A0A087Y440_POEFO Loading...

NAD-dependent protein deacylase sirtuin-6

AlphaFold DB , UniProt , Accession A0A087Y440, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 390 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	38.3	Very low	250 Å²	250	158.5 Å²	158.5	100%	1.232	85%	0.847	S	S	*	*				0	136.2	0	-102.2	171.7	151.5	0	0	108.4
2	Q	34.7	Very low	39	Very low	195 Å²	195	158.7 Å²	158.7	91%	0.911	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-72.2	145.5	-146.5	-70.7	159	-24.1	0	0	117.1
3	Q	30.1	Very low	39.4	Very low	194 Å²	194	158.7 Å²	158.7	91%	0.907	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-85.2	144.1	154.4	-77.9	177.4	-16.2	0	0	109.8
4	R	37.7	Very low	39.8	Very low	253 Å²	253	156.3 Å²	156.3	96%	0.955	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-97.5	134	173.9	-75.5	-175.8	176.2	-157.3	-1	110.8
5	S	35	Very low	40.4	Very low	118 Å²	118	154.6 Å²	154.6	83%	0.825	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-102.6	154.8	170.5	46.5	0	0	0	0	111.5
6	S	37.5	Very low	41.6	Very low	113 Å²	113	150 Å²	150	79%	0.79	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.4	150.6	179.1	45.1	0	0	0	0	114.1
7	P	43.2	Very low	42.2	Very low	118 Å²	118	150.1 Å²	150.1	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-100.8	157.2	160.5	34.9	-25.5	0	0	0	111.1
8	S	39.7	Very low	42.4	Very low	92 Å²	92	153.8 Å²	153.8	64%	0.643	79%	0.791	S	S	*	*			cis	163.7	133.2	-29.9	46	0	0	0	0	105.2	D10	S8-D10 PolarHBondContact O-N 3.46Å
9	D	43	Very low	42.7	Very low	161 Å²	161	151.2 Å²	151.2	86%	0.861	78%	0.775	S	S	*	*			trans	-61.3	29.4	-167.8	-66.3	-59.4	0	0	0	118.9	V11	D9-V11 PolarHBondContact O-N 3.37Å
10	D	41.8	Very low	43	Very low	121 Å²	121	147.5 Å²	147.5	65%	0.647	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	4.1	-161	-116.7	-13.3	0	0	0	116.8	S8	S8-D10 PolarHBondContact O-N 3.46Å
11	V	47.1	Very low	43.1	Very low	129 Å²	129	147.4 Å²	147.4	78%	0.782	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-8.8	-178.1	-173.6	0	0	0	0	112.9	D9	D9-V11 PolarHBondContact O-N 3.37Å
12	F	45.8	Very low	43.6	Very low	160 Å²	160	141.1 Å²	141.1	70%	0.702	72%	0.718	S	S	*	*	S	Bend	trans	-89.1	-10.7	-174.2	-105.5	-88.8	0	0	0	115.5	K20	F12-K20 WeakPolarHBondContact O-CE 3.44Å; F12-K20 PolarHBondContact O-NZ 2.74Å
13	Q	44	Very low	43.9	Very low	159 Å²	159	138.9 Å²	138.9	74%	0.743	70%	0.702	S	S	*	*	S	Bend	trans	-92.5	-9.1	-168.1	-73.8	-164.9	-0.9	0	0	116.5
14	T	46.1	Very low	44.9	Very low	125 Å²	125	134.4 Å²	134.4	77%	0.767	68%	0.683	S	S	*	*	S	Bend	trans	-111.1	6.9	-168.6	55.2	0	0	0	0	117
15	K	48.8	Very low	45	Very low	131 Å²	131	126.8 Å²	126.8	57%	0.57	66%	0.661	S	S	*	*	S	Bend	trans	-95.5	139.7	177.3	-67.8	-166.2	178.9	-173.7	0	114.2	K20	K15-K20 VanDerWaalsContact O-CE 3.28Å; K15-K20 WeakPolarHBondContact O-CE 3.39Å
16	P	58.3	Low	45.3	Very low	81 Å²	81	126.7 Å²	126.7	53%	0.526	65%	0.648	S	S	.	*			trans	-58.4	146.2	179.6	-18.6	28.8	0	0	0	113.2	R18 E19 K20	P16-R18 PolarHBondContact O-N 3.44Å; P16-R18 VanDerWaalsContact O-N 3.07Å; P16-E19 PolarHBondContact O-N 3.26Å; P16-K20 PolarHBondContact O-N 3.03Å
17	L	52.1	Low	45.5	Very low	151 Å²	151	124.9 Å²	124.9	79%	0.791	63%	0.629	S	S	*	*	H	α-helix	trans	-52.9	-31.1	-177	-90.6	151.9	0	0	0	114.8	F21	L17-F21 PolarHBondContact O-N 3.18Å
18	R	46.6	Very low	45.1	Very low	217 Å²	217	125.8 Å²	125.8	82%	0.819	62%	0.621	S	S	*	*	H	α-helix	trans	-70.5	-33.3	175.9	-84.8	-171.6	174.1	-154.2	-0.6	113.5	P16 L22	P16-R18 PolarHBondContact O-N 3.44Å; P16-R18 VanDerWaalsContact O-N 3.07Å; R18-L22 PolarHBondContact O-N 2.78Å
19	E	48.1	Very low	44.9	Very low	105 Å²	105	126.9 Å²	126.9	49%	0.491	62%	0.619	S	S	.	*	H	α-helix	trans	-77.2	-33.6	178.4	-70.1	-176.4	175.7	0	0	111.8	P16 F21 L22 W23	P16-E19 PolarHBondContact O-N 3.26Å; E19-F21 VanDerWaalsContact C-N 3.32Å; E19-F21 PolarHBondContact O-N 3.44Å; E19-L22 PolarHBondContact O-N 3.5Å; E19-W23 WeakPolarHBondContact O-CB 3.33Å; E19-W23 PolarHBondContact O-N 3Å
20	K	49.1	Very low	44.8	Very low	77 Å²	77	122.9 Å²	122.9	34%	0.335	60%	0.597	S	S	.	*	H	α-helix	trans	-62.6	-38.1	173.4	-70	-178.2	173.6	-177.9	0	112.1	F12 K15 P16 I24	F12-K20 WeakPolarHBondContact O-CE 3.44Å; F12-K20 PolarHBondContact O-NZ 2.74Å; K15-K20 VanDerWaalsContact O-CE 3.28Å; K15-K20 WeakPolarHBondContact O-CE 3.39Å; P16-K20 PolarHBondContact O-N 3.03Å; K20-I24 WeakPolarHBondContact O-CB 3.19Å; K20-I24 WeakPolarHBondContact O-CD1 3.49Å; K20-I24 VanDerWaalsContact O-CG1 3.29Å; K20-I24 WeakPolarHBondContact O-CG1 3.29Å; K20-I24 PolarHBondContact O-N 2.56Å; K20-I24 VanDerWaalsContact O-N 3.07Å
21	F	43.3	Very low	44.6	Very low	146 Å²	146	123.2 Å²	123.2	64%	0.64	59%	0.594	S	S	*	*	H	α-helix	trans	-71.3	-37	177.2	-124.2	-89.9	0	0	0	112.9	L17 E19 N25	L17-F21 PolarHBondContact O-N 3.18Å; E19-F21 VanDerWaalsContact C-N 3.32Å; E19-F21 PolarHBondContact O-N 3.44Å; F21-N25 VanDerWaalsContact O-CB 3.32Å; F21-N25 WeakPolarHBondContact O-CB 2.99Å; F21-N25 PolarHBondContact O-N 3.37Å; F21-N25 PolarHBondContact O-ND2 3.38Å
22	L	44	Very low	43.8	Very low	118 Å²	118	125.5 Å²	125.5	62%	0.618	59%	0.589	S	S	*	*	H	α-helix	trans	-68.1	-39.4	174.8	-78.2	162.2	0	0	0	111.9	R18 E19 N25 E26	R18-L22 PolarHBondContact O-N 2.78Å; E19-L22 PolarHBondContact O-N 3.5Å; L22-N25 PolarHBondContact O-N 3.06Å; L22-E26 WeakPolarHBondContact O-CB 3.45Å; L22-E26 PolarHBondContact O-N 3.22Å
23	W	41.6	Very low	43.3	Very low	147 Å²	147	121.5 Å²	121.5	56%	0.557	58%	0.578	S	S	*	*	H	α-helix	trans	-72.3	-38.4	179.7	-138.7	69.8	0	0	0	113	E19 E26 L27	E19-W23 WeakPolarHBondContact O-CB 3.33Å; E19-W23 PolarHBondContact O-N 3Å; W23-E26 PolarHBondContact O-N 3.04Å; W23-L27 HydrophobicContact CD2-CD1 4.3Å; W23-L27 HydrophobicContact CE3-CD1 3.41Å; W23-L27 VanDerWaalsContact CE3-CD1 3.41Å; W23-L27 HydrophobicContact CE3-CG 4.26Å; W23-L27 HydrophobicContact CH2-CD1 4.23Å; W23-L27 HydrophobicContact CZ3-CD1 3.38Å; W23-L27 HydrophobicContact CZ3-CG 4.31Å; W23-L27 WeakPolarHBondContact O-CB 3.39Å; W23-L27 WeakPolarHBondContact O-CG 3.24Å; W23-L27 PolarHBondContact O-N 3.01Å
