Å; N278-R282 VanDerWaalsContact O-N 3.16Å; N278-R282 PolarHBondContact O-NE 3.01Å; N278-R282 VanDerWaalsContact O-NE 3.17Å; Y279-R282 PolarHBondContact O-N 3.19Å; R280-R282 PolarHBondContact O-N 2.99Å; R282-A286 PolarHBondContact O-N 2.74Å; R282-A286 VanDerWaalsContact O-N 3.14Å
283	K	89.1	Confident	78.7	Confident	89 Å²	89	75.8 Å²	75.8	39%	0.387	42%	0.417	S	S	.	.	H	α-helix	trans	-65.7	-48.7	179.1	-86.3	-68.2	-166.7	162.6	0	112.5	E109 L112 Y279 R280 A286 V287	E109-K283 VanDerWaalsContact OE2-CE 3.27Å; E109-K283 WeakPolarHBondContact OE2-CE 3.44Å; E109-K283 IonicContact OE2-NZ 2.8Å; E109-K283 PolarHBondContact OE2-NZ 2.96Å; L112-K283 HydrophobicContact CD2-CB 4.24Å; Y279-K283 HydrophobicContact CD1-CG 4.15Å; Y279-K283 HydrophobicContact CE1-CG 3.65Å; Y279-K283 HydrophobicContact CE2-CG 4.24Å; Y279-K283 WeakPolarHBondContact O-CB 3.22Å; Y279-K283 PolarHBondContact O-N 3.48Å; Y279-K283 WeakPolarHBondContact OH-CE 3.5Å; R280-K283 PolarHBondContact O-N 3.44Å; K283-A286 PolarHBondContact O-N 3.32Å; K283-V287 WeakPolarHBondContact O-CG2 3.5Å; K283-V287 PolarHBondContact O-N 2.98Å; K283-V287 VanDerWaalsContact O-N 3.08Å
284	L	86.7	Confident	76.4	Confident	73 Å²	73	78.2 Å²	78.2	38%	0.382	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-39.8	179.8	-67.1	177.3	0	0	0	111.4	R280 A286 V287 T288	R280-L284 HydrophobicContact CG-CD1 3.8Å; R280-L284 HydrophobicContact CG-CG 4.34Å; R280-L284 WeakPolarHBondContact O-CB 2.99Å; R280-L284 VanDerWaalsContact O-CG 3.3Å; R280-L284 WeakPolarHBondContact O-CG 3.25Å; R280-L284 PolarHBondContact O-N 3.35Å; L284-A286 VanDerWaalsContact C-N 3.31Å; L284-A286 PolarHBondContact O-N 3.25Å; L284-V287 PolarHBondContact O-N 3.43Å; L284-T288 PolarHBondContact O-N 2.97Å; L284-T288 PolarHBondContact O-OG1 3.23Å
285	A	86	Confident	74.2	Confident	50 Å²	50	81 Å²	81	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-59.7	-41.9	174.5	0	0	0	0	0	112.2	S281 T288 Y289	S281-A285 WeakPolarHBondContact O-CB 3.44Å; S281-A285 PolarHBondContact O-N 3.25Å; A285-T288 PolarHBondContact O-N 3.26Å; A285-Y289 WeakPolarHBondContact O-CD2 3.18Å; A285-Y289 PolarHBondContact O-N 2.98Å
286	A	80.3	Confident	71.9	Confident	46 Å²	46	89.4 Å²	89.4	38%	0.38	48%	0.479	S	S	.	.	H	α-helix	trans	-65.1	-38	176.9	0	0	0	0	0	112.6	R282 K283 L284 N290	R282-A286 PolarHBondContact O-N 2.74Å; R282-A286 VanDerWaalsContact O-N 3.14Å; K283-A286 PolarHBondContact O-N 3.32Å; L284-A286 VanDerWaalsContact C-N 3.31Å; L284-A286 PolarHBondContact O-N 3.25Å; A286-N290 WeakPolarHBondContact O-CB 3.47Å; A286-N290 VanDerWaalsContact O-CG 3.22Å; A286-N290 PolarHBondContact O-N 2.77Å; A286-N290 PolarHBondContact O-ND2 3.39Å
287	V	73.4	Confident	69.6	Low	103 Å²	103	95.9 Å²	95.9	62%	0.624	51%	0.514	S	S	*	.	H	α-helix	trans	-63.9	-44.4	174.4	174.7	0	0	0	0	110.7	K283 L284 G291	K283-V287 WeakPolarHBondContact O-CG2 3.5Å; K283-V287 PolarHBondContact O-N 2.98Å; K283-V287 VanDerWaalsContact O-N 3.08Å; L284-V287 PolarHBondContact O-N 3.43Å; V287-G291 PolarHBondContact O-N 3.16Å
288	T	64.8	Low	67.2	Low	94 Å²	94	102.9 Å²	102.9	58%	0.577	54%	0.543	S	S	*	.	H	α-helix	trans	-62.3	-47.5	177.9	-49.8	0	0	0	0	111.4	L284 A285 G291 V292	L284-T288 PolarHBondContact O-N 2.97Å; L284-T288 PolarHBondContact O-OG1 3.23Å; A285-T288 PolarHBondContact O-N 3.26Å; T288-G291 PolarHBondContact O-N 3.06Å; T288-G291 VanDerWaalsContact O-N 3.14Å; T288-V292 WeakPolarHBondContact O-CG2 3.3Å; T288-V292 PolarHBondContact O-N 3.34Å
289	Y	56.9	Low	64.7	Low	165 Å²	165	103 Å²	103	65%	0.647	56%	0.562	S	S	*	*	H	α-helix	trans	-66.2	-41.6	-179.2	-95.7	-86.1	0	0	0	113.5	A285 G291 V292 D293	A285-Y289 WeakPolarHBondContact O-CD2 3.18Å; A285-Y289 PolarHBondContact O-N 2.98Å; Y289-G291 PolarHBondContact O-N 2.97Å; Y289-G291 VanDerWaalsContact O-N 3.11Å; Y289-V292 PolarHBondContact O-N 3.17Å; Y289-D293 PolarHBondContact O-N 2.78Å
290	N	51.8	Low	62.1	Low	130 Å²	130	111.7 Å²	111.7	70%	0.695	60%	0.603	S	S	*	*	H	α-helix	trans	-64.9	-14.4	175.1	-70.7	-15.6	0	0	0	112.9	A286	A286-N290 WeakPolarHBondContact O-CB 3.47Å; A286-N290 VanDerWaalsContact O-CG 3.22Å; A286-N290 PolarHBondContact O-N 2.77Å; A286-N290 PolarHBondContact O-ND2 3.39Å
291	G	47.8	Very low	60.1	Low	57 Å²	57	116.4 Å²	116.4	59%	0.588	63%	0.633	S	S	*	*	H	α-helix	trans	-84.7	-20.8	169.7	0	0	0	0	0	114.8	V287 T288 Y289	V287-G291 PolarHBondContact O-N 3.16Å; T288-G291 PolarHBondContact O-N 3.06Å; T288-G291 VanDerWaalsContact O-N 3.14Å; Y289-G291 PolarHBondContact O-N 2.97Å; Y289-G291 VanDerWaalsContact O-N 3.11Å
292	V	48.3	Very low	58.1	Low	88 Å²	88	119.8 Å²	119.8	53%	0.533	65%	0.651	S	S	.	*	H	α-helix	trans	-93.4	-25.3	-174.4	-161.4	0	0	0	0	113.2	T288 Y289 N294 N295	T288-V292 WeakPolarHBondContact O-CG2 3.3Å; T288-V292 PolarHBondContact O-N 3.34Å; Y289-V292 PolarHBondContact O-N 3.17Å; V292-N294 PolarHBondContact O-N 2.96Å; V292-N294 VanDerWaalsContact O-N 3.12Å; V292-N295 PolarHBondContact O-N 3.48Å; V292-N295 VanDerWaalsContact O-N 3.1Å
293	D	44.3	Very low	56.1	Low	121 Å²	121	121.6 Å²	121.6	65%	0.647	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-7.6	-175.9	-81.2	-44.7	0	0	0	115.1	Y289	Y289-D293 PolarHBondContact O-N 2.78Å
294	N	44.8	Very low	54.1	Low	151 Å²	151	121.1 Å²	121.1	81%	0.807	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-0.9	171.2	-88.9	-20.8	0	0	0	114.8	V292	V292-N294 PolarHBondContact O-N 2.96Å; V292-N294 VanDerWaalsContact O-N 3.12Å
295	N	45.2	Very low	52.6	Low	125 Å²	125	122.6 Å²	122.6	67%	0.668	68%	0.683	S	S	*	*			trans	-141	64	-175.4	-134.5	8.9	0	0	0	113.7	V292 N297	V292-N295 PolarHBondContact O-N 3.48Å; V292-N295 VanDerWaalsContact O-N 3.1Å; N295-N297 PolarHBondContact O-N 2.98Å
296	K	45.6	Very low	51.1	Low	188 Å²	188	126.5 Å²	126.5	82%	0.817	70%	0.696	S	S	*	*			trans	-72.1	74.5	154.6	-77.6	-175.9	179.3	171.1	0	109.5
297	N	45.2	Very low	50.2	Low	138 Å²	138	126.4 Å²	126.4	74%	0.738	70%	0.695	S	S	*	*	S	Bend	trans	-167.4	129.2	147.8	-99.9	-21.1	0	0	0	112.8	N295	N295-N297 PolarHBondContact O-N 2.98Å
298	K	41.3	Very low	49.5	Very low	207 Å²	207	127 Å²	127	90%	0.9	69%	0.691	S	S	*	*			trans	79.5	122.7	169.6	-71.6	-179.8	171.7	177.3	0	117.7
299	G	40.4	Very low	49.3	Very low	76 Å²	76	128.9 Å²	128.9	78%	0.784	70%	0.695	S	S	*	*			trans	-82.8	-167.8	172.3	0	0	0	0	0	114.4
300	Q	38.3	Very low	49.7	Very low	199 Å²	199	126 Å²	126	93%	0.93	69%	0.687	S	S	*	*			trans	79.9	115.6	-179.4	-84.2	177.3	-6	0	0	117.7
301	L	51.2	Low	50.5	Low	167 Å²	167	124.6 Å²	124.6	87%	0.874	68%	0.677	S	S	*	*			trans	-51.6	128.4	160.9	-69.9	110.2	0	0	0	110.9
302	T	48.4	Very low	51.4	Low	139 Å²	139	128.3 Å²	128.3	85%	0.853	68%	0.679	S	S	*	*			trans	159.5	83.4	141.3	42.9	0	0	0	0	108.7
303	K	47.8	Very low	52.4	Low	147 Å²	147	130.8 Å²	130.8	64%	0.639	68%	0.679	S	S	*	*			trans	-134.6	133.8	160.2	-78.8	-170.6	177.1	-179.5	0	109.4
304	S	48.4	Very low	53.9	Low	79 Å²	79	134.7 Å²	134.7	55%	0.552	68%	0.684	S	S	*	*			trans	-58.2	139.3	179.4	175	0	0	0	0	110.8	L306 A307	S304-L306 PolarHBondContact O-N 3.29Å; S304-A307 WeakPolarHBondContact O-CB 3.13Å; S304-A307 PolarHBondContact O-N 3.5Å
305	P	54	Low	55.4	Low	104 Å²	104	133.2 Å²	133.2	68%	0.675	67%	0.673	S	S	*	*	H	α-helix	trans	-52.3	-26.2	179.5	-28.1	34.7	0	0	0	114.5	M309	P305-M309 PolarHBondContact O-N 3.38Å