24	I	50.3	Low	42.9	Very low	101 Å²	101	121 Å²	121	52%	0.518	57%	0.573	S	S	.	*	H	α-helix	trans	-66.1	-41.1	172.8	-69.7	167	0	0	0	110.3	K20 L27 F28	K20-I24 WeakPolarHBondContact O-CB 3.19Å; K20-I24 WeakPolarHBondContact O-CD1 3.49Å; K20-I24 VanDerWaalsContact O-CG1 3.29Å; K20-I24 WeakPolarHBondContact O-CG1 3.29Å; K20-I24 PolarHBondContact O-N 2.56Å; K20-I24 VanDerWaalsContact O-N 3.07Å; I24-L27 PolarHBondContact O-N 3.23Å; I24-F28 HydrophobicContact CG2-CD2 4.44Å; I24-F28 WeakPolarHBondContact O-CB 3.38Å; I24-F28 PolarHBondContact O-N 2.99Å
25	N	40.1	Very low	42.3	Very low	93 Å²	93	119.5 Å²	119.5	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-67.7	-39.4	175.3	-82.8	-19.8	0	0	0	112.4	F21 L22 F28 L29	F21-N25 VanDerWaalsContact O-CB 3.32Å; F21-N25 WeakPolarHBondContact O-CB 2.99Å; F21-N25 PolarHBondContact O-N 3.37Å; F21-N25 PolarHBondContact O-ND2 3.38Å; L22-N25 PolarHBondContact O-N 3.06Å; N25-F28 PolarHBondContact O-N 3.43Å; N25-L29 WeakPolarHBondContact O-CB 3.47Å; N25-L29 PolarHBondContact O-N 3.33Å
26	E	41.5	Very low	41.6	Very low	115 Å²	115	117.2 Å²	117.2	54%	0.537	56%	0.561	S	S	.	*	H	α-helix	trans	-63.4	-44.2	172.5	-91.9	-170.5	143.2	0	0	111.6	L22 W23 L29 I30	L22-E26 WeakPolarHBondContact O-CB 3.45Å; L22-E26 PolarHBondContact O-N 3.22Å; W23-E26 PolarHBondContact O-N 3.04Å; E26-L29 PolarHBondContact O-N 3.47Å; E26-I30 HydrophobicContact CB-CD1 4.44Å; E26-I30 WeakPolarHBondContact O-CB 3.35Å; E26-I30 WeakPolarHBondContact O-CD1 3.48Å; E26-I30 WeakPolarHBondContact O-CG1 3.1Å; E26-I30 PolarHBondContact O-N 3.24Å
27	L	40.3	Very low	40.7	Very low	76 Å²	76	118.1 Å²	118.1	40%	0.398	57%	0.565	S	S	.	*	H	α-helix	trans	-63.3	-43.9	174.6	-81.6	168.3	0	0	0	111.8	W23 I24 L29 I30 Q31	W23-L27 HydrophobicContact CD2-CD1 4.3Å; W23-L27 HydrophobicContact CE3-CD1 3.41Å; W23-L27 VanDerWaalsContact CE3-CD1 3.41Å; W23-L27 HydrophobicContact CE3-CG 4.26Å; W23-L27 HydrophobicContact CH2-CD1 4.23Å; W23-L27 HydrophobicContact CZ3-CD1 3.38Å; W23-L27 HydrophobicContact CZ3-CG 4.31Å; W23-L27 WeakPolarHBondContact O-CB 3.39Å; W23-L27 WeakPolarHBondContact O-CG 3.24Å; W23-L27 PolarHBondContact O-N 3.01Å; I24-L27 PolarHBondContact O-N 3.23Å; L27-L29 VanDerWaalsContact C-N 3.34Å; L27-L29 PolarHBondContact O-N 3Å; L27-I30 PolarHBondContact O-N 3.02Å; L27-Q31 WeakPolarHBondContact O-CB 3.3Å; L27-Q31 PolarHBondContact O-N 2.84Å
28	F	36.5	Very low	39.8	Very low	136 Å²	136	112.5 Å²	112.5	60%	0.596	54%	0.54	S	S	*	.	H	α-helix	trans	-65.2	-36.2	176.1	-116.8	-94.8	0	0	0	112.4	I24 N25 R32	I24-F28 HydrophobicContact CG2-CD2 4.44Å; I24-F28 WeakPolarHBondContact O-CB 3.38Å; I24-F28 PolarHBondContact O-N 2.99Å; N25-F28 PolarHBondContact O-N 3.43Å; F28-R32 VanDerWaalsContact O-CB 3.28Å; F28-R32 WeakPolarHBondContact O-CB 3.25Å; F28-R32 PolarHBondContact O-N 3.2Å
29	L	34.7	Very low	39.5	Very low	115 Å²	115	105 Å²	105	60%	0.602	53%	0.525	S	S	*	.	H	α-helix	trans	-75.8	-38.2	178.2	-154	78.5	0	0	0	111.2	N25 E26 L27 T33	N25-L29 WeakPolarHBondContact O-CB 3.47Å; N25-L29 PolarHBondContact O-N 3.33Å; E26-L29 PolarHBondContact O-N 3.47Å; L27-L29 VanDerWaalsContact C-N 3.34Å; L27-L29 PolarHBondContact O-N 3Å; L29-T33 VanDerWaalsContact O-CB 3.27Å; L29-T33 WeakPolarHBondContact O-CB 3.47Å; L29-T33 WeakPolarHBondContact O-CG2 3.48Å; L29-T33 PolarHBondContact O-N 3.16Å; L29-T33 PolarHBondContact O-OG1 3.29Å
30	I	39.8	Very low	39.3	Very low	78 Å²	78	107 Å²	107	40%	0.4	54%	0.536	S	S	.	.	H	α-helix	trans	-66	-39.8	172.5	-70.4	163.9	0	0	0	110.2	E26 L27 T33 K34	E26-I30 HydrophobicContact CB-CD1 4.44Å; E26-I30 WeakPolarHBondContact O-CB 3.35Å; E26-I30 WeakPolarHBondContact O-CD1 3.48Å; E26-I30 WeakPolarHBondContact O-CG1 3.1Å; E26-I30 PolarHBondContact O-N 3.24Å; L27-I30 PolarHBondContact O-N 3.02Å; I30-T33 VanDerWaalsContact CA-OG1 3.29Å; I30-T33 WeakPolarHBondContact CA-OG1 3.34Å; I30-T33 PolarHBondContact O-OG1 2.99Å; I30-T33 VanDerWaalsContact O-OG1 3.1Å; I30-K34 HydrophobicContact CG2-CD 4.1Å; I30-K34 HydrophobicContact CG2-CG 4.49Å; I30-K34 VanDerWaalsContact O-CB 3.24Å; I30-K34 WeakPolarHBondContact O-CB 3.48Å; I30-K34 VanDerWaalsContact O-CG 3.25Å; I30-K34 WeakPolarHBondContact O-CG 3.29Å; I30-K34 PolarHBondContact O-N 2.98Å
31	Q	37.9	Very low	39.2	Very low	127 Å²	127	103.9 Å²	103.9	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-74.1	-41.8	178.6	-152	153.6	11.8	0	0	110.7	L27 T35	L27-Q31 WeakPolarHBondContact O-CB 3.3Å; L27-Q31 PolarHBondContact O-N 2.84Å; Q31-T35 WeakPolarHBondContact O-CB 3.44Å; Q31-T35 PolarHBondContact O-N 3.39Å; Q31-T35 PolarHBondContact O-OG1 2.99Å
32	R	31.8	Very low	39.8	Very low	178 Å²	178	97.1 Å²	97.1	67%	0.672	49%	0.494	S	S	*	.	H	α-helix	trans	-60.4	-47.1	169	-98.7	-176.9	166.4	173.2	-3.5	112.1	F28 T35 T36	F28-R32 VanDerWaalsContact O-CB 3.28Å; F28-R32 WeakPolarHBondContact O-CB 3.25Å; F28-R32 PolarHBondContact O-N 3.2Å; R32-T35 PolarHBondContact O-N 2.76Å; R32-T36 VanDerWaalsContact O-CB 3.32Å; R32-T36 WeakPolarHBondContact O-CB 3.4Å; R32-T36 PolarHBondContact O-N 3.07Å; R32-T36 PolarHBondContact O-OG1 3.3Å