306	L	54.7	Low	56.6	Low	133 Å²	133	133 Å²	133	70%	0.696	67%	0.667	S	S	*	*	H	α-helix	trans	-71.1	-32.1	178.2	-152.2	74.5	0	0	0	112.9	S304 E310	S304-L306 PolarHBondContact O-N 3.29Å; L306-E310 WeakPolarHBondContact O-CB 3.41Å; L306-E310 PolarHBondContact O-N 3.26Å
307	A	61.7	Low	58.1	Low	43 Å²	43	128.3 Å²	128.3	36%	0.355	65%	0.654	S	S	.	*	H	α-helix	trans	-74.8	-35.3	178.2	0	0	0	0	0	111.7	S304 E310 E311	S304-A307 WeakPolarHBondContact O-CB 3.13Å; S304-A307 PolarHBondContact O-N 3.5Å; A307-E310 PolarHBondContact O-N 3.1Å; A307-E311 WeakPolarHBondContact O-CB 3.49Å; A307-E311 PolarHBondContact O-N 3.44Å
308	Q	59.2	Low	59.8	Low	116 Å²	116	124.6 Å²	124.6	54%	0.542	64%	0.643	S	S	.	*	H	α-helix	trans	-65.2	-43.9	173.7	-80.5	179.2	-28.9	0	0	111.6	E310 E311 E312	Q308-E310 VanDerWaalsContact C-N 3.29Å; Q308-E310 PolarHBondContact O-N 3.49Å; Q308-E311 PolarHBondContact O-N 3.05Å; Q308-E312 WeakPolarHBondContact O-CB 3.42Å; Q308-E312 WeakPolarHBondContact O-CG 3.4Å; Q308-E312 PolarHBondContact O-N 3Å
309	M	59.8	Low	61.7	Low	133 Å²	133	121.8 Å²	121.8	66%	0.655	63%	0.631	S	S	*	*	H	α-helix	trans	-67.6	-29.8	179.2	-160	178.7	-179.1	0	0	112.6	P305 R313	P305-M309 PolarHBondContact O-N 3.38Å; M309-R313 VanDerWaalsContact O-CB 3.3Å; M309-R313 WeakPolarHBondContact O-CB 3.45Å; M309-R313 PolarHBondContact O-N 3.3Å; M309-R313 VanDerWaalsContact O-N 3.12Å
310	E	66.5	Low	63.1	Low	104 Å²	104	123.2 Å²	123.2	49%	0.486	62%	0.618	S	S	.	*	H	α-helix	trans	-76.2	-35.7	175	-172	144.6	-114.5	0	0	112.8	L306 A307 Q308 R313 R314	L306-E310 WeakPolarHBondContact O-CB 3.41Å; L306-E310 PolarHBondContact O-N 3.26Å; A307-E310 PolarHBondContact O-N 3.1Å; Q308-E310 VanDerWaalsContact C-N 3.29Å; Q308-E310 PolarHBondContact O-N 3.49Å; E310-R313 VanDerWaalsContact CG-NH2 3.3Å; E310-R313 IonicContact OE1-CZ 3.78Å; E310-R313 IonicContact OE1-NH1 3.58Å; E310-R313 PolarHBondContact OE1-NH1 2.91Å; E310-R313 IonicContact OE1-NH2 3.15Å; E310-R313 PolarHBondContact OE1-NH2 2.9Å; E310-R314 WeakPolarHBondContact O-CB 3.31Å; E310-R314 PolarHBondContact O-N 3.26Å
311	E	67.3	Low	65.2	Low	102 Å²	102	120.2 Å²	120.2	48%	0.477	60%	0.602	S	S	.	*	H	α-helix	trans	-69.6	-44.6	174.8	-162.9	157.2	-157.1	0	0	111	A307 Q308 R313 R314 E315	A307-E311 WeakPolarHBondContact O-CB 3.49Å; A307-E311 PolarHBondContact O-N 3.44Å; Q308-E311 PolarHBondContact O-N 3.05Å; E311-R313 PolarHBondContact O-N 3.46Å; E311-R314 WeakPolarHBondContact O-CB 3.34Å; E311-R314 PolarHBondContact O-N 3.17Å; E311-R314 VanDerWaalsContact O-N 3.11Å; E311-E315 PolarHBondContact O-N 3Å
312	E	66.9	Low	66.8	Low	135 Å²	135	118.7 Å²	118.7	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-61.6	-41.8	173.3	-76.6	-176	170.9	0	0	112.6	Q308 R314 E315 H316	Q308-E312 WeakPolarHBondContact O-CB 3.42Å; Q308-E312 WeakPolarHBondContact O-CG 3.4Å; Q308-E312 PolarHBondContact O-N 3Å; E312-R314 VanDerWaalsContact C-N 3.27Å; E312-R314 PolarHBondContact O-N 2.96Å; E312-E315 PolarHBondContact O-N 2.76Å; E312-H316 WeakPolarHBondContact O-CB 3.27Å; E312-H316 PolarHBondContact O-N 2.88Å
313	R	70.2	Confident	68.2	Low	139 Å²	139	117.7 Å²	117.7	53%	0.525	58%	0.576	S	S	.	*	H	α-helix	trans	-60.1	-41.2	174.2	-165.3	-155.4	-36	137.8	6.2	110.7	M309 E310 E311 H316 V317	M309-R313 VanDerWaalsContact O-CB 3.3Å; M309-R313 WeakPolarHBondContact O-CB 3.45Å; M309-R313 PolarHBondContact O-N 3.3Å; M309-R313 VanDerWaalsContact O-N 3.12Å; E310-R313 VanDerWaalsContact CG-NH2 3.3Å; E310-R313 IonicContact OE1-CZ 3.78Å; E310-R313 IonicContact OE1-NH1 3.58Å; E310-R313 PolarHBondContact OE1-NH1 2.91Å; E310-R313 IonicContact OE1-NH2 3.15Å; E310-R313 PolarHBondContact OE1-NH2 2.9Å; E311-R313 PolarHBondContact O-N 3.46Å; R313-H316 PolarHBondContact O-N 3.12Å; R313-V317 WeakPolarHBondContact O-CB 3.49Å; R313-V317 WeakPolarHBondContact O-CG2 3.29Å; R313-V317 PolarHBondContact O-N 3.04Å
314	R	75.4	Confident	69.4	Low	203 Å²	203	116.8 Å²	116.8	77%	0.766	57%	0.573	S	S	*	*	H	α-helix	trans	-68.8	-40.4	-179.5	-155.2	176.5	-165.3	177	4	111.5	E310 E311 E312 A318	E310-R314 WeakPolarHBondContact O-CB 3.31Å; E310-R314 PolarHBondContact O-N 3.26Å; E311-R314 WeakPolarHBondContact O-CB 3.34Å; E311-R314 PolarHBondContact O-N 3.17Å; E311-R314 VanDerWaalsContact O-N 3.11Å; E312-R314 VanDerWaalsContact C-N 3.27Å; E312-R314 PolarHBondContact O-N 2.96Å; R314-A318 WeakPolarHBondContact O-CB 3.45Å; R314-A318 PolarHBondContact O-N 3.13Å
315	E	75.2	Confident	71.1	Confident	120 Å²	120	118.2 Å²	118.2	56%	0.561	57%	0.573	S	S	*	*	H	α-helix	trans	-67.2	-41.1	174.2	-73.3	-170.4	171.7	0	0	112.5	E311 E312 A318 K319	E311-E315 PolarHBondContact O-N 3Å; E312-E315 PolarHBondContact O-N 2.76Å; E315-A318 PolarHBondContact O-N 2.87Å; E315-K319 PolarHBondContact O-N 2.86Å
316	H	72.1	Confident	72.6	Confident	120 Å²	120	117.9 Å²	117.9	56%	0.556	56%	0.562	S	S	*	*	H	α-helix	trans	-63.8	-43.5	175.8	-170.7	-81.9	0	0	0	111.1	E312 R313 A318 K319 M320	E312-H316 WeakPolarHBondContact O-CB 3.27Å; E312-H316 PolarHBondContact O-N 2.88Å; R313-H316 PolarHBondContact O-N 3.12Å; H316-A318 VanDerWaalsContact C-N 3.33Å; H316-A318 PolarHBondContact O-N 3.27Å; H316-K319 PolarHBondContact O-N 3.44Å; H316-M320 WeakPolarHBondContact O-CB 3.39Å; H316-M320 VanDerWaalsContact O-CG 3.26Å; H316-M320 WeakPolarHBondContact O-CG 3.46Å; H316-M320 PolarHBondContact O-N 3.05Å
317	V	75.8	Confident	73.5	Confident	90 Å²	90	118.1 Å²	118.1	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-62.2	-40.7	174.5	170.3	0	0	0	0	111.2	R313 M320 K321	R313-V317 WeakPolarHBondContact O-CB 3.49Å; R313-V317 WeakPolarHBondContact O-CG2 3.29Å; R313-V317 PolarHBondContact O-N 3.04Å; V317-M320 PolarHBondContact O-N 3.18Å; V317-K321 WeakPolarHBondContact O-CB 3.39Å; V317-K321 PolarHBondContact O-N 3.08Å
318	A	81.2	Confident	74.4	Confident	60 Å²	60	122.3 Å²	122.3	50%	0.496	57%	0.574	S	S	.	*	H	α-helix	trans	-65.4	-40.9	176	0	0	0	0	0	112.4	R314 E315 H316 K321 K322	R314-A318 WeakPolarHBondContact O-CB 3.45Å; R314-A318 PolarHBondContact O-N 3.13Å; E315-A318 PolarHBondContact O-N 2.87Å; H316-A318 VanDerWaalsContact C-N 3.33Å; H316-A318 PolarHBondContact O-N 3.27Å; A318-K321 PolarHBondContact O-N 3.1Å; A318-K322 WeakPolarHBondContact O-CB 3.44Å; A318-K322 PolarHBondContact O-N 3.37Å
319	K	80.7	Confident	75.7	Confident	149 Å²	149	122.8 Å²	122.8	65%	0.648	58%	0.576	S	S	*	*	H	α-helix	trans	-64.3	-45	174.1	-86.3	-179.9	177.8	170.3	0	112.1	E315 H316 K321 K322 M323	E315-K319 PolarHBondContact O-N 2.86Å; H316-K319 PolarHBondContact O-N 3.44Å; K319-K321 VanDerWaalsContact C-N 3.3Å; K319-K321 PolarHBondContact O-N 3.4Å; K319-K322 PolarHBondContact O-N 2.87Å; K319-M323 WeakPolarHBondContact O-CB 3.42Å; K319-M323 PolarHBondContact O-N 2.65Å
320	M	70.4	Confident	76.8	Confident	106 Å²	106	120 Å²	120	52%	0.522	57%	0.566	S	S	.	*	H	α-helix	trans	-59.9	-43.4	176.6	-73	-61.7	-66.1	0	0	111	H316 V317 K322 M323 E324	H316-M320 WeakPolarHBondContact O-CB 3.39Å; H316-M320 VanDerWaalsContact O-CG 3.26Å; H316-M320 WeakPolarHBondContact O-CG 3.46Å; H316-M320 PolarHBondContact O-N 3.05Å; V317-M320 PolarHBondContact O-N 3.18Å; M320-K322 PolarHBondContact O-N 2.89Å; M320-M323 PolarHBondContact O-N 3.13Å; M320-E324 WeakPolarHBondContact O-CB 3.47Å; M320-E324 PolarHBondContact O-N 3.21Å
321	K	81.9	Confident	77.6	Confident	136 Å²	136	121.7 Å²	121.7	59%	0.591	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-37.2	177.5	-161.8	173.8	-173.7	178.1	0	112.7	V317 A318 K319 M325	V317-K321 WeakPolarHBondContact O-CB 3.39Å; V317-K321 PolarHBondContact O-N 3.08Å; A318-K321 PolarHBondContact O-N 3.1Å; K319-K321 VanDerWaalsContact C-N 3.3Å; K319-K321 PolarHBondContact O-N 3.4Å; K321-M325 WeakPolarHBondContact O-CG 3.27Å; K321-M325 PolarHBondContact O-N 3.47Å
322	K	86.1	Confident	78.4	Confident	134 Å²	134	121.6 Å²	121.6	58%	0.583	57%	0.572	S	S	*	*	H	α-helix	trans	-66.4	-43.8	174.1	-170.2	-176	178.6	-163.7	0	111.5	A318 K319 M320 E324 M325 E326	A318-K322 WeakPolarHBondContact O-CB 3.44Å; A318-K322 PolarHBondContact O-N 3.37Å; K319-K322 PolarHBondContact O-N 2.87Å; M320-K322 PolarHBondContact O-N 2.89Å; K322-E324 VanDerWaalsContact C-N 3.33Å; K322-M325 PolarHBondContact O-N 3.04Å; K322-E326 WeakPolarHBondContact CE-OE1 3.04Å; K322-E326 IonicContact NZ-OE1 3.03Å; K322-E326 WeakPolarHBondContact O-CG 3.42Å; K322-E326 PolarHBondContact O-N 2.94Å
323	M	77.5	Confident	79.2	Confident	119 Å²	119	121.4 Å²	121.4	59%	0.586	57%	0.572	S	S	*	*	H	α-helix	trans	-66	-36.5	178.2	-165.7	173.6	-173.7	0	0	111.9	K319 M320 E326 M327	K319-M323 WeakPolarHBondContact O-CB 3.42Å; K319-M323 PolarHBondContact O-N 2.65Å; M320-M323 PolarHBondContact O-N 3.13Å; M323-E326 PolarHBondContact O-N 3.29Å; M323-M327 WeakPolarHBondContact O-CB 3.37Å; M323-M327 PolarHBondContact O-N 2.84Å
324	E	73.5	Confident	79.8	Confident	127 Å²	127	121.1 Å²	121.1	59%	0.593	58%	0.575	S	S	*	*	H	α-helix	trans	-62.4	-47.6	172.6	-174.2	176	-156.7	0	0	111.2	M320 K322 E326 M327 E328	M320-E324 WeakPolarHBondContact O-CB 3.47Å; M320-E324 PolarHBondContact O-N 3.21Å; K322-E324 VanDerWaalsContact C-N 3.33Å; E324-E326 PolarHBondContact O-N 3.37Å; E324-M327 PolarHBondContact O-N 3.3Å; E324-E328 WeakPolarHBondContact O-CB 3.19Å; E324-E328 PolarHBondContact O-N 3.34Å
325	M	83.2	Confident	80.5	Confident	109 Å²	109	114.5 Å²	114.5	54%	0.537	56%	0.557	S	S	.	*	H	α-helix	trans	-61.2	-41.7	175	-73.4	179.6	65.2	0	0	112.7	K321 K322 E328 Q329	K321-M325 WeakPolarHBondContact O-CG 3.27Å; K321-M325 PolarHBondContact O-N 3.47Å; K322-M325 PolarHBondContact O-N 3.04Å; M325-E328 PolarHBondContact O-N 2.93Å; M325-Q329 WeakPolarHBondContact O-CG 3.26Å; M325-Q329 PolarHBondContact O-N 3.01Å
326	E	84.8	Confident	81.1	Confident	98 Å²	98	114.9 Å²	114.9	46%	0.458	56%	0.557	S	S	.	*	H	α-helix	trans	-66	-42.7	176.6	-74.3	174.9	-172.6	0	0	111.4	K322 M323 E324 Q329 V330	K322-E326 WeakPolarHBondContact CE-OE1 3.04Å; K322-E326 IonicContact NZ-OE1 3.03Å; K322-E326 WeakPolarHBondContact O-CG 3.42Å; K322-E326 PolarHBondContact O-N 2.94Å; M323-E326 PolarHBondContact O-N 3.29Å; E324-E326 PolarHBondContact O-N 3.37Å; E326-Q329 PolarHBondContact O-N 2.78Å; E326-V330 VanDerWaalsContact O-CG2 3.29Å; E326-V330 WeakPolarHBondContact O-CG2 3.38Å; E326-V330 PolarHBondContact O-N 2.9Å
327	M	74.9	Confident	81.9	Confident	138 Å²	138	114 Å²	114	68%	0.68	55%	0.553	S	S	*	*	H	α-helix	trans	-62.9	-41.4	174.3	-95.3	-164.1	73.2	0	0	112.1	M323 E324 V330 F331	M323-M327 WeakPolarHBondContact O-CB 3.37Å; M323-M327 PolarHBondContact O-N 2.84Å; E324-M327 PolarHBondContact O-N 3.3Å; M327-V330 PolarHBondContact O-N 3.03Å; M327-F331 VanDerWaalsContact O-CB 3.26Å; M327-F331 WeakPolarHBondContact O-CB 3.49Å; M327-F331 PolarHBondContact O-N 2.94Å
328	E	80.7	Confident	82.3	Confident	130 Å²	130	116.4 Å²	116.4	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-65.4	-41.8	179.6	-166.6	168.2	-155.1	0	0	111	E324 M325 F331 E332	E324-E328 WeakPolarHBondContact O-CB 3.19Å; E324-E328 PolarHBondContact O-N 3.34Å; M325-E328 PolarHBondContact O-N 2.93Å; E328-F331 PolarHBondContact O-N 3.15Å; E328-E332 WeakPolarHBondContact O-CB 3.32Å; E328-E332 PolarHBondContact O-N 2.98Å
329	Q	85.6	Confident	82.6	Confident	127 Å²	127	117.8 Å²	117.8	59%	0.593	56%	0.558	S	S	*	*	H	α-helix	trans	-62.2	-45.1	172.7	-75.5	179.9	-0.2	0	0	112.6	M325 E326 F331 E332 M333	M325-Q329 WeakPolarHBondContact O-CG 3.26Å; M325-Q329 PolarHBondContact O-N 3.01Å; E326-Q329 PolarHBondContact O-N 2.78Å; Q329-F331 VanDerWaalsContact C-N 3.31Å; Q329-F331 PolarHBondContact O-N 3.5Å; Q329-E332 PolarHBondContact O-N 3.44Å; Q329-M333 WeakPolarHBondContact O-CB 3.41Å; Q329-M333 PolarHBondContact O-N 3.43Å
330	V	82.9	Confident	83	Confident	75 Å²	75	115.2 Å²	115.2	46%	0.455	55%	0.549	S	S	.	.	H	α-helix	trans	-64.7	-39	177.4	171.5	0	0	0	0	110.9	E326 M327 M333 K334	E326-V330 VanDerWaalsContact O-CG2 3.29Å; E326-V330 WeakPolarHBondContact O-CG2 3.38Å; E326-V330 PolarHBondContact O-N 2.9Å; M327-V330 PolarHBondContact O-N 3.03Å; V330-M333 PolarHBondContact O-N 3.39Å; V330-K334 WeakPolarHBondContact O-CB 3.44Å; V330-K334 WeakPolarHBondContact O-CG 3.29Å; V330-K334 PolarHBondContact O-N 3.44Å
331	F	82.6	Confident	83.9	Confident	139 Å²	139	115.6 Å²	115.6	61%	0.61	55%	0.547	S	S	*	.	H	α-helix	trans	-64.3	-48	176.1	-175.8	-99.3	0	0	0	111	M327 E328 Q329 M333 K334 V335	M327-F331 VanDerWaalsContact O-CB 3.26Å; M327-F331 WeakPolarHBondContact O-CB 3.49Å; M327-F331 PolarHBondContact O-N 2.94Å; E328-F331 PolarHBondContact O-N 3.15Å; Q329-F331 VanDerWaalsContact C-N 3.31Å; Q329-F331 PolarHBondContact O-N 3.5Å; F331-M333 VanDerWaalsContact C-N 3.3Å; F331-M333 PolarHBondContact O-N 2.66Å; F331-K334 PolarHBondContact O-N 2.85Å; F331-V335 HydrophobicContact CD1-CG2 3.98Å; F331-V335 HydrophobicContact CE1-CG2 3.63Å; F331-V335 HydrophobicContact CE2-CG2 4.3Å; F331-V335 HydrophobicContact CG-CG2 4.45Å; F331-V335 HydrophobicContact CZ-CG2 3.81Å; F331-V335 WeakPolarHBondContact O-CB 3.46Å; F331-V335 VanDerWaalsContact O-CG2 3.29Å; F331-V335 WeakPolarHBondContact O-CG2 3.45Å; F331-V335 PolarHBondContact O-N 2.98Å
332	E	84.3	Confident	83.9	Confident	100 Å²	100	114.5 Å²	114.5	47%	0.467	55%	0.547	S	S	.	.	H	α-helix	trans	-61.2	-40.4	178.2	-158.4	-168	158.5	0	0	111.5	E328 Q329 V335 K336	E328-E332 WeakPolarHBondContact O-CB 3.32Å; E328-E332 PolarHBondContact O-N 2.98Å; Q329-E332 PolarHBondContact O-N 3.44Å; E332-V335 PolarHBondContact O-N 3.36Å; E332-K336 WeakPolarHBondContact O-CB 3.47Å; E332-K336 WeakPolarHBondContact O-CG 3.47Å; E332-K336 PolarHBondContact O-N 3.3Å; E332-K336 WeakPolarHBondContact OE1-CE 3.41Å; E332-K336 IonicContact OE1-NZ 3.56Å; E332-K336 PolarHBondContact OE1-NZ 2.81Å
333	M	84.1	Confident	84.1	Confident	130 Å²	130	114.5 Å²	114.5	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-43.8	176	-162.1	172.2	71.6	0	0	111.7	Q329 V330 F331 K336 E337	Q329-M333 WeakPolarHBondContact O-CB 3.41Å; Q329-M333 PolarHBondContact O-N 3.43Å; V330-M333 PolarHBondContact O-N 3.39Å; F331-M333 VanDerWaalsContact C-N 3.3Å; F331-M333 PolarHBondContact O-N 2.66Å; M333-K336 PolarHBondContact O-N 3.01Å; M333-E337 WeakPolarHBondContact O-CB 3.4Å; M333-E337 PolarHBondContact O-N 3Å
334	K	83.7	Confident	84.7	Confident	134 Å²	134	113.1 Å²	113.1	58%	0.583	54%	0.542	S	S	*	.	H	α-helix	trans	-65.4	-38.4	175.2	-81.1	-172.4	176.3	-178.9	0	112.8	V330 F331 E337 K338	V330-K334 WeakPolarHBondContact O-CB 3.44Å; V330-K334 WeakPolarHBondContact O-CG 3.29Å; V330-K334 PolarHBondContact O-N 3.44Å; F331-K334 PolarHBondContact O-N 2.85Å; K334-E337 PolarHBondContact O-N 3.3Å; K334-K338 WeakPolarHBondContact O-CB 3.28Å; K334-K338 PolarHBondContact O-N 2.62Å