33	T	35	Very low	40.9	Very low	75 Å²	75	94 Å²	94	46%	0.46	48%	0.478	S	S	.	.	H	α-helix	trans	-66.6	-39.9	-179.4	49.5	0	0	0	0	112	L29 I30 T36 V37	L29-T33 VanDerWaalsContact O-CB 3.27Å; L29-T33 WeakPolarHBondContact O-CB 3.47Å; L29-T33 WeakPolarHBondContact O-CG2 3.48Å; L29-T33 PolarHBondContact O-N 3.16Å; L29-T33 PolarHBondContact O-OG1 3.29Å; I30-T33 VanDerWaalsContact CA-OG1 3.29Å; I30-T33 WeakPolarHBondContact CA-OG1 3.34Å; I30-T33 PolarHBondContact O-OG1 2.99Å; I30-T33 VanDerWaalsContact O-OG1 3.1Å; T33-T36 PolarHBondContact O-N 3.37Å; T33-V37 VanDerWaalsContact O-CB 3.29Å; T33-V37 WeakPolarHBondContact O-CB 3.5Å; T33-V37 WeakPolarHBondContact O-CG2 3.29Å; T33-V37 PolarHBondContact O-N 3.49Å
34	K	35.9	Very low	42.5	Very low	149 Å²	149	88.1 Å²	88.1	65%	0.648	46%	0.456	S	S	*	.	H	α-helix	trans	-62.8	-45.1	171.7	-77.2	-179.8	178.2	-176.4	0	112.3	I30 A38	I30-K34 HydrophobicContact CG2-CD 4.1Å; I30-K34 HydrophobicContact CG2-CG 4.49Å; I30-K34 VanDerWaalsContact O-CB 3.24Å; I30-K34 WeakPolarHBondContact O-CB 3.48Å; I30-K34 VanDerWaalsContact O-CG 3.25Å; I30-K34 WeakPolarHBondContact O-CG 3.29Å; I30-K34 PolarHBondContact O-N 2.98Å; K34-A38 WeakPolarHBondContact O-CB 3.4Å; K34-A38 PolarHBondContact O-N 3.2Å
35	T	32.7	Very low	43.8	Very low	93 Å²	93	84 Å²	84	57%	0.571	44%	0.437	S	S	*	.	H	α-helix	trans	-68.4	-35.2	178.3	-50.3	0	0	0	0	112.3	Q31 R32 A39	Q31-T35 WeakPolarHBondContact O-CB 3.44Å; Q31-T35 PolarHBondContact O-N 3.39Å; Q31-T35 PolarHBondContact O-OG1 2.99Å; R32-T35 PolarHBondContact O-N 2.76Å; T35-A39 VanDerWaalsContact O-CB 3.22Å; T35-A39 WeakPolarHBondContact O-CB 3.48Å; T35-A39 PolarHBondContact O-N 3.39Å
36	T	35	Very low	45.7	Very low	83 Å²	83	83.1 Å²	83.1	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-73.9	-42.6	178.7	-40.6	0	0	0	0	110.9	R32 T33 A39 M40	R32-T36 VanDerWaalsContact O-CB 3.32Å; R32-T36 WeakPolarHBondContact O-CB 3.4Å; R32-T36 PolarHBondContact O-N 3.07Å; R32-T36 PolarHBondContact O-OG1 3.3Å; T33-T36 PolarHBondContact O-N 3.37Å; T36-A39 PolarHBondContact O-N 2.95Å; T36-M40 WeakPolarHBondContact O-CB 3.48Å; T36-M40 WeakPolarHBondContact O-CG 3.5Å; T36-M40 PolarHBondContact O-N 3.2Å
37	V	37.6	Very low	47.5	Very low	101 Å²	101	79.3 Å²	79.3	61%	0.612	43%	0.434	S	S	*	.	H	α-helix	trans	-68.8	-40.1	175.6	174.1	0	0	0	0	111.3	T33 M40 S41	T33-V37 VanDerWaalsContact O-CB 3.29Å; T33-V37 WeakPolarHBondContact O-CB 3.5Å; T33-V37 WeakPolarHBondContact O-CG2 3.29Å; T33-V37 PolarHBondContact O-N 3.49Å; V37-M40 PolarHBondContact O-N 2.73Å; V37-S41 PolarHBondContact O-N 2.97Å
38	A	34.4	Very low	49.6	Very low	33 Å²	33	76.9 Å²	76.9	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-61.8	-43.5	173.7	0	0	0	0	0	111.4	K34 M40 V42 T124	K34-A38 WeakPolarHBondContact O-CB 3.4Å; K34-A38 PolarHBondContact O-N 3.2Å; A38-M40 VanDerWaalsContact C-N 3.31Å; A38-M40 PolarHBondContact O-N 2.96Å; A38-V42 WeakPolarHBondContact O-CG2 3.4Å; A38-T124 HydrophobicContact CB-CG2 3.75Å
39	A	39.5	Very low	52.1	Low	59 Å²	59	73.2 Å²	73.2	49%	0.488	41%	0.413	S	S	.	.	H	α-helix	trans	-66.9	-29.5	176	0	0	0	0	0	113.3	T35 T36 N43	T35-A39 VanDerWaalsContact O-CB 3.22Å; T35-A39 WeakPolarHBondContact O-CB 3.48Å; T35-A39 PolarHBondContact O-N 3.39Å; T36-A39 PolarHBondContact O-N 2.95Å; A39-N43 WeakPolarHBondContact O-CB 3.43Å
40	M	43.9	Very low	54.6	Low	148 Å²	148	74 Å²	74	73%	0.729	43%	0.425	S	S	*	.	H	α-helix	trans	-80.9	-30	179.1	-70.8	-140.4	81	0	0	114	T36 V37 A38	T36-M40 WeakPolarHBondContact O-CB 3.48Å; T36-M40 WeakPolarHBondContact O-CG 3.5Å; T36-M40 PolarHBondContact O-N 3.2Å; V37-M40 PolarHBondContact O-N 2.73Å; A38-M40 VanDerWaalsContact C-N 3.31Å; A38-M40 PolarHBondContact O-N 2.96Å
41	S	47.7	Very low	56.8	Low	11 Å²	11	75 Å²	75	8%	0.077	42%	0.424	C	S	.	.	H	α-helix	trans	-74.8	-35.1	-177.2	73.8	0	0	0	0	112.6	V37 F125 E126	V37-S41 PolarHBondContact O-N 2.97Å; S41-F125 WeakPolarHBondContact O-CD2 3.41Å; S41-F125 VanDerWaalsContact O-CE2 3.23Å; S41-F125 WeakPolarHBondContact O-CE2 3.38Å; S41-E126 PolarHBondContact OG-OE2 3.36Å
42	V	56	Low	59.2	Low	3 Å²	3	74 Å²	74	2%	0.018	44%	0.438	C	S	.	.	H	α-helix	trans	-92.4	-20.5	-174.2	-120.7	0	0	0	0	114.6	A38 Y44 F121 T123 F125	A38-V42 WeakPolarHBondContact O-CG2 3.4Å; V42-Y44 PolarHBondContact O-N 3.49Å; V42-F121 HydrophobicContact CB-CB 4.34Å; V42-F121 HydrophobicContact CB-CD1 3.38Å; V42-F121 HydrophobicContact CB-CD2 4.3Å; V42-F121 HydrophobicContact CB-CE1 3.55Å; V42-F121 HydrophobicContact CB-CE2 4.44Å; V42-F121 HydrophobicContact CB-CG 3.78Å; V42-F121 HydrophobicContact CB-CZ 4.1Å; V42-F121 HydrophobicContact CG1-CD1 3.29Å; V42-F121 HydrophobicContact CG1-CE1 3.58Å; V42-F121 HydrophobicContact CG1-CG 4.09Å; V42-F121 HydrophobicContact CG2-CB 4.11Å; V42-F121 HydrophobicContact CG2-CD1 4.08Å; V42-F121 HydrophobicContact CG2-CG 4.04Å; V42-F121 WeakPolarHBondContact O-CE1 3.17Å; V42-F121 VanDerWaalsContact O-CZ 3.29Å; V42-F121 WeakPolarHBondContact O-CZ 3.39Å; V42-T123 WeakPolarHBondContact CG2-O 3.44Å; V42-F125 HydrophobicContact CB-CE2 4.49Å; V42-F125 HydrophobicContact CG1-CD1 4.05Å; V42-F125 HydrophobicContact CG1-CD2 4.12Å; V42-F125 HydrophobicContact CG1-CE1 4.01Å; V42-F125 HydrophobicContact CG1-CE2 4.08Å; V42-F125 HydrophobicContact CG1-CG 4.09Å; V42-F125 HydrophobicContact CG1-CZ 4.02Å
43	N	67.2	Low	62.1	Low	54 Å²	54	70.7 Å²	70.7	29%	0.289	43%	0.433	S	S	.	.			trans	-84.6	61.6	-176.9	-163.9	1.9	0	0	0	112.4	A39 A45 A46	A39-N43 WeakPolarHBondContact O-CB 3.43Å; N43-A45 PolarHBondContact O-N 2.94Å; N43-A46 HydrophobicContact CB-CB 4.31Å; N43-A46 WeakPolarHBondContact ND2-CB 3.31Å; N43-A46 PolarHBondContact O-N 3.4Å; N43-A46 VanDerWaalsContact O-N 3.11Å; N43-A46 PolarHBondContact OD1-N 3.33Å