335	V	89.1	Confident	85.2	Confident	64 Å²	64	110.4 Å²	110.4	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-47.5	175.9	169.8	0	0	0	0	109.8	F331 E332 E337 K338 V339	F331-V335 HydrophobicContact CD1-CG2 3.98Å; F331-V335 HydrophobicContact CE1-CG2 3.63Å; F331-V335 HydrophobicContact CE2-CG2 4.3Å; F331-V335 HydrophobicContact CG-CG2 4.45Å; F331-V335 HydrophobicContact CZ-CG2 3.81Å; F331-V335 WeakPolarHBondContact O-CB 3.46Å; F331-V335 VanDerWaalsContact O-CG2 3.29Å; F331-V335 WeakPolarHBondContact O-CG2 3.45Å; F331-V335 PolarHBondContact O-N 2.98Å; E332-V335 PolarHBondContact O-N 3.36Å; V335-E337 VanDerWaalsContact C-N 3.33Å; V335-E337 PolarHBondContact O-N 2.71Å; V335-K338 PolarHBondContact O-N 3.42Å; V335-V339 HydrophobicContact CG1-CG2 4.26Å; V335-V339 WeakPolarHBondContact O-CB 3.43Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.46Å; V335-V339 PolarHBondContact O-N 3.07Å
336	K	88.1	Confident	85.4	Confident	128 Å²	128	111.3 Å²	111.3	56%	0.557	54%	0.54	S	S	*	.	H	α-helix	trans	-57.4	-45.2	174.9	-77.8	173.9	-176.1	160.3	0	111.8	E332 M333 K338 V339 Q340	E332-K336 WeakPolarHBondContact O-CB 3.47Å; E332-K336 WeakPolarHBondContact O-CG 3.47Å; E332-K336 PolarHBondContact O-N 3.3Å; E332-K336 WeakPolarHBondContact OE1-CE 3.41Å; E332-K336 IonicContact OE1-NZ 3.56Å; E332-K336 PolarHBondContact OE1-NZ 2.81Å; M333-K336 PolarHBondContact O-N 3.01Å; K336-K338 PolarHBondContact O-N 2.93Å; K336-V339 PolarHBondContact O-N 2.94Å; K336-Q340 WeakPolarHBondContact O-CB 3.3Å; K336-Q340 PolarHBondContact O-N 2.99Å
337	E	88.4	Confident	85.7	Confident	101 Å²	101	108.8 Å²	108.8	47%	0.472	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-42.9	177.2	-165.1	-165.4	148.3	0	0	112.1	M333 K334 V335 Q340 K341	M333-E337 WeakPolarHBondContact O-CB 3.4Å; M333-E337 PolarHBondContact O-N 3Å; K334-E337 PolarHBondContact O-N 3.3Å; V335-E337 VanDerWaalsContact C-N 3.33Å; V335-E337 PolarHBondContact O-N 2.71Å; E337-Q340 PolarHBondContact O-N 2.89Å; E337-K341 WeakPolarHBondContact O-CG 3.28Å; E337-K341 PolarHBondContact O-N 3.4Å; E337-K341 WeakPolarHBondContact OE1-CE 3.46Å; E337-K341 IonicContact OE1-NZ 3.9Å; E337-K341 PolarHBondContact OE1-NZ 3.3Å
338	K	85	Confident	86.4	Confident	141 Å²	141	106.9 Å²	106.9	61%	0.613	53%	0.526	S	S	*	.	H	α-helix	trans	-67.9	-41.2	178.3	-100.2	-71.9	-178.2	176.6	0	112.8	K334 V335 K336 Q340 K341 L342	K334-K338 WeakPolarHBondContact O-CB 3.28Å; K334-K338 PolarHBondContact O-N 2.62Å; V335-K338 PolarHBondContact O-N 3.42Å; K336-K338 PolarHBondContact O-N 2.93Å; K338-Q340 VanDerWaalsContact C-N 3.32Å; K338-K341 PolarHBondContact O-N 2.87Å; K338-L342 WeakPolarHBondContact O-CG 3.49Å; K338-L342 PolarHBondContact O-N 3.34Å
339	V	87.1	Confident	86.8	Confident	89 Å²	89	106.6 Å²	106.6	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-42.6	175.3	170.2	0	0	0	0	110.2	V335 K336 L342 K343	V335-V339 HydrophobicContact CG1-CG2 4.26Å; V335-V339 WeakPolarHBondContact O-CB 3.43Å; V335-V339 VanDerWaalsContact O-CG2 3.28Å; V335-V339 WeakPolarHBondContact O-CG2 3.46Å; V335-V339 PolarHBondContact O-N 3.07Å; K336-V339 PolarHBondContact O-N 2.94Å; V339-L342 PolarHBondContact O-N 3.05Å; V339-K343 PolarHBondContact O-N 2.88Å
340	Q	89.6	Confident	86.9	Confident	95 Å²	95	106.8 Å²	106.8	44%	0.444	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-46.2	175.9	-171.3	59.6	44.1	0	0	111.6	K336 E337 K338 L342 K343 D344	K336-Q340 WeakPolarHBondContact O-CB 3.3Å; K336-Q340 PolarHBondContact O-N 2.99Å; E337-Q340 PolarHBondContact O-N 2.89Å; K338-Q340 VanDerWaalsContact C-N 3.32Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 2.82Å; Q340-K343 WeakPolarHBondContact O-CB 3.45Å; Q340-K343 PolarHBondContact O-N 3.31Å; Q340-K343 VanDerWaalsContact O-N 3.16Å; Q340-D344 PolarHBondContact NE2-OD1 3.26Å; Q340-D344 VanDerWaalsContact O-CG 3.29Å; Q340-D344 PolarHBondContact O-N 3.19Å
341	K	88	Confident	87.3	Confident	114 Å²	114	112.1 Å²	112.1	50%	0.496	54%	0.54	S	S	.	.	H	α-helix	trans	-59.4	-39	175.5	-78.1	176.3	174.3	167.4	0	113	E337 K338 S345	E337-K341 WeakPolarHBondContact O-CG 3.28Å; E337-K341 PolarHBondContact O-N 3.4Å; E337-K341 WeakPolarHBondContact OE1-CE 3.46Å; E337-K341 IonicContact OE1-NZ 3.9Å; E337-K341 PolarHBondContact OE1-NZ 3.3Å; K338-K341 PolarHBondContact O-N 2.87Å; K341-S345 VanDerWaalsContact O-CB 3.27Å; K341-S345 WeakPolarHBondContact O-CB 3.27Å; K341-S345 PolarHBondContact O-N 2.85Å
342	L	83.3	Confident	87.6	Confident	113 Å²	113	113 Å²	113	59%	0.592	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-42.5	175.9	-76.9	171.8	0	0	0	111.5	K338 V339 Q340 S345 E346	K338-L342 WeakPolarHBondContact O-CG 3.49Å; K338-L342 PolarHBondContact O-N 3.34Å; V339-L342 PolarHBondContact O-N 3.05Å; Q340-L342 VanDerWaalsContact C-N 3.31Å; Q340-L342 PolarHBondContact O-N 2.82Å; L342-S345 WeakPolarHBondContact O-CB 3.49Å; L342-S345 PolarHBondContact O-N 2.8Å; L342-E346 WeakPolarHBondContact O-CB 3.45Å; L342-E346 PolarHBondContact O-N 2.89Å
343	K	90.2	Very high	87.8	Confident	134 Å²	134	114.6 Å²	114.6	58%	0.583	55%	0.547	S	S	*	.	H	α-helix	trans	-63.1	-42	177.1	-168.6	178	-178.7	179.8	0	112.2	V339 Q340 E346 A347	V339-K343 PolarHBondContact O-N 2.88Å; Q340-K343 WeakPolarHBondContact O-CB 3.45Å; Q340-K343 PolarHBondContact O-N 3.31Å; Q340-K343 VanDerWaalsContact O-N 3.16Å; K343-E346 PolarHBondContact O-N 3.22Å; K343-A347 WeakPolarHBondContact O-CB 3.48Å; K343-A347 PolarHBondContact O-N 3.14Å
344	D	89.1	Confident	88.1	Confident	89 Å²	89	113.8 Å²	113.8	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-40.4	176.8	-63.1	-20.4	0	0	0	111.1	Q340 A347 E348	Q340-D344 PolarHBondContact NE2-OD1 3.26Å; Q340-D344 VanDerWaalsContact O-CG 3.29Å; Q340-D344 PolarHBondContact O-N 3.19Å; D344-A347 PolarHBondContact O-N 3.2Å; D344-E348 PolarHBondContact O-N 2.86Å
345	S	85.6	Confident	88.4	Confident	71 Å²	71	113.6 Å²	113.6	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-42.4	175	177.9	0	0	0	0	112.5	K341 L342 E348 L349	K341-S345 VanDerWaalsContact O-CB 3.27Å; K341-S345 WeakPolarHBondContact O-CB 3.27Å; K341-S345 PolarHBondContact O-N 2.85Å; L342-S345 WeakPolarHBondContact O-CB 3.49Å; L342-S345 PolarHBondContact O-N 2.8Å; S345-E348 PolarHBondContact O-N 3.02Å; S345-L349 WeakPolarHBondContact O-CB 3.47Å; S345-L349 PolarHBondContact O-N 3.28Å
346	E	86.8	Confident	88.4	Confident	127 Å²	127	116.3 Å²	116.3	59%	0.593	55%	0.552	S	S	*	*	H	α-helix	trans	-63.4	-44.2	175.9	-174.8	177.6	-161.2	0	0	110.9	L342 K343 E348 L349 Q350	L342-E346 WeakPolarHBondContact O-CB 3.45Å; L342-E346 PolarHBondContact O-N 2.89Å; K343-E346 PolarHBondContact O-N 3.22Å; E346-E348 PolarHBondContact O-N 3.05Å; E346-L349 PolarHBondContact O-N 3.21Å; E346-Q350 WeakPolarHBondContact O-CB 3.35Å; E346-Q350 PolarHBondContact O-N 3.02Å
347	A	89.7	Confident	88.6	Confident	45 Å²	45	116 Å²	116	37%	0.372	55%	0.551	S	S	.	*	H	α-helix	trans	-62.9	-39.1	176.6	0	0	0	0	0	112.8	K343 D344 Q350 R351	K343-A347 WeakPolarHBondContact O-CB 3.48Å; K343-A347 PolarHBondContact O-N 3.14Å; D344-A347 PolarHBondContact O-N 3.2Å; A347-Q350 PolarHBondContact O-N 3.45Å; A347-R351 WeakPolarHBondContact O-CG 3.41Å; A347-R351 PolarHBondContact O-N 2.94Å; A347-R351 VanDerWaalsContact O-N 3.1Å
348	E	90.4	Very high	88.8	Confident	99 Å²	99	117.2 Å²	117.2	46%	0.463	56%	0.555	S	S	.	*	H	α-helix	trans	-66.2	-43.3	175	-166.6	-175.1	159.7	0	0	111.6	D344 S345 E346 Q350 R351 R352	D344-E348 PolarHBondContact O-N 2.86Å; S345-E348 PolarHBondContact O-N 3.02Å; E346-E348 PolarHBondContact O-N 3.05Å; E348-Q350 VanDerWaalsContact C-N 3.31Å; E348-Q350 PolarHBondContact O-N 2.8Å; E348-R351 PolarHBondContact O-N 3.16Å; E348-R352 WeakPolarHBondContact O-CG 3.49Å; E348-R352 PolarHBondContact O-N 2.95Å; E348-R352 IonicContact OE1-CZ 2.72Å; E348-R352 IonicContact OE1-NE 3.95Å; E348-R352 PolarHBondContact OE1-NE 3.21Å; E348-R352 IonicContact OE1-NH2 3.05Å; E348-R352 PolarHBondContact OE1-NH2 2.91Å
349	L	88.4	Confident	89	Confident	123 Å²	123	115.1 Å²	115.1	64%	0.644	55%	0.551	S	S	*	*	H	α-helix	trans	-61.5	-41.6	177.1	-165.4	72.1	0	0	0	111.3	S345 E346 R351 R352 H353	S345-L349 WeakPolarHBondContact O-CB 3.47Å; S345-L349 PolarHBondContact O-N 3.28Å; E346-L349 PolarHBondContact O-N 3.21Å; L349-R351 PolarHBondContact O-N 2.99Å; L349-R352 PolarHBondContact O-N 3.43Å; L349-H353 WeakPolarHBondContact O-CB 3.45Å; L349-H353 PolarHBondContact O-N 3.42Å
350	Q	89.5	Confident	89	Confident	132 Å²	132	115.9 Å²	115.9	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-60.8	-44.8	176.4	-159	117.5	-7	0	0	111.7	E346 A347 E348 H353 E354	E346-Q350 WeakPolarHBondContact O-CB 3.35Å; E346-Q350 PolarHBondContact O-N 3.02Å; A347-Q350 PolarHBondContact O-N 3.45Å; E348-Q350 VanDerWaalsContact C-N 3.31Å; E348-Q350 PolarHBondContact O-N 2.8Å; Q350-H353 PolarHBondContact O-N 3.17Å; Q350-E354 PolarHBondContact O-N 2.86Å
351	R	91.3	Very high	89.1	Confident	186 Å²	186	116.5 Å²	116.5	70%	0.702	55%	0.554	S	S	*	*	H	α-helix	trans	-62	-43.6	175.9	-73.4	176.7	-174.1	167.6	3.5	112	A347 E348 L349 H353 E354 Q355	A347-R351 WeakPolarHBondContact O-CG 3.41Å; A347-R351 PolarHBondContact O-N 2.94Å; A347-R351 VanDerWaalsContact O-N 3.1Å; E348-R351 PolarHBondContact O-N 3.16Å; L349-R351 PolarHBondContact O-N 2.99Å; R351-H353 VanDerWaalsContact C-N 3.33Å; R351-H353 PolarHBondContact O-N 3.36Å; R351-E354 PolarHBondContact O-N 2.96Å; R351-Q355 WeakPolarHBondContact O-CB 3.32Å; R351-Q355 PolarHBondContact O-N 3.47Å
352	R	87.8	Confident	89.2	Confident	158 Å²	158	113.9 Å²	113.9	60%	0.596	55%	0.554	S	S	*	*	H	α-helix	trans	-62.6	-42	176.5	-72.6	-174.9	-172.4	-167.5	3.9	111.6	E348 L349 Q355 M356	E348-R352 WeakPolarHBondContact O-CG 3.49Å; E348-R352 PolarHBondContact O-N 2.95Å; E348-R352 IonicContact OE1-CZ 2.72Å; E348-R352 IonicContact OE1-NE 3.95Å; E348-R352 PolarHBondContact OE1-NE 3.21Å; E348-R352 IonicContact OE1-NH2 3.05Å; E348-R352 PolarHBondContact OE1-NH2 2.91Å; L349-R352 PolarHBondContact O-N 3.43Å; R352-Q355 PolarHBondContact O-N 3.49Å; R352-M356 WeakPolarHBondContact O-CB 3.5Å; R352-M356 PolarHBondContact O-N 3.26Å
353	H	88.1	Confident	89.4	Confident	133 Å²	133	114 Å²	114	62%	0.616	55%	0.551	S	S	*	*	H	α-helix	trans	-63.6	-43.4	178.2	-168.8	-110.7	0	0	0	111.5	L349 Q350 R351 Q355 M356 K357	L349-H353 WeakPolarHBondContact O-CB 3.45Å; L349-H353 PolarHBondContact O-N 3.42Å; Q350-H353 PolarHBondContact O-N 3.17Å; R351-H353 VanDerWaalsContact C-N 3.33Å; R351-H353 PolarHBondContact O-N 3.36Å; H353-Q355 PolarHBondContact O-N 2.88Å; H353-M356 PolarHBondContact O-N 3.24Å; H353-K357 WeakPolarHBondContact O-CB 3.48Å; H353-K357 PolarHBondContact O-N 3.16Å
354	E	90.4	Very high	89.4	Confident	113 Å²	113	113 Å²	113	53%	0.528	55%	0.548	S	S	.	.	H	α-helix	trans	-65.9	-37.6	177.1	-168.8	162.3	-162	0	0	112.6	Q350 R351 K357 K358	Q350-E354 PolarHBondContact O-N 2.86Å; R351-E354 PolarHBondContact O-N 2.96Å; E354-K357 PolarHBondContact O-N 3.44Å; E354-K358 WeakPolarHBondContact O-CG 3.48Å; E354-K358 PolarHBondContact O-N 2.83Å
355	Q	90.9	Very high	89.5	Confident	130 Å²	130	115.8 Å²	115.8	61%	0.607	56%	0.556	S	S	*	*	H	α-helix	trans	-67.9	-41.9	175	-168.8	163	9.9	0	0	112.2	R351 R352 H353 K357 K358 N359	R351-Q355 WeakPolarHBondContact O-CB 3.32Å; R351-Q355 PolarHBondContact O-N 3.47Å; R352-Q355 PolarHBondContact O-N 3.49Å; H353-Q355 PolarHBondContact O-N 2.88Å; Q355-K357 VanDerWaalsContact C-N 3.32Å; Q355-K357 PolarHBondContact O-N 3.47Å; Q355-K358 PolarHBondContact O-N 3.07Å; Q355-N359 PolarHBondContact O-N 3.36Å
356	M	89.6	Confident	89.8	Confident	121 Å²	121	117.1 Å²	117.1	60%	0.596	55%	0.554	S	S	*	*	H	α-helix	trans	-62.5	-40.6	175	-173.3	177.6	-75.6	0	0	111.4	R352 H353 N359 L360	R352-M356 WeakPolarHBondContact O-CB 3.5Å; R352-M356 PolarHBondContact O-N 3.26Å; H353-M356 PolarHBondContact O-N 3.24Å; M356-N359 PolarHBondContact O-N 2.79Å; M356-L360 HydrophobicContact CG-CD1 4.43Å; M356-L360 PolarHBondContact O-N 3.4Å
357	K	91.5	Very high	89.9	Confident	121 Å²	121	116.6 Å²	116.6	53%	0.526	56%	0.555	S	S	.	*	H	α-helix	trans	-61.1	-46.9	175.7	-172.3	-179.1	176.3	-172.4	0	112	H353 E354 Q355 N359 L360 E361	H353-K357 WeakPolarHBondContact O-CB 3.48Å; H353-K357 PolarHBondContact O-N 3.16Å; E354-K357 PolarHBondContact O-N 3.44Å; Q355-K357 VanDerWaalsContact C-N 3.32Å; Q355-K357 PolarHBondContact O-N 3.47Å; K357-N359 VanDerWaalsContact C-N 3.3Å; K357-N359 PolarHBondContact O-N 3.43Å; K357-L360 PolarHBondContact O-N 2.98Å; K357-E361 VanDerWaalsContact CE-OE1 3.22Å; K357-E361 WeakPolarHBondContact CE-OE1 3.29Å; K357-E361 WeakPolarHBondContact O-CG 3.42Å; K357-E361 PolarHBondContact O-N 2.85Å
358	K	91.7	Very high	90	Very high	127 Å²	127	119.7 Å²	119.7	55%	0.552	56%	0.562	S	S	*	*	H	α-helix	trans	-60.2	-39.6	175.9	-74.7	179.3	-178.3	176.1	0	112.4	E354 Q355 E361 A362	E354-K358 WeakPolarHBondContact O-CG 3.48Å; E354-K358 PolarHBondContact O-N 2.83Å; Q355-K358 PolarHBondContact O-N 3.07Å; K358-E361 PolarHBondContact O-N 3.3Å; K358-A362 WeakPolarHBondContact O-CB 3.29Å; K358-A362 PolarHBondContact O-N 3.26Å
359	N	89.3	Confident	90	Very high	98 Å²	98	120.6 Å²	120.6	52%	0.524	57%	0.566	S	S	.	*	H	α-helix	trans	-65.3	-41.8	176.2	-73.7	-4.7	0	0	0	111.9	Q355 M356 K357 A362 Q363	Q355-N359 PolarHBondContact O-N 3.36Å; M356-N359 PolarHBondContact O-N 2.79Å; K357-N359 VanDerWaalsContact C-N 3.3Å; K357-N359 PolarHBondContact O-N 3.43Å; N359-A362 PolarHBondContact O-N 3.37Å; N359-Q363 WeakPolarHBondContact O-CG 3.49Å; N359-Q363 PolarHBondContact O-N 3.14Å
360	L	88.8	Confident	90.1	Very high	104 Å²	104	120 Å²	120	55%	0.545	56%	0.558	S	S	.	*	H	α-helix	trans	-64.1	-41.7	175.8	-79	168.3	0	0	0	112	M356 K357 A362 Q363 H364	M356-L360 HydrophobicContact CG-CD1 4.43Å; M356-L360 PolarHBondContact O-N 3.4Å; K357-L360 PolarHBondContact O-N 2.98Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.42Å; L360-Q363 PolarHBondContact O-N 2.57Å; L360-H364 WeakPolarHBondContact O-CB 3.36Å; L360-H364 PolarHBondContact O-N 2.89Å
361	E	89.8	Confident	90.1	Very high	109 Å²	109	121.2 Å²	121.2	51%	0.509	56%	0.557	S	S	.	*	H	α-helix	trans	-62.5	-40.5	175	-74.8	172.5	-176.5	0	0	111.7	K357 K358 H364 K365	K357-E361 VanDerWaalsContact CE-OE1 3.22Å; K357-E361 WeakPolarHBondContact CE-OE1 3.29Å; K357-E361 WeakPolarHBondContact O-CG 3.42Å; K357-E361 PolarHBondContact O-N 2.85Å; K358-E361 PolarHBondContact O-N 3.3Å; E361-H364 PolarHBondContact O-N 3.41Å; E361-K365 PolarHBondContact O-N 2.92Å