44	Y	74.1	Confident	64.8	Low	22 Å²	22	67.8 Å²	67.8	9%	0.086	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-58.5	-32.2	178.3	91.7	-68	0	0	0	112.3	V42 A46 G47 L48 F103 W110 V154 M196	V42-Y44 PolarHBondContact O-N 3.49Å; Y44-A46 VanDerWaalsContact C-N 3.25Å; Y44-A46 PolarHBondContact O-N 2.94Å; Y44-G47 PolarHBondContact O-N 3.39Å; Y44-L48 HydrophobicContact CD2-CD1 4.4Å; Y44-L48 HydrophobicContact CE2-CD1 3.87Å; Y44-F103 HydrophobicContact CD1-CE1 4.3Å; Y44-F103 HydrophobicContact CE1-CD1 4.03Å; Y44-F103 AromaticContact CE1-CE1 3.15Å; Y44-F103 HydrophobicContact CE1-CE1 3.15Å; Y44-F103 AromaticContact CE1-CZ 3.7Å; Y44-F103 HydrophobicContact CE1-CZ 3.7Å; Y44-F103 HydrophobicContact CE2-CE1 4.49Å; Y44-F103 HydrophobicContact CE2-CZ 4.4Å; Y44-F103 AromaticContact CZ-CE1 3.25Å; Y44-F103 AromaticContact CZ-CZ 3.48Å; Y44-F103 VanDerWaalsContact CZ-CZ 3.48Å; Y44-F103 WeakPolarHBondContact OH-CD1 3.38Å; Y44-F103 WeakPolarHBondContact OH-CE1 3.45Å; Y44-F103 WeakPolarHBondContact OH-CZ 3.37Å; Y44-W110 VanDerWaalsContact OH-CZ2 3.3Å; Y44-W110 WeakPolarHBondContact OH-CZ2 3.38Å; Y44-V154 HydrophobicContact CD2-CG2 4.21Å; Y44-V154 HydrophobicContact CG-CG2 4.29Å; Y44-M196 VanDerWaalsContact CA-CE 3.42Å
45	A	78	Confident	67.6	Low	14 Å²	14	61.6 Å²	61.6	12%	0.116	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-60	-33.6	177.9	0	0	0	0	0	113.3	N43 G47 L48 V109 W110	N43-A45 PolarHBondContact O-N 2.94Å; A45-G47 PolarHBondContact O-N 3.03Å; A45-L48 PolarHBondContact O-N 3.29Å; A45-V109 HydrophobicContact CB-CG1 3.5Å; A45-W110 HydrophobicContact CB-CH2 3.32Å; A45-W110 HydrophobicContact CB-CZ2 4.23Å; A45-W110 HydrophobicContact CB-CZ3 3.56Å
46	A	79.4	Confident	70.7	Confident	75 Å²	75	61 Å²	61	62%	0.62	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-70.4	-17.5	177.2	0	0	0	0	0	113.8	N43 Y44	N43-A46 HydrophobicContact CB-CB 4.31Å; N43-A46 WeakPolarHBondContact ND2-CB 3.31Å; N43-A46 PolarHBondContact O-N 3.4Å; N43-A46 VanDerWaalsContact O-N 3.11Å; N43-A46 PolarHBondContact OD1-N 3.33Å; Y44-A46 VanDerWaalsContact C-N 3.25Å; Y44-A46 PolarHBondContact O-N 2.94Å
47	G	79.9	Confident	73.6	Confident	35 Å²	35	58.2 Å²	58.2	36%	0.361	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-91.7	-4.1	176.6	0	0	0	0	0	114.6	Y44 A45	Y44-G47 PolarHBondContact O-N 3.39Å; A45-G47 PolarHBondContact O-N 3.03Å
48	L	85.4	Confident	76.4	Confident	26 Å²	26	55 Å²	55	14%	0.136	36%	0.36	C	S	.	.	S	Bend	trans	-85.2	155.9	178.1	-58.6	-175.7	0	0	0	111.8	Y44 A45 W110 W227	Y44-L48 HydrophobicContact CD2-CD1 4.4Å; Y44-L48 HydrophobicContact CE2-CD1 3.87Å; A45-L48 PolarHBondContact O-N 3.29Å; L48-W110 HydrophobicContact CD1-CH2 4.02Å; L48-W110 HydrophobicContact CD1-CZ2 4.2Å; L48-W227 HydrophobicContact CD1-CZ2 4.12Å
49	S	87.6	Confident	79.4	Confident	59 Å²	59	56.1 Å²	56.1	41%	0.413	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-64.9	150.3	171.3	-65.3	0	0	0	0	111.2	Y51 D226 W227	S49-Y51 PolarHBondContact O-N 2.84Å; S49-D226 WeakPolarHBondContact CB-OD1 3.2Å; S49-D226 VanDerWaalsContact CB-OD2 3.28Å; S49-D226 WeakPolarHBondContact CB-OD2 3.3Å; S49-D226 PolarHBondContact N-OD1 2.88Å; S49-D226 PolarHBondContact N-OD2 3.07Å; S49-D226 PolarHBondContact OG-OD2 2.95Å; S49-W227 PolarHBondContact O-NE1 3.48Å
50	P	87.2	Confident	82.2	Confident	131 Å²	131	57.9 Å²	57.9	85%	0.851	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-56.3	135.8	170.9	-23.1	33.5	0	0	0	110.5
51	Y	87.5	Confident	84.8	Confident	98 Å²	98	54.2 Å²	54.2	38%	0.384	35%	0.349	S	S	.	.			trans	-148	127	-179.1	-164.2	-103.2	0	0	0	110.5	S49 D53 K54 W227	S49-Y51 PolarHBondContact O-N 2.84Å; Y51-D53 HydrophobicContact CD1-CB 4.38Å; Y51-D53 VanDerWaalsContact CD1-O 3.24Å; Y51-D53 WeakPolarHBondContact CD1-O 3.27Å; Y51-D53 HydrophobicContact CE1-CB 3.84Å; Y51-D53 VanDerWaalsContact CE1-O 3.24Å; Y51-D53 WeakPolarHBondContact CE1-O 3.46Å; Y51-K54 WeakPolarHBondContact O-CE 3.29Å; Y51-W227 VanDerWaalsContact CB-CD1 3.46Å; Y51-W227 VanDerWaalsContact CB-CG 3.5Å; Y51-W227 HydrophobicContact CD1-CB 4.46Å; Y51-W227 AromaticContact CD1-CD2 3.7Å; Y51-W227 HydrophobicContact CD1-CD2 3.7Å; Y51-W227 AromaticContact CD1-CE3 3.58Å; Y51-W227 HydrophobicContact CD1-CE3 3.58Å; Y51-W227 HydrophobicContact CD1-CG 4.09Å; Y51-W227 HydrophobicContact CD1-CZ3 4.11Å; Y51-W227 HydrophobicContact CD2-CB 3.55Å; Y51-W227 HydrophobicContact CD2-CD2 4.28Å; Y51-W227 AromaticContact CD2-CG 3.77Å; Y51-W227 HydrophobicContact CD2-CG 3.77Å; Y51-W227 HydrophobicContact CE1-CD2 4.42Å; Y51-W227 AromaticContact CE1-CE3 3.95Å; Y51-W227 HydrophobicContact CE1-CE3 3.95Å; Y51-W227 HydrophobicContact CE2-CB 3.95Å; Y51-W227 HydrophobicContact CG-CB 3.84Å; Y51-W227 AromaticContact CG-CD2 3.61Å; Y51-W227 HydrophobicContact CG-CD2 3.61Å; Y51-W227 AromaticContact CG-CE3 3.99Å; Y51-W227 HydrophobicContact CG-CE3 3.99Å; Y51-W227 AromaticContact CG-CG 3.52Å; Y51-W227 HydrophobicContact CG-CG 3.52Å
52	A	87.7	Confident	87.2	Confident	107 Å²	107	56.4 Å²	56.4	88%	0.884	36%	0.364	S	S	*	.	S	Bend	trans	-72.7	-41.2	-171.8	0	0	0	0	0	112.6	K54	A52-K54 PolarHBondContact O-N 2.9Å
53	D	91.6	Very high	89.2	Confident	108 Å²	108	61.6 Å²	61.6	58%	0.578	39%	0.386	S	S	*	.			trans	-89.6	87.5	-176.7	-174.2	11.1	0	0	0	111.9	Y51 G55	Y51-D53 HydrophobicContact CD1-CB 4.38Å; Y51-D53 VanDerWaalsContact CD1-O 3.24Å; Y51-D53 WeakPolarHBondContact CD1-O 3.27Å; Y51-D53 HydrophobicContact CE1-CB 3.84Å; Y51-D53 VanDerWaalsContact CE1-O 3.24Å; Y51-D53 WeakPolarHBondContact CE1-O 3.46Å; D53-G55 WeakPolarHBondContact OD1-CA 3.46Å; D53-G55 PolarHBondContact OD1-N 3.25Å
54	K	93.1	Very high	90.7	Very high	14 Å²	14	60.2 Å²	60.2	6%	0.061	38%	0.379	C	S	.	.			trans	-82.9	-0.3	170.3	-54.5	-60.8	-169.5	-179.5	0	112.9	Y51 A52 R104 W110 W227	Y51-K54 WeakPolarHBondContact O-CE 3.29Å; A52-K54 PolarHBondContact O-N 2.9Å; K54-R104 PolarHBondContact O-NE 2.9Å; K54-R104 PolarHBondContact O-NH2 2.9Å; K54-W110 HydrophobicContact CB-CB 3.98Å; K54-W110 HydrophobicContact CB-CG 4.07Å; K54-W110 HydrophobicContact CD-CD2 3.99Å; K54-W110 HydrophobicContact CD-CE3 4.09Å; K54-W110 HydrophobicContact CD-CG 4.31Å; K54-W110 HydrophobicContact CD-CZ3 4.49Å; K54-W110 HydrophobicContact CG-CB 4.37Å; K54-W110 HydrophobicContact CG-CD2 4.45Å; K54-W110 HydrophobicContact CG-CG 4.34Å; K54-W227 HydrophobicContact CD-CH2 3.76Å; K54-W227 HydrophobicContact CD-CZ2 3.63Å
55	G	94.6	Very high	91.9	Very high	19 Å²	19	61.9 Å²	61.9	20%	0.196	39%	0.394	C	S	.	.			trans	75.3	-168.4	-171.4	0	0	0	0	0	114	D53 C57 K114	D53-G55 WeakPolarHBondContact OD1-CA 3.46Å; D53-G55 PolarHBondContact OD1-N 3.25Å; G55-C57 PolarHBondContact O-SG 2.71Å; G55-C57 VanDerWaalsContact O-SG 3.38Å; G55-K114 PolarHBondContact O-NZ 3.49Å
56	V	96.8	Very high	92.8	Very high	80 Å²	80	65.5 Å²	65.5	49%	0.485	42%	0.418	S	S	.	.	S	Bend	trans	-79.8	120.4	179.9	-169	0	0	0	0	109.3	L59 R104 Q257	V56-L59 HydrophobicContact CG1-CD1 3.89Å; V56-L59 HydrophobicContact CG1-CD2 3.72Å; V56-L59 HydrophobicContact CG1-CG 3.73Å; V56-R104 WeakPolarHBondContact O-CD 3.31Å; V56-Q257 PolarHBondContact O-NE2 3.24Å
57	C	96.8	Very high	93.7	Very high	25 Å²	25	68.5 Å²	68.5	17%	0.169	42%	0.42	C	S	.	.			trans	-120.3	148.3	-172.3	-58.8	0	0	0	0	110.3	G55 L59 T111 K114	G55-C57 PolarHBondContact O-SG 2.71Å; G55-C57 VanDerWaalsContact O-SG 3.38Å; C57-L59 VanDerWaalsContact C-N 3.33Å; C57-L59 PolarHBondContact O-N 3.24Å; C57-T111 WeakPolarHBondContact CB-OG1 3.38Å; C57-K114 HydrophobicContact CB-CD 4.18Å; C57-K114 PolarHBondContact SG-NZ 3.47Å; C57-K114 VanDerWaalsContact SG-NZ 3.43Å
58	G	96.4	Very high	94.6	Very high	34 Å²	34	71.1 Å²	71.1	35%	0.351	42%	0.422	S	S	.	.			trans	68.3	27.8	172.3	0	0	0	0	0	114.6	R104 T111	G58-R104 PolarHBondContact N-O 3.02Å; G58-T111 PolarHBondContact N-OG1 2.98Å
59	L	97.6	Very high	95.2	Very high	56 Å²	56	70.9 Å²	70.9	29%	0.293	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-60.9	148.9	171.5	-70.5	178.9	0	0	0	110.5	V56 C57 Q281 P282	V56-L59 HydrophobicContact CG1-CD1 3.89Å; V56-L59 HydrophobicContact CG1-CD2 3.72Å; V56-L59 HydrophobicContact CG1-CG 3.73Å; C57-L59 VanDerWaalsContact C-N 3.33Å; C57-L59 PolarHBondContact O-N 3.24Å; L59-Q281 PolarHBondContact O-NE2 3.28Å; L59-P282 HydrophobicContact CD1-CB 4.3Å; L59-P282 HydrophobicContact CD1-CG 4.41Å
60	P	97.8	Very high	95.7	Very high	96 Å²	96	73.6 Å²	73.6	62%	0.623	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-61.7	144.1	176.6	26.7	-34.3	0	0	0	110.7	P282	P60-P282 WeakPolarHBondContact O-CD 3.38Å
61	E	98.4	Very high	96.3	Very high	72 Å²	72	69.6 Å²	69.6	34%	0.336	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-80.7	153.1	171.7	-66.3	176.3	159.8	0	0	110	F63 P106 L280 Q281	E61-F63 HydrophobicContact CB-CE2 3.69Å; E61-F63 HydrophobicContact CB-CZ 3.88Å; E61-P106 HydrophobicContact CG-CG 3.96Å; E61-P106 VanDerWaalsContact OE1-CD 3.3Å; E61-P106 WeakPolarHBondContact OE1-CD 3.03Å; E61-L280 WeakPolarHBondContact CA-O 3.33Å; E61-L280 HydrophobicContact CB-CB 4.18Å; E61-L280 HydrophobicContact CG-CB 3.95Å; E61-Q281 HydrophobicContact CG-CG 3.94Å
62	S	98	Very high	96.8	Very high	57 Å²	57	66.4 Å²	66.4	40%	0.399	39%	0.392	S	S	.	.			trans	-126.9	147.1	173.6	-61.8	0	0	0	0	108.9	L280 N294	S62-L280 PolarHBondContact N-O 3.41Å; S62-N294 WeakPolarHBondContact O-CB 3.19Å
63	F	98.6	Very high	97.4	Very high	111 Å²	111	61.3 Å²	61.3	49%	0.487	35%	0.35	S	S	.	.			trans	-134.1	119.3	-176.1	-58.6	-91.4	0	0	0	108.6	E61 L280 N294 Y296	E61-F63 HydrophobicContact CB-CE2 3.69Å; E61-F63 HydrophobicContact CB-CZ 3.88Å; F63-L280 HydrophobicContact CD1-CD2 3.76Å; F63-L280 HydrophobicContact CE1-CD1 4.37Å; F63-L280 HydrophobicContact CE1-CD2 3.45Å; F63-L280 VanDerWaalsContact CE1-CD2 3.45Å; F63-L280 HydrophobicContact CZ-CD2 4.15Å; F63-N294 CarbonylContact C-O 3.57Å; F63-N294 WeakPolarHBondContact CA-O 3.29Å; F63-Y296 HydrophobicContact CD1-CE2 4.47Å; F63-Y296 AromaticContact CE1-CE2 3.93Å; F63-Y296 HydrophobicContact CE1-CE2 3.93Å; F63-Y296 AromaticContact CE1-CZ 3.87Å
64	D	98.6	Very high	97.7	Very high	26 Å²	26	60.3 Å²	60.3	14%	0.139	34%	0.342	C	S	.	.			trans	-63.9	148.7	169.6	-68.9	-28.3	0	0	0	109.4	E68 L69 K72 N294	D64-E68 HydrophobicContact CB-CB 4.22Å; D64-E68 HydrophobicContact CB-CG 4.11Å; D64-L69 HydrophobicContact CB-CB 4.2Å; D64-K72 IonicContact OD1-NZ 2.71Å; D64-K72 PolarHBondContact OD1-NZ 3.35Å; D64-K72 WeakPolarHBondContact OD2-CD 3.4Å; D64-K72 IonicContact OD2-NZ 3.54Å; D64-K72 PolarHBondContact OD2-NZ 3.41Å; D64-N294 PolarHBondContact N-O 3.15Å; D64-N294 PolarHBondContact OD2-N 2.95Å
65	S	98.4	Very high	98	Very high	56 Å²	56	62.6 Å²	62.6	39%	0.392	36%	0.359	S	S	.	.			trans	-63.3	162.7	171.7	90.8	0	0	0	0	110.5	E67 E68 L69	S65-E67 PolarHBondContact O-N 3.41Å; S65-E67 PolarHBondContact OG-N 3.39Å; S65-E67 PolarHBondContact OG-OE2 3.28Å; S65-E68 PolarHBondContact O-N 2.93Å; S65-E68 PolarHBondContact OG-N 2.75Å; S65-L69 WeakPolarHBondContact O-CB 3.35Å; S65-L69 PolarHBondContact O-N 3.44Å
66	S	97.9	Very high	98.2	Very high	90 Å²	90	61.7 Å²	61.7	63%	0.629	35%	0.35	S	S	*	.	H	α-helix	trans	-54.8	-41.8	177.6	-175.2	0	0	0	0	112.2	K70	S66-K70 WeakPolarHBondContact O-CB 3.42Å; S66-K70 PolarHBondContact O-N 3.21Å
67	E	98	Very high	98.3	Very high	138 Å²	138	58 Å²	58	65%	0.645	33%	0.328	S	S	*	.	H	α-helix	trans	-69.7	-44.6	179.6	-57.2	71.1	-152.6	0	0	111.8	S65 K70 A71	S65-E67 PolarHBondContact O-N 3.41Å; S65-E67 PolarHBondContact OG-N 3.39Å; S65-E67 PolarHBondContact OG-OE2 3.28Å; E67-K70 PolarHBondContact O-N 2.88Å; E67-A71 WeakPolarHBondContact O-CB 3.49Å; E67-A71 PolarHBondContact O-N 2.87Å