362	A	90.8	Very high	90	Very high	59 Å²	59	120.5 Å²	120.5	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-64.3	-44.3	175.2	0	0	0	0	0	112.1	K358 N359 L360 H364 K365 E366	K358-A362 WeakPolarHBondContact O-CB 3.29Å; K358-A362 PolarHBondContact O-N 3.26Å; N359-A362 PolarHBondContact O-N 3.37Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.42Å; A362-H364 VanDerWaalsContact C-N 3.35Å; A362-H364 PolarHBondContact O-N 3.29Å; A362-K365 PolarHBondContact O-N 3.41Å; A362-E366 PolarHBondContact O-N 3.45Å
363	Q	88.2	Confident	90.1	Very high	116 Å²	116	118 Å²	118	54%	0.542	55%	0.55	S	S	.	.	H	α-helix	trans	-62.7	-40.7	175.7	-76.3	-174.9	-17.1	0	0	112.3	N359 L360 K365 E366 L367	N359-Q363 WeakPolarHBondContact O-CG 3.49Å; N359-Q363 PolarHBondContact O-N 3.14Å; L360-Q363 PolarHBondContact O-N 2.57Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 2.96Å; Q363-E366 PolarHBondContact O-N 3.2Å; Q363-L367 WeakPolarHBondContact O-CB 3.4Å; Q363-L367 WeakPolarHBondContact O-CG 3.42Å; Q363-L367 PolarHBondContact O-N 3.4Å
364	H	90	Very high	90.2	Very high	113 Å²	113	118.1 Å²	118.1	52%	0.523	55%	0.549	S	S	.	.	H	α-helix	trans	-60.6	-45.5	176.2	-169.4	-82.9	0	0	0	111.2	L360 E361 A362 E366 L367 E368	L360-H364 WeakPolarHBondContact O-CB 3.36Å; L360-H364 PolarHBondContact O-N 2.89Å; E361-H364 PolarHBondContact O-N 3.41Å; A362-H364 VanDerWaalsContact C-N 3.35Å; A362-H364 PolarHBondContact O-N 3.29Å; H364-E366 PolarHBondContact O-N 3.09Å; H364-L367 PolarHBondContact O-N 3.38Å; H364-E368 IonicContact CE1-OE1 3.47Å; H364-E368 PolarHBondContact CE1-OE1 2.94Å; H364-E368 IonicContact ND1-OE1 3.7Å; H364-E368 IonicContact ND1-OE2 2.71Å; H364-E368 WeakPolarHBondContact O-CG 3.26Å; H364-E368 PolarHBondContact O-N 2.93Å
365	K	91.1	Very high	90.1	Very high	146 Å²	146	116.9 Å²	116.9	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-64.3	-40.3	178.4	-164.6	178.5	-178.6	-176.8	0	112.4	E361 A362 Q363 E368 E369	E361-K365 PolarHBondContact O-N 2.92Å; A362-K365 PolarHBondContact O-N 3.41Å; Q363-K365 VanDerWaalsContact C-N 3.33Å; Q363-K365 PolarHBondContact O-N 2.96Å; K365-E368 PolarHBondContact O-N 3.5Å; K365-E369 WeakPolarHBondContact O-CB 3.21Å; K365-E369 PolarHBondContact O-N 3.41Å
366	E	91.1	Very high	90	Very high	99 Å²	99	114.7 Å²	114.7	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.6	-166.7	-168.5	150.5	0	0	111.7	A362 Q363 H364 E369 K370	A362-E366 PolarHBondContact O-N 3.45Å; Q363-E366 PolarHBondContact O-N 3.2Å; H364-E366 PolarHBondContact O-N 3.09Å; E366-E369 PolarHBondContact O-N 2.95Å; E366-K370 WeakPolarHBondContact O-CB 3.3Å; E366-K370 WeakPolarHBondContact O-CG 3.4Å; E366-K370 PolarHBondContact O-N 2.84Å; E366-K370 WeakPolarHBondContact OE1-CE 3.25Å; E366-K370 IonicContact OE1-NZ 3.59Å; E366-K370 PolarHBondContact OE1-NZ 3.48Å
367	L	89.3	Confident	90	Very high	117 Å²	117	115.2 Å²	115.2	61%	0.613	54%	0.536	S	S	*	.	H	α-helix	trans	-66	-39.9	175.6	-75.8	172.4	0	0	0	112.2	Q363 H364 E369 K370 R371	Q363-L367 WeakPolarHBondContact O-CB 3.4Å; Q363-L367 WeakPolarHBondContact O-CG 3.42Å; Q363-L367 PolarHBondContact O-N 3.4Å; H364-L367 PolarHBondContact O-N 3.38Å; L367-E369 VanDerWaalsContact C-N 3.35Å; L367-K370 PolarHBondContact O-N 2.81Å; L367-R371 VanDerWaalsContact O-CB 3.29Å; L367-R371 WeakPolarHBondContact O-CB 3.19Å; L367-R371 PolarHBondContact O-N 3.32Å
368	E	91.1	Very high	89.9	Confident	110 Å²	110	114.9 Å²	114.9	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-62.6	-41.8	173.8	-78.6	-177.7	153	0	0	111.9	H364 K365 R371 R372	H364-E368 IonicContact CE1-OE1 3.47Å; H364-E368 PolarHBondContact CE1-OE1 2.94Å; H364-E368 IonicContact ND1-OE1 3.7Å; H364-E368 IonicContact ND1-OE2 2.71Å; H364-E368 WeakPolarHBondContact O-CG 3.26Å; H364-E368 PolarHBondContact O-N 2.93Å; K365-E368 PolarHBondContact O-N 3.5Å; E368-R371 PolarHBondContact O-N 3.36Å; E368-R372 WeakPolarHBondContact O-CB 3.22Å; E368-R372 PolarHBondContact O-N 3.35Å
369	E	91.3	Very high	89.7	Confident	117 Å²	117	111.4 Å²	111.4	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-67.1	-42.5	178.5	-166	159.6	-158.3	0	0	111.6	K365 E366 L367 R371 R372 Q373	K365-E369 WeakPolarHBondContact O-CB 3.21Å; K365-E369 PolarHBondContact O-N 3.41Å; E366-E369 PolarHBondContact O-N 2.95Å; L367-E369 VanDerWaalsContact C-N 3.35Å; E369-R371 PolarHBondContact O-N 2.83Å; E369-R372 PolarHBondContact O-N 3.4Å; E369-Q373 WeakPolarHBondContact O-CG 3.34Å; E369-Q373 PolarHBondContact O-N 3Å
370	K	90.8	Very high	89.7	Confident	111 Å²	111	111.9 Å²	111.9	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-61.5	-41.4	171.4	-78.5	173.6	171.6	162.8	0	112.4	E366 L367 R372 Q373 F374	E366-K370 WeakPolarHBondContact O-CB 3.3Å; E366-K370 WeakPolarHBondContact O-CG 3.4Å; E366-K370 PolarHBondContact O-N 2.84Å; E366-K370 WeakPolarHBondContact OE1-CE 3.25Å; E366-K370 IonicContact OE1-NZ 3.59Å; E366-K370 PolarHBondContact OE1-NZ 3.48Å; L367-K370 PolarHBondContact O-N 2.81Å; K370-R372 VanDerWaalsContact C-N 3.34Å; K370-Q373 PolarHBondContact O-N 3.08Å; K370-F374 WeakPolarHBondContact O-CB 3.5Å; K370-F374 PolarHBondContact O-N 3.26Å
371	R	88.8	Confident	89.6	Confident	158 Å²	158	114.1 Å²	114.1	60%	0.596	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-43.6	176.7	-177.7	177	179.6	-73.2	-15.8	110.8	L367 E368 E369 F374 E375	L367-R371 VanDerWaalsContact O-CB 3.29Å; L367-R371 WeakPolarHBondContact O-CB 3.19Å; L367-R371 PolarHBondContact O-N 3.32Å; E368-R371 PolarHBondContact O-N 3.36Å; E369-R371 PolarHBondContact O-N 2.83Å; R371-F374 PolarHBondContact O-N 3.4Å; R371-E375 IonicContact CZ-OE1 2.77Å; R371-E375 IonicContact NE-OE1 2.93Å; R371-E375 IonicContact NH1-OE1 3.34Å; R371-E375 PolarHBondContact NH1-OE1 2.83Å; R371-E375 IonicContact NH1-OE2 3.87Å; R371-E375 IonicContact NH2-OE1 3.59Å; R371-E375 PolarHBondContact NH2-OE1 3.18Å; R371-E375 WeakPolarHBondContact O-CG 3.36Å; R371-E375 PolarHBondContact O-N 2.85Å
372	R	90.7	Very high	89.3	Confident	170 Å²	170	112.4 Å²	112.4	64%	0.642	53%	0.525	S	S	*	.	H	α-helix	trans	-64.6	-45.5	176.7	-177.6	-179.3	161	-174.4	-4.7	112	E368 E369 K370 F374 E375 D376	E368-R372 WeakPolarHBondContact O-CB 3.22Å; E368-R372 PolarHBondContact O-N 3.35Å; E369-R372 PolarHBondContact O-N 3.4Å; K370-R372 VanDerWaalsContact C-N 3.34Å; R372-F374 VanDerWaalsContact C-N 3.29Å; R372-F374 PolarHBondContact O-N 3.14Å; R372-E375 PolarHBondContact O-N 2.98Å; R372-D376 PolarHBondContact O-N 2.73Å
373	Q	89.9	Confident	89	Confident	107 Å²	107	111.8 Å²	111.8	50%	0.5	52%	0.521	S	S	.	.	H	α-helix	trans	-58.2	-43.2	175.2	-73.2	174.5	7.5	0	0	111.5	E369 K370 D376 E377	E369-Q373 WeakPolarHBondContact O-CG 3.34Å; E369-Q373 PolarHBondContact O-N 3Å; K370-Q373 PolarHBondContact O-N 3.08Å; Q373-D376 PolarHBondContact O-N 3.22Å; Q373-E377 WeakPolarHBondContact O-CB 3.39Å; Q373-E377 WeakPolarHBondContact O-CG 3.36Å; Q373-E377 PolarHBondContact O-N 2.94Å
374	F	88.6	Confident	88.8	Confident	135 Å²	135	112.5 Å²	112.5	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-64.8	-38.9	176.5	-175.6	-99.2	0	0	0	112.6	K370 R371 R372 K378	K370-F374 WeakPolarHBondContact O-CB 3.5Å; K370-F374 PolarHBondContact O-N 3.26Å; R371-F374 PolarHBondContact O-N 3.4Å; R372-F374 VanDerWaalsContact C-N 3.29Å; R372-F374 PolarHBondContact O-N 3.14Å; F374-K378 VanDerWaalsContact O-CB 3.24Å; F374-K378 WeakPolarHBondContact O-CB 3.43Å; F374-K378 PolarHBondContact O-N 3.46Å