68	E	98.4	Very high	98.4	Very high	90 Å²	90	61.4 Å²	61.4	42%	0.421	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-44.7	177.7	-178.7	175.3	-172.7	0	0	111.1	D64 S65 K70 A71 K72	D64-E68 HydrophobicContact CB-CB 4.22Å; D64-E68 HydrophobicContact CB-CG 4.11Å; S65-E68 PolarHBondContact O-N 2.93Å; S65-E68 PolarHBondContact OG-N 2.75Å; E68-K70 PolarHBondContact O-N 2.8Å; E68-A71 PolarHBondContact O-N 2.95Å; E68-K72 HydrophobicContact CG-CD 3.96Å; E68-K72 HydrophobicContact CG-CG 4.37Å; E68-K72 WeakPolarHBondContact O-CB 3.24Å; E68-K72 VanDerWaalsContact O-CG 3.26Å; E68-K72 WeakPolarHBondContact O-CG 3.23Å; E68-K72 PolarHBondContact O-N 3.28Å; E68-K72 WeakPolarHBondContact OE1-CE 3.3Å; E68-K72 IonicContact OE1-NZ 2.82Å; E68-K72 PolarHBondContact OE1-NZ 2.91Å
69	L	98.6	Very high	98.5	Very high	21 Å²	21	60.5 Å²	60.5	11%	0.11	33%	0.329	C	S	.	.	H	α-helix	trans	-56.2	-52	176.1	-177.7	64.7	0	0	0	110.1	D64 S65 A71 K72 V73 I293 V300	D64-L69 HydrophobicContact CB-CB 4.2Å; S65-L69 WeakPolarHBondContact O-CB 3.35Å; S65-L69 PolarHBondContact O-N 3.44Å; L69-A71 PolarHBondContact O-N 2.66Å; L69-K72 PolarHBondContact O-N 3.04Å; L69-V73 HydrophobicContact CD1-CG2 4.3Å; L69-V73 HydrophobicContact CG-CG2 4.45Å; L69-V73 VanDerWaalsContact O-CG2 3.28Å; L69-V73 WeakPolarHBondContact O-CG2 3.45Å; L69-V73 PolarHBondContact O-N 3.05Å; L69-I293 HydrophobicContact CD1-CG2 3.44Å; L69-I293 VanDerWaalsContact CD1-CG2 3.44Å; L69-V300 HydrophobicContact CD1-CG2 3.77Å
70	K	98.5	Very high	98.6	Very high	116 Å²	116	57.9 Å²	57.9	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-56.5	-49.7	178.8	-176.9	179.9	174.7	-175.8	0	111.8	S66 E67 E68 K72 V73 E74	S66-K70 WeakPolarHBondContact O-CB 3.42Å; S66-K70 PolarHBondContact O-N 3.21Å; E67-K70 PolarHBondContact O-N 2.88Å; E68-K70 PolarHBondContact O-N 2.8Å; K70-K72 VanDerWaalsContact C-N 3.31Å; K70-K72 PolarHBondContact O-N 2.82Å; K70-V73 PolarHBondContact O-N 3.14Å; K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 WeakPolarHBondContact O-CG 3.32Å; K70-E74 PolarHBondContact O-N 2.95Å
71	A	98.8	Very high	98.6	Very high	47 Å²	47	58.3 Å²	58.3	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-37.3	179.8	0	0	0	0	0	112.7	E67 E68 L69 S75	E67-A71 WeakPolarHBondContact O-CB 3.49Å; E67-A71 PolarHBondContact O-N 2.87Å; E68-A71 PolarHBondContact O-N 2.95Å; L69-A71 PolarHBondContact O-N 2.66Å; A71-S75 PolarHBondContact O-N 3.06Å; A71-S75 PolarHBondContact O-OG 3.14Å
72	K	98.9	Very high	98.6	Very high	31 Å²	31	60.3 Å²	60.3	14%	0.135	32%	0.316	C	S	.	.	H	α-helix	trans	-69.9	-38.7	175.2	-71.8	177.4	174.3	174.8	0	112.1	D64 E68 L69 K70 S75 L76 L291 R292 I293	D64-K72 IonicContact OD1-NZ 2.71Å; D64-K72 PolarHBondContact OD1-NZ 3.35Å; D64-K72 WeakPolarHBondContact OD2-CD 3.4Å; D64-K72 IonicContact OD2-NZ 3.54Å; D64-K72 PolarHBondContact OD2-NZ 3.41Å; E68-K72 HydrophobicContact CG-CD 3.96Å; E68-K72 HydrophobicContact CG-CG 4.37Å; E68-K72 WeakPolarHBondContact O-CB 3.24Å; E68-K72 VanDerWaalsContact O-CG 3.26Å; E68-K72 WeakPolarHBondContact O-CG 3.23Å; E68-K72 PolarHBondContact O-N 3.28Å; E68-K72 WeakPolarHBondContact OE1-CE 3.3Å; E68-K72 IonicContact OE1-NZ 2.82Å; E68-K72 PolarHBondContact OE1-NZ 2.91Å; L69-K72 PolarHBondContact O-N 3.04Å; K70-K72 VanDerWaalsContact C-N 3.31Å; K70-K72 PolarHBondContact O-N 2.82Å; K72-S75 WeakPolarHBondContact O-CB 3.36Å; K72-S75 PolarHBondContact O-N 2.85Å; K72-L76 PolarHBondContact O-N 3.13Å; K72-L291 HydrophobicContact CB-CD1 4.23Å; K72-L291 HydrophobicContact CD-CD1 4.45Å; K72-L291 HydrophobicContact CG-CD1 3.97Å; K72-R292 WeakPolarHBondContact CD-O 3.38Å; K72-R292 VanDerWaalsContact CE-O 3.31Å; K72-R292 WeakPolarHBondContact CE-O 3.22Å; K72-R292 PolarHBondContact NZ-O 3.3Å; K72-R292 VanDerWaalsContact NZ-O 3.16Å; K72-I293 HydrophobicContact CB-CD1 4.1Å; K72-I293 HydrophobicContact CB-CG1 4.02Å; K72-I293 HydrophobicContact CB-CG2 4.46Å; K72-I293 HydrophobicContact CD-CG1 4.4Å
73	V	98.9	Very high	98.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-35.9	176.3	-177.8	0	0	0	0	111.2	L69 K70 S75 L76 A77 V300 Q303 L304 L307	L69-V73 HydrophobicContact CD1-CG2 4.3Å; L69-V73 HydrophobicContact CG-CG2 4.45Å; L69-V73 VanDerWaalsContact O-CG2 3.28Å; L69-V73 WeakPolarHBondContact O-CG2 3.45Å; L69-V73 PolarHBondContact O-N 3.05Å; K70-V73 PolarHBondContact O-N 3.14Å; V73-S75 VanDerWaalsContact C-N 3.34Å; V73-L76 WeakPolarHBondContact O-CB 3.36Å; V73-L76 PolarHBondContact O-N 2.75Å; V73-A77 WeakPolarHBondContact O-CB 3.48Å; V73-A77 PolarHBondContact O-N 3.3Å; V73-V300 HydrophobicContact CG2-CB 4.42Å; V73-V300 HydrophobicContact CG2-CG1 4.11Å; V73-V300 HydrophobicContact CG2-CG2 4.28Å; V73-Q303 HydrophobicContact CB-CB 4.45Å; V73-Q303 HydrophobicContact CG1-CB 3.81Å; V73-L304 HydrophobicContact CG1-CB 3.97Å; V73-L307 HydrophobicContact CG1-CD1 3.98Å
74	E	98.9	Very high	98.6	Very high	88 Å²	88	61 Å²	61	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-44.5	169.6	-73.1	171	-180	0	0	111.6	K70 L76 A77 Q78 L307	K70-E74 WeakPolarHBondContact CE-OE1 3.41Å; K70-E74 WeakPolarHBondContact O-CG 3.32Å; K70-E74 PolarHBondContact O-N 2.95Å; E74-L76 PolarHBondContact O-N 3.07Å; E74-A77 PolarHBondContact O-N 3.46Å; E74-Q78 PolarHBondContact O-N 2.77Å; E74-L307 HydrophobicContact CB-CD1 4.48Å; E74-L307 HydrophobicContact CG-CD1 3.86Å; E74-L307 HydrophobicContact CG-CD2 4.23Å
75	S	98.9	Very high	98.6	Very high	61 Å²	61	61.5 Å²	61.5	43%	0.427	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-42.1	174.4	-58.8	0	0	0	0	111.9	A71 K72 V73 Q78 L79	A71-S75 PolarHBondContact O-N 3.06Å; A71-S75 PolarHBondContact O-OG 3.14Å; K72-S75 WeakPolarHBondContact O-CB 3.36Å; K72-S75 PolarHBondContact O-N 2.85Å; V73-S75 VanDerWaalsContact C-N 3.34Å; S75-Q78 PolarHBondContact O-N 3.37Å; S75-L79 VanDerWaalsContact O-CG 3.3Å; S75-L79 WeakPolarHBondContact O-CG 3.25Å; S75-L79 PolarHBondContact O-N 3.02Å
76	L	98.9	Very high	98.6	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-43.4	174.9	174.2	57.3	0	0	0	111.9	K72 V73 E74 Q78 L79 I80 L250 V276 L291 I293 V300 L304	K72-L76 PolarHBondContact O-N 3.13Å; V73-L76 WeakPolarHBondContact O-CB 3.36Å; V73-L76 PolarHBondContact O-N 2.75Å; E74-L76 PolarHBondContact O-N 3.07Å; L76-Q78 VanDerWaalsContact C-N 3.28Å; L76-Q78 PolarHBondContact O-N 2.82Å; L76-L79 PolarHBondContact O-N 2.87Å; L76-I80 HydrophobicContact CD1-CD1 3.75Å; L76-I80 HydrophobicContact CD1-CG1 4.04Å; L76-I80 HydrophobicContact CG-CD1 3.98Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 2.95Å; L76-L250 HydrophobicContact CD1-CD1 4.14Å; L76-L250 HydrophobicContact CD1-CD2 4.48Å; L76-L250 HydrophobicContact CD2-CD1 4.26Å; L76-V276 HydrophobicContact CD1-CB 4.35Å; L76-V276 HydrophobicContact CD1-CG1 4.09Å; L76-V276 HydrophobicContact CD1-CG2 4.2Å; L76-L291 HydrophobicContact CB-CD2 4.2Å; L76-I293 HydrophobicContact CB-CD1 4.2Å; L76-I293 HydrophobicContact CD2-CD1 3.99Å; L76-V300 HydrophobicContact CD2-CG1 4.25Å; L76-L304 HydrophobicContact CD2-CD2 4.08Å; L76-L304 HydrophobicContact CG-CD1 4.21Å; L76-L304 HydrophobicContact CG-CD2 4.36Å
77	A	98.9	Very high	98.7	Very high	4 Å²	4	54.7 Å²	54.7	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-59.7	-41.5	176.9	0	0	0	0	0	111.2	V73 E74 I80 K81 L304 L307 L308	V73-A77 WeakPolarHBondContact O-CB 3.48Å; V73-A77 PolarHBondContact O-N 3.3Å; E74-A77 PolarHBondContact O-N 3.46Å; A77-I80 PolarHBondContact O-N 3.27Å; A77-K81 WeakPolarHBondContact O-CG 3.13Å; A77-K81 PolarHBondContact O-N 2.98Å; A77-L304 HydrophobicContact CB-CD1 3.73Å; A77-L307 HydrophobicContact CB-CB 3.94Å; A77-L307 HydrophobicContact CB-CD1 4.19Å; A77-L308 HydrophobicContact CB-CD2 4.32Å
78	Q	98.9	Very high	98.7	Very high	95 Å²	95	48.1 Å²	48.1	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-63.9	-46.1	175.4	-172.9	59.5	25.9	0	0	111.9	E74 S75 L76 I80 K81 E82	E74-Q78 PolarHBondContact O-N 2.77Å; S75-Q78 PolarHBondContact O-N 3.37Å; L76-Q78 VanDerWaalsContact C-N 3.28Å; L76-Q78 PolarHBondContact O-N 2.82Å; Q78-I80 VanDerWaalsContact C-N 3.28Å; Q78-I80 PolarHBondContact O-N 3.35Å; Q78-K81 PolarHBondContact O-N 3.4Å; Q78-E82 WeakPolarHBondContact CG-OE1 3.43Å; Q78-E82 PolarHBondContact NE2-OE1 2.84Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 3.19Å
79	L	98.9	Very high	98.8	Very high	16 Å²	16	44 Å²	44	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-40	176.4	-69.6	173	0	0	0	112.3	S75 L76 E82 S83 L248 K274 V276 L291	S75-L79 VanDerWaalsContact O-CG 3.3Å; S75-L79 WeakPolarHBondContact O-CG 3.25Å; S75-L79 PolarHBondContact O-N 3.02Å; L76-L79 PolarHBondContact O-N 2.87Å; L79-E82 PolarHBondContact O-N 2.9Å; L79-S83 VanDerWaalsContact O-CB 3.25Å; L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 3.47Å; L79-L248 HydrophobicContact CB-CD1 4.38Å; L79-L248 HydrophobicContact CB-CD2 4Å; L79-K274 HydrophobicContact CD2-CD 3.47Å; L79-K274 VanDerWaalsContact CD2-CD 3.47Å; L79-K274 VanDerWaalsContact CD2-NZ 3.25Å; L79-V276 HydrophobicContact CD1-CG2 3.76Å; L79-L291 HydrophobicContact CD1-CD2 4.38Å
80	I	98.8	Very high	98.8	Very high	1 Å²	1	43 Å²	43	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-38.1	178.2	-71.7	173	0	0	0	111.5	L76 A77 Q78 E82 S83 L86 Y145 L248 L250 L304 L308	L76-I80 HydrophobicContact CD1-CD1 3.75Å; L76-I80 HydrophobicContact CD1-CG1 4.04Å; L76-I80 HydrophobicContact CG-CD1 3.98Å; L76-I80 WeakPolarHBondContact O-CG1 3.49Å; L76-I80 PolarHBondContact O-N 2.95Å; A77-I80 PolarHBondContact O-N 3.27Å; Q78-I80 VanDerWaalsContact C-N 3.28Å; Q78-I80 PolarHBondContact O-N 3.35Å; I80-E82 VanDerWaalsContact C-N 3.31Å; I80-E82 PolarHBondContact O-N 3.41Å; I80-S83 PolarHBondContact O-N 3.34Å; I80-L86 HydrophobicContact CD1-CD2 4.25Å; I80-L86 HydrophobicContact CG1-CD2 4.13Å; I80-L86 HydrophobicContact CG2-CD2 4.25Å; I80-Y145 HydrophobicContact CG2-CD1 3.57Å; I80-Y145 HydrophobicContact CG2-CE1 4.21Å; I80-Y145 HydrophobicContact CG2-CG 4.04Å; I80-L248 HydrophobicContact CG1-CD2 3.75Å; I80-L250 HydrophobicContact CD1-CD2 4.45Å; I80-L304 HydrophobicContact CD1-CD1 3.98Å; I80-L304 HydrophobicContact CD1-CD2 3.64Å; I80-L304 HydrophobicContact CD1-CG 4.38Å; I80-L308 HydrophobicContact CG2-CD1 4.14Å; I80-L308 HydrophobicContact CG2-CD2 4.42Å
81	K	98.6	Very high	98.8	Very high	105 Å²	105	37.6 Å²	37.6	46%	0.457	19%	0.191	S	C	.	.	H	α-helix	trans	-65.5	-34.5	175.5	-72.8	176	-170	-179.7	0	112.6	A77 Q78 L307 L308	A77-K81 WeakPolarHBondContact O-CG 3.13Å; A77-K81 PolarHBondContact O-N 2.98Å; Q78-K81 PolarHBondContact O-N 3.4Å; K81-L307 PolarHBondContact NZ-O 2.75Å; K81-L308 HydrophobicContact CD-CD2 4.33Å; K81-L308 HydrophobicContact CG-CD2 3.82Å
82	E	98.4	Very high	98.8	Very high	114 Å²	114	36 Å²	36	53%	0.533	18%	0.179	S	C	.	.	H	α-helix	trans	-82.2	-21.3	179.2	-70.1	173.2	-177.9	0	0	113.6	Q78 L79 I80	Q78-E82 WeakPolarHBondContact CG-OE1 3.43Å; Q78-E82 PolarHBondContact NE2-OE1 2.84Å; Q78-E82 WeakPolarHBondContact O-CG 3.43Å; Q78-E82 PolarHBondContact O-N 3.19Å; L79-E82 PolarHBondContact O-N 2.9Å; I80-E82 VanDerWaalsContact C-N 3.31Å; I80-E82 PolarHBondContact O-N 3.41Å
83	S	98.6	Very high	98.7	Very high	22 Å²	22	35.3 Å²	35.3	15%	0.154	18%	0.179	C	C	.	.			trans	-77.1	130.6	-177	169.3	0	0	0	0	111.7	L79 I80 Y85 L86 D247 L248	L79-S83 VanDerWaalsContact O-CB 3.25Å; L79-S83 WeakPolarHBondContact O-CB 3.48Å; L79-S83 PolarHBondContact O-N 3.47Å; I80-S83 PolarHBondContact O-N 3.34Å; S83-Y85 PolarHBondContact OG-N 3.07Å; S83-L86 PolarHBondContact OG-N 2.93Å; S83-D247 WeakPolarHBondContact CB-OD1 3.32Å; S83-D247 PolarHBondContact OG-OD1 3.25Å; S83-L248 WeakPolarHBondContact OG-CB 3.43Å