375	E	88.7	Confident	88.3	Confident	86 Å²	86	110.4 Å²	110.4	40%	0.402	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-42.1	173.8	-76.4	178	166	0	0	111.8	R371 R372 K378 A379	R371-E375 IonicContact CZ-OE1 2.77Å; R371-E375 IonicContact NE-OE1 2.93Å; R371-E375 IonicContact NH1-OE1 3.34Å; R371-E375 PolarHBondContact NH1-OE1 2.83Å; R371-E375 IonicContact NH1-OE2 3.87Å; R371-E375 IonicContact NH2-OE1 3.59Å; R371-E375 PolarHBondContact NH2-OE1 3.18Å; R371-E375 WeakPolarHBondContact O-CG 3.36Å; R371-E375 PolarHBondContact O-N 2.85Å; R372-E375 PolarHBondContact O-N 2.98Å; E375-K378 PolarHBondContact O-N 3.11Å; E375-A379 WeakPolarHBondContact O-CB 3.4Å; E375-A379 PolarHBondContact O-N 2.97Å
376	D	89.9	Confident	87.7	Confident	84 Å²	84	111.3 Å²	111.3	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-43.3	176.3	-71.8	-23.1	0	0	0	111.7	R372 Q373 A379 N380	R372-D376 PolarHBondContact O-N 2.73Å; Q373-D376 PolarHBondContact O-N 3.22Å; D376-A379 PolarHBondContact O-N 3.03Å; D376-N380 WeakPolarHBondContact O-CB 3.32Å; D376-N380 PolarHBondContact O-N 3.45Å
377	E	88.3	Confident	87.1	Confident	132 Å²	132	111 Å²	111	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-62.4	-44.2	174.4	-78.4	-176.4	177.6	0	0	111.9	Q373 N380 W381	Q373-E377 WeakPolarHBondContact O-CB 3.39Å; Q373-E377 WeakPolarHBondContact O-CG 3.36Å; Q373-E377 PolarHBondContact O-N 2.94Å; E377-N380 PolarHBondContact O-N 3Å; E377-W381 WeakPolarHBondContact O-CB 3.33Å; E377-W381 PolarHBondContact O-N 2.86Å
378	K	89.6	Confident	86.4	Confident	115 Å²	115	109.4 Å²	109.4	50%	0.5	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-45.7	176.6	-175.6	-176.2	175.6	-169.2	0	111.1	F374 E375 N380 W381 E382	F374-K378 VanDerWaalsContact O-CB 3.24Å; F374-K378 WeakPolarHBondContact O-CB 3.43Å; F374-K378 PolarHBondContact O-N 3.46Å; E375-K378 PolarHBondContact O-N 3.11Å; K378-N380 VanDerWaalsContact C-N 3.35Å; K378-N380 PolarHBondContact O-N 2.83Å; K378-W381 PolarHBondContact O-N 3.29Å; K378-E382 WeakPolarHBondContact CE-OE1 3.35Å; K378-E382 IonicContact NZ-OE1 2.73Å; K378-E382 WeakPolarHBondContact O-CB 3.44Å; K378-E382 WeakPolarHBondContact O-CG 3.26Å; K378-E382 PolarHBondContact O-N 2.94Å
379	A	88.7	Confident	85.6	Confident	53 Å²	53	110.2 Å²	110.2	44%	0.438	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-42.4	177.6	0	0	0	0	0	112	E375 D376 E382 A383	E375-A379 WeakPolarHBondContact O-CB 3.4Å; E375-A379 PolarHBondContact O-N 2.97Å; D376-A379 PolarHBondContact O-N 3.03Å; A379-E382 PolarHBondContact O-N 3.45Å; A379-A383 WeakPolarHBondContact O-CB 3.21Å; A379-A383 PolarHBondContact O-N 3.32Å
380	N	88.3	Confident	84.8	Confident	108 Å²	108	111.3 Å²	111.3	58%	0.578	52%	0.515	S	S	*	.	H	α-helix	trans	-64.2	-42.8	175.4	-80.5	-21.6	0	0	0	112.4	D376 E377 K378 A383 Q384	D376-N380 WeakPolarHBondContact O-CB 3.32Å; D376-N380 PolarHBondContact O-N 3.45Å; E377-N380 PolarHBondContact O-N 3Å; K378-N380 VanDerWaalsContact C-N 3.35Å; K378-N380 PolarHBondContact O-N 2.83Å; N380-A383 PolarHBondContact O-N 3.44Å; N380-Q384 WeakPolarHBondContact O-CG 3.48Å; N380-Q384 PolarHBondContact O-N 2.87Å
381	W	86	Confident	83.8	Confident	152 Å²	152	110.9 Å²	110.9	58%	0.576	52%	0.515	S	S	*	.	H	α-helix	trans	-64	-43.3	176.9	-178	86	0	0	0	111.8	E377 K378 A383 Q384 Q385	E377-W381 WeakPolarHBondContact O-CB 3.33Å; E377-W381 PolarHBondContact O-N 2.86Å; K378-W381 PolarHBondContact O-N 3.29Å; W381-A383 VanDerWaalsContact C-N 3.34Å; W381-A383 PolarHBondContact O-N 3.44Å; W381-Q384 PolarHBondContact O-N 3.14Å; W381-Q385 HydrophobicContact CD2-CG 4.09Å; W381-Q385 HydrophobicContact CE3-CG 4.22Å; W381-Q385 HydrophobicContact CH2-CG 3.89Å; W381-Q385 HydrophobicContact CZ2-CG 3.74Å; W381-Q385 HydrophobicContact CZ3-CG 4.13Å; W381-Q385 PolarHBondContact O-N 3.3Å
382	E	85	Confident	82.8	Confident	72 Å²	72	107.6 Å²	107.6	34%	0.336	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-40.2	174.8	-74.9	-178.7	-172.9	0	0	111.9	K378 A379 Q385 R386	K378-E382 WeakPolarHBondContact CE-OE1 3.35Å; K378-E382 IonicContact NZ-OE1 2.73Å; K378-E382 WeakPolarHBondContact O-CB 3.44Å; K378-E382 WeakPolarHBondContact O-CG 3.26Å; K378-E382 PolarHBondContact O-N 2.94Å; A379-E382 PolarHBondContact O-N 3.45Å; E382-Q385 PolarHBondContact O-N 2.97Å; E382-R386 WeakPolarHBondContact O-CG 3.38Å; E382-R386 PolarHBondContact O-N 3.33Å
383	A	84.1	Confident	81.4	Confident	47 Å²	47	102.6 Å²	102.6	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-42.9	175.1	0	0	0	0	0	111.9	A379 N380 W381 R386 I387	A379-A383 WeakPolarHBondContact O-CB 3.21Å; A379-A383 PolarHBondContact O-N 3.32Å; N380-A383 PolarHBondContact O-N 3.44Å; W381-A383 VanDerWaalsContact C-N 3.34Å; W381-A383 PolarHBondContact O-N 3.44Å; A383-R386 PolarHBondContact O-N 3.31Å; A383-I387 WeakPolarHBondContact O-CG1 3.37Å; A383-I387 PolarHBondContact O-N 2.97Å; A383-I387 VanDerWaalsContact O-N 3.09Å
384	Q	82.8	Confident	80.1	Confident	131 Å²	131	100.9 Å²	100.9	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-63.1	-42.2	175.5	-75.1	179.5	-0.2	0	0	112.3	N380 W381 I387 L388	N380-Q384 WeakPolarHBondContact O-CG 3.48Å; N380-Q384 PolarHBondContact O-N 2.87Å; W381-Q384 PolarHBondContact O-N 3.14Å; Q384-I387 PolarHBondContact O-N 3.05Å; Q384-L388 WeakPolarHBondContact O-CB 3.41Å; Q384-L388 PolarHBondContact O-N 3.23Å
385	Q	79.9	Confident	78.7	Confident	69 Å²	69	102 Å²	102	32%	0.322	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-44.2	175.5	-78.3	-63.9	-26.6	0	0	111.9	W381 E382 I387 L388 E389	W381-Q385 HydrophobicContact CD2-CG 4.09Å; W381-Q385 HydrophobicContact CE3-CG 4.22Å; W381-Q385 HydrophobicContact CH2-CG 3.89Å; W381-Q385 HydrophobicContact CZ2-CG 3.74Å; W381-Q385 HydrophobicContact CZ3-CG 4.13Å; W381-Q385 PolarHBondContact O-N 3.3Å; E382-Q385 PolarHBondContact O-N 2.97Å; Q385-I387 VanDerWaalsContact C-N 3.32Å; Q385-I387 PolarHBondContact O-N 2.85Å; Q385-L388 PolarHBondContact O-N 3.43Å; Q385-L388 VanDerWaalsContact O-N 3.15Å; Q385-E389 PolarHBondContact O-N 2.85Å
386	R	78.9	Confident	77.4	Confident	165 Å²	165	101.5 Å²	101.5	62%	0.623	50%	0.503	S	S	*	.	H	α-helix	trans	-60.4	-40.3	175.8	-72.2	-177.7	-157	-169.4	7.9	112.6	E382 A383 E389 Q390	E382-R386 WeakPolarHBondContact O-CG 3.38Å; E382-R386 PolarHBondContact O-N 3.33Å; A383-R386 PolarHBondContact O-N 3.31Å; R386-E389 PolarHBondContact O-N 3.45Å; R386-Q390 PolarHBondContact O-N 3.12Å
387	I	79.1	Confident	75.8	Confident	93 Å²	93	103.3 Å²	103.3	48%	0.477	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-42.3	175.9	-67.3	166.7	0	0	0	110.4	A383 Q384 Q385 Q390 Q391	A383-I387 WeakPolarHBondContact O-CG1 3.37Å; A383-I387 PolarHBondContact O-N 2.97Å; A383-I387 VanDerWaalsContact O-N 3.09Å; Q384-I387 PolarHBondContact O-N 3.05Å; Q385-I387 VanDerWaalsContact C-N 3.32Å; Q385-I387 PolarHBondContact O-N 2.85Å; I387-Q390 PolarHBondContact O-N 3.48Å; I387-Q391 WeakPolarHBondContact O-CG 3.44Å; I387-Q391 PolarHBondContact O-N 3.1Å
388	L	74.8	Confident	74.4	Confident	83 Å²	83	103.8 Å²	103.8	44%	0.435	51%	0.514	S	S	.	.	H	α-helix	trans	-65.8	-39.7	179.1	-161.3	74.7	0	0	0	111.9	Q384 Q385 Q391 N392	Q384-L388 WeakPolarHBondContact O-CB 3.41Å; Q384-L388 PolarHBondContact O-N 3.23Å; Q385-L388 PolarHBondContact O-N 3.43Å; Q385-L388 VanDerWaalsContact O-N 3.15Å; L388-Q391 PolarHBondContact O-N 3.44Å; L388-N392 WeakPolarHBondContact O-CB 3.48Å; L388-N392 PolarHBondContact O-N 2.96Å
389	E	74.8	Confident	72.9	Confident	127 Å²	127	105.5 Å²	105.5	59%	0.593	52%	0.522	S	S	*	.	H	α-helix	trans	-64.9	-39.8	173.6	-77.4	-175.8	160.1	0	0	112.4	Q385 R386 N392 S393	Q385-E389 PolarHBondContact O-N 2.85Å; R386-E389 PolarHBondContact O-N 3.45Å; E389-N392 PolarHBondContact O-N 3.44Å; E389-S393 WeakPolarHBondContact O-CB 3.19Å; E389-S393 PolarHBondContact O-N 3.3Å; E389-S393 PolarHBondContact O-OG 2.85Å
390	Q	73.4	Confident	71.4	Confident	139 Å²	139	108.1 Å²	108.1	65%	0.65	53%	0.528	S	S	*	.	H	α-helix	trans	-64.8	-41.1	173.2	-81.3	-176.8	-9.3	0	0	112.3	R386 I387 S394	R386-Q390 PolarHBondContact O-N 3.12Å; I387-Q390 PolarHBondContact O-N 3.48Å; Q390-S394 WeakPolarHBondContact O-CB 3.42Å; Q390-S394 PolarHBondContact O-N 3.46Å; Q390-S394 PolarHBondContact O-OG 2.85Å
391	Q	70.8	Confident	69.9	Low	103 Å²	103	111.2 Å²	111.2	48%	0.481	54%	0.537	S	S	.	.	H	α-helix	trans	-66.7	-41.4	175.3	-76.2	-172.2	1	0	0	112.2	I387 L388 S394 R395	I387-Q391 WeakPolarHBondContact O-CG 3.44Å; I387-Q391 PolarHBondContact O-N 3.1Å; L388-Q391 PolarHBondContact O-N 3.44Å; Q391-S394 PolarHBondContact O-N 3.27Å; Q391-R395 WeakPolarHBondContact O-CG 3.41Å; Q391-R395 PolarHBondContact O-N 3.48Å
392	N	66.6	Low	68.5	Low	88 Å²	88	112.7 Å²	112.7	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-64	-45.3	176.1	-90.8	-17.5	0	0	0	111.1	L388 E389 S394 R395 T396	L388-N392 WeakPolarHBondContact O-CB 3.48Å; L388-N392 PolarHBondContact O-N 2.96Å; E389-N392 PolarHBondContact O-N 3.44Å; N392-S394 VanDerWaalsContact C-N 3.29Å; N392-S394 PolarHBondContact O-N 2.96Å; N392-R395 CarbonylContact O-C 3.54Å; N392-R395 WeakPolarHBondContact O-CB 3.3Å; N392-R395 PolarHBondContact O-N 3.36Å; N392-R395 VanDerWaalsContact O-N 3.09Å; N392-T396 PolarHBondContact O-N 2.89Å; N392-T396 PolarHBondContact O-OG1 2.97Å
393	S	62.3	Low	67.1	Low	66 Å²	66	117.7 Å²	117.7	46%	0.462	57%	0.568	S	S	.	*	H	α-helix	trans	-58.4	-40.8	175.3	-61.9	0	0	0	0	112.3	E389 T396 L397	E389-S393 WeakPolarHBondContact O-CB 3.19Å; E389-S393 PolarHBondContact O-N 3.3Å; E389-S393 PolarHBondContact O-OG 2.85Å; S393-T396 WeakPolarHBondContact CA-OG1 3.4Å; S393-T396 PolarHBondContact O-N 3.4Å; S393-T396 PolarHBondContact O-OG1 2.95Å; S393-L397 WeakPolarHBondContact O-CD1 3.44Å; S393-L397 PolarHBondContact O-N 3.07Å
394	S	60.9	Low	65.8	Low	71 Å²	71	118.6 Å²	118.6	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-65.1	-39.9	175	-58.3	0	0	0	0	112.1	Q390 Q391 N392 L397 E398	Q390-S394 WeakPolarHBondContact O-CB 3.42Å; Q390-S394 PolarHBondContact O-N 3.46Å; Q390-S394 PolarHBondContact O-OG 2.85Å; Q391-S394 PolarHBondContact O-N 3.27Å; N392-S394 VanDerWaalsContact C-N 3.29Å; N392-S394 PolarHBondContact O-N 2.96Å; S394-L397 PolarHBondContact O-N 3.12Å; S394-E398 PolarHBondContact O-N 2.89Å
395	R	60.9	Low	64.3	Low	157 Å²	157	121.2 Å²	121.2	59%	0.592	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-34.5	174.1	-75.5	177.8	172.6	-179.2	-0.5	112.9	Q391 N392 K399	Q391-R395 WeakPolarHBondContact O-CG 3.41Å; Q391-R395 PolarHBondContact O-N 3.48Å; N392-R395 CarbonylContact O-C 3.54Å; N392-R395 WeakPolarHBondContact O-CB 3.3Å; N392-R395 PolarHBondContact O-N 3.36Å; N392-R395 VanDerWaalsContact O-N 3.09Å; R395-K399 WeakPolarHBondContact O-CB 3.47Å; R395-K399 PolarHBondContact O-N 2.94Å
396	T	59.7	Low	62.9	Low	77 Å²	77	124.6 Å²	124.6	47%	0.472	61%	0.61	S	S	.	*	H	α-helix	trans	-68.5	-39.1	173.3	0.3	0	0	0	0	111.5	N392 S393 K399 N400	N392-T396 PolarHBondContact O-N 2.89Å; N392-T396 PolarHBondContact O-OG1 2.97Å; S393-T396 WeakPolarHBondContact CA-OG1 3.4Å; S393-T396 PolarHBondContact O-N 3.4Å; S393-T396 PolarHBondContact O-OG1 2.95Å; T396-K399 PolarHBondContact O-N 3.11Å; T396-N400 WeakPolarHBondContact O-CB 3.33Å; T396-N400 PolarHBondContact O-N 3.45Å
397	L	58	Low	61	Low	121 Å²	121	129.9 Å²	129.9	63%	0.634	64%	0.638	S	S	*	*	H	α-helix	trans	-62.5	-40.8	173.4	-82.4	152.3	0	0	0	112.2	S393 S394 N400 K401	S393-L397 WeakPolarHBondContact O-CD1 3.44Å; S393-L397 PolarHBondContact O-N 3.07Å; S394-L397 PolarHBondContact O-N 3.12Å; L397-N400 PolarHBondContact O-N 3.28Å; L397-K401 PolarHBondContact O-N 3.38Å
398	E	58	Low	60.1	Low	143 Å²	143	131.7 Å²	131.7	67%	0.668	65%	0.646	S	S	*	*	H	α-helix	trans	-68.5	-40.1	173.9	-76.7	-159.9	148.1	0	0	113.3	S394 N400 K401 K402	S394-E398 PolarHBondContact O-N 2.89Å; E398-N400 VanDerWaalsContact C-N 3.31Å; E398-N400 PolarHBondContact O-N 3.01Å; E398-K401 PolarHBondContact O-N 3.46Å; E398-K402 PolarHBondContact O-N 3.18Å
399	K	58.3	Low	59.4	Low	150 Å²	150	134.3 Å²	134.3	65%	0.652	66%	0.657	S	S	*	*	H	α-helix	trans	-64.1	-36.2	174.3	-82.9	179.6	175.7	177.4	0	112	R395 T396 K402 K403	R395-K399 WeakPolarHBondContact O-CB 3.47Å; R395-K399 PolarHBondContact O-N 2.94Å; T396-K399 PolarHBondContact O-N 3.11Å; K399-K402 PolarHBondContact O-N 3.23Å; K399-K403 PolarHBondContact O-N 2.99Å; K399-K403 VanDerWaalsContact O-N 3.17Å
400	N	57.2	Low	58.5	Low	108 Å²	108	134.7 Å²	134.7	58%	0.578	66%	0.661	S	S	*	*	H	α-helix	trans	-72.2	-34.6	176.2	-76.3	-11.2	0	0	0	112.5	T396 L397 E398 K402 K403 G404	T396-N400 WeakPolarHBondContact O-CB 3.33Å; T396-N400 PolarHBondContact O-N 3.45Å; L397-N400 PolarHBondContact O-N 3.28Å; E398-N400 VanDerWaalsContact C-N 3.31Å; E398-N400 PolarHBondContact O-N 3.01Å; N400-K402 VanDerWaalsContact C-N 3.3Å; N400-K402 PolarHBondContact O-N 2.92Å; N400-K403 PolarHBondContact O-N 2.82Å; N400-G404 PolarHBondContact O-N 3.03Å
401	K	57.1	Low	57.6	Low	174 Å²	174	134.4 Å²	134.4	76%	0.757	66%	0.661	S	S	*	*	H	α-helix	trans	-62.6	-32.9	170.3	-95.5	-178	174.8	176.2	0	113.3	L397 E398	L397-K401 PolarHBondContact O-N 3.38Å; E398-K401 PolarHBondContact O-N 3.46Å
402	K	55.8	Low	56.8	Low	183 Å²	183	136.4 Å²	136.4	80%	0.796	67%	0.672	S	S	*	*	H	α-helix	trans	-76.5	-26	174.6	-77.9	-176.5	177	177.3	0	113.5	E398 K399 N400	E398-K402 PolarHBondContact O-N 3.18Å; K399-K402 PolarHBondContact O-N 3.23Å; N400-K402 VanDerWaalsContact C-N 3.3Å; N400-K402 PolarHBondContact O-N 2.92Å
403	K	56.9	Low	56.2	Low	176 Å²	176	139.6 Å²	139.6	77%	0.765	69%	0.686	S	S	*	*	H	α-helix	trans	-86.3	-17.2	176.2	-74.1	-172.1	174.5	-173.2	0	114.4	K399 N400 K405	K399-K403 PolarHBondContact O-N 2.99Å; K399-K403 VanDerWaalsContact O-N 3.17Å; N400-K403 PolarHBondContact O-N 2.82Å; K403-K405 VanDerWaalsContact C-N 3.35Å
404	G	55.6	Low	55.7	Low	66 Å²	66	144.9 Å²	144.9	68%	0.68	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	10.4	176.5	0	0	0	0	0	115.7	N400	N400-G404 PolarHBondContact O-N 3.03Å
405	K	52	Low	55.3	Low	187 Å²	187	150.5 Å²	150.5	81%	0.813	72%	0.718	S	S	*	*			trans	-115.7	48.9	177.2	-99.2	-171.3	176.6	-175.6	0	111.4	K403	K403-K405 VanDerWaalsContact C-N 3.35Å
406	I	50.3	Low	54.9	Low	139 Å²	139	150 Å²	150	71%	0.713	73%	0.728	S	S	*	*			trans	-140.4	92.8	159	-55.5	179.2	0	0	0	106.1
407	F	39.6	Very low	54.4	Low	276 Å²	276	156.6 Å²	156.6	100%	1.211	75%	0.751	S	S	*	*			trans	157.2	0	142	-94	-75.1	0	0	0	109.2

Retrieved 407 of 407 residues in 310.5 ms (Link to these results)

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