84	E	98.1	Very high	98.7	Very high	161 Å²	161	35.3 Å²	35.3	75%	0.752	18%	0.179	S	C	*	.	S	Bend	trans	-85	-28.7	171.8	-61.9	-172.4	168.3	0	0	111.6	K147 D247	E84-K147 WeakPolarHBondContact O-CE 3.49Å; E84-D247 PolarHBondContact N-OD2 2.92Å
85	Y	98.7	Very high	98.7	Very high	36 Å²	36	31.1 Å²	31.1	14%	0.141	16%	0.16	C	C	.	.	S	Bend	trans	-137.8	77.4	-175.4	-154.5	-80	0	0	0	112.6	S83 V87 K147 A242 R245 A246 D247	S83-Y85 PolarHBondContact OG-N 3.07Å; Y85-V87 HydrophobicContact CD1-CG2 3.78Å; Y85-V87 HydrophobicContact CE1-CG2 3.59Å; Y85-K147 HydrophobicContact CD1-CB 4.11Å; Y85-K147 HydrophobicContact CD1-CG 4.32Å; Y85-K147 HydrophobicContact CD2-CB 4.02Å; Y85-K147 HydrophobicContact CD2-CG 3.75Å; Y85-K147 HydrophobicContact CE1-CB 3.95Å; Y85-K147 HydrophobicContact CE2-CB 3.81Å; Y85-K147 HydrophobicContact CE2-CG 4.02Å; Y85-K147 HydrophobicContact CG-CB 4.18Å; Y85-K147 HydrophobicContact CG-CG 3.92Å; Y85-A242 HydrophobicContact CE1-CB 4.41Å; Y85-R245 HydrophobicContact CD1-CB 4.18Å; Y85-R245 HydrophobicContact CE1-CB 4.02Å; Y85-R245 VanDerWaalsContact CE2-NH2 3.32Å; Y85-A246 HydrophobicContact CD1-CB 4.11Å; Y85-A246 VanDerWaalsContact O-CA 3.24Å; Y85-A246 WeakPolarHBondContact O-CA 3.34Å; Y85-A246 WeakPolarHBondContact O-CB 3.44Å; Y85-D247 VanDerWaalsContact C-OD1 3.29Å; Y85-D247 PolarHBondContact N-OD1 3.28Å; Y85-D247 PolarHBondContact N-OD2 3.45Å; Y85-D247 PolarHBondContact O-N 3.06Å
86	L	98.9	Very high	98.7	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	128	171.7	171.2	65.2	0	0	0	111.5	I80 S83 V88 Y145 L146 K147 L248 L250	I80-L86 HydrophobicContact CD1-CD2 4.25Å; I80-L86 HydrophobicContact CG1-CD2 4.13Å; I80-L86 HydrophobicContact CG2-CD2 4.25Å; S83-L86 PolarHBondContact OG-N 2.93Å; L86-V88 HydrophobicContact CD1-CG2 4.4Å; L86-V88 HydrophobicContact CG-CG2 4.42Å; L86-Y145 WeakPolarHBondContact CB-O 3.33Å; L86-L146 HydrophobicContact CD2-CB 4.47Å; L86-L146 HydrophobicContact CD2-CD1 4.4Å; L86-L146 HydrophobicContact CG-CD1 4.16Å; L86-K147 PolarHBondContact O-N 2.92Å; L86-L248 WeakPolarHBondContact CA-O 3.32Å; L86-L248 HydrophobicContact CD1-CB 4.29Å; L86-L248 HydrophobicContact CD1-CD2 3.88Å; L86-L248 HydrophobicContact CD1-CG 3.86Å; L86-L250 HydrophobicContact CD1-CB 3.96Å
87	V	98.9	Very high	98.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.9	167.8	174.9	0	0	0	0	110.1	Y85 Y148 I150 A242 A246 L248 A249 L250	Y85-V87 HydrophobicContact CD1-CG2 3.78Å; Y85-V87 HydrophobicContact CE1-CG2 3.59Å; V87-Y148 WeakPolarHBondContact CA-O 3.4Å; V87-I150 HydrophobicContact CG1-CD1 3.62Å; V87-I150 HydrophobicContact CG1-CG1 4.21Å; V87-A242 HydrophobicContact CG2-CB 4.13Å; V87-A246 HydrophobicContact CB-CB 4.01Å; V87-A246 HydrophobicContact CG2-CB 3.68Å; V87-L248 PolarHBondContact N-O 3.41Å; V87-A249 CarbonylContact O-C 3.57Å; V87-A249 WeakPolarHBondContact O-CA 3.02Å; V87-L250 PolarHBondContact O-N 2.79Å
88	V	98.9	Very high	98.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	138.5	175.8	171.9	0	0	0	0	110.3	L86 L137 L146 Y148 L149 I150 L250 L252	L86-V88 HydrophobicContact CD1-CG2 4.4Å; L86-V88 HydrophobicContact CG-CG2 4.42Å; V88-L137 HydrophobicContact CB-CD2 4.19Å; V88-L137 HydrophobicContact CG1-CD1 4.37Å; V88-L137 HydrophobicContact CG1-CD2 3.81Å; V88-L137 HydrophobicContact CG2-CD2 3.86Å; V88-L146 HydrophobicContact CB-CD1 3.82Å; V88-L146 HydrophobicContact CG2-CD1 3.48Å; V88-L146 VanDerWaalsContact CG2-CD1 3.48Å; V88-L146 HydrophobicContact CG2-CD2 4.29Å; V88-Y148 PolarHBondContact N-O 3.46Å; V88-L149 HydrophobicContact CB-CD1 3.85Å; V88-L149 HydrophobicContact CG1-CD1 3.63Å; V88-I150 PolarHBondContact O-N 3.34Å; V88-L250 CarbonylContact C-O 3.56Å; V88-L250 VanDerWaalsContact CA-O 3.28Å; V88-L250 WeakPolarHBondContact CA-O 3.26Å; V88-L250 HydrophobicContact CG2-CB 4.09Å; V88-L250 HydrophobicContact CG2-CD2 4.15Å; V88-L250 HydrophobicContact CG2-CG 4.39Å; V88-L252 HydrophobicContact CG1-CD1 3.87Å; V88-L252 HydrophobicContact CG1-CG 4.25Å
89	H	98.9	Very high	98.3	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.019	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	115	172.4	-56.4	-102	0	0	0	109.6	I150 S243 L250 T251 L252 P265	H89-I150 CarbonylContact C-O 3.51Å; H89-I150 VanDerWaalsContact CA-O 3.24Å; H89-I150 WeakPolarHBondContact CA-O 3.34Å; H89-I150 VanDerWaalsContact CE1-CD1 3.49Å; H89-I150 WeakPolarHBondContact CE1-CD1 3.29Å; H89-S243 PolarHBondContact CE1-OG 3.38Å; H89-L250 PolarHBondContact N-O 2.97Å; H89-T251 HydrophobicContact CB-CG2 4.12Å; H89-T251 CarbonylContact O-C 3.59Å; H89-T251 VanDerWaalsContact O-CA 3.32Å; H89-T251 WeakPolarHBondContact O-CA 3.22Å; H89-L252 PolarHBondContact O-N 3.05Å; H89-P265 HydrophobicContact CB-CG 4.28Å
90	S	98.9	Very high	98.1	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	148.8	-180	88.3	0	0	0	0	112.9	I150 S151 Q152 H158 L252	S90-I150 PolarHBondContact N-O 3.49Å; S90-S151 PolarHBondContact OG-OG 3.39Å; S90-Q152 PolarHBondContact O-N 2.76Å; S90-Q152 VanDerWaalsContact O-N 3.08Å; S90-H158 PolarHBondContact OG-NE2 2.76Å; S90-L252 WeakPolarHBondContact CA-O 3.3Å
91	G	98.7	Very high	98	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.021	17%	0.174	C	C	.	.			trans	-132	-172.1	168.1	0	0	0	0	0	112.4	G93 I94 N153 L252 G253	G91-G93 PolarHBondContact O-N 3.23Å; G91-I94 WeakPolarHBondContact O-CG1 3.21Å; G91-I94 PolarHBondContact O-N 3.04Å; G91-I94 VanDerWaalsContact O-N 3.17Å; G91-N153 WeakPolarHBondContact CA-OD1 3.17Å; G91-N153 PolarHBondContact O-ND2 3.16Å; G91-N153 VanDerWaalsContact O-ND2 3.13Å; G91-N153 PolarHBondContact O-OD1 2.9Å; G91-L252 PolarHBondContact N-O 3.29Å; G91-G253 CarbonylContact C-O 3.56Å; G91-G253 VanDerWaalsContact CA-O 3.27Å; G91-G253 WeakPolarHBondContact CA-O 3.23Å
92	A	98.2	Very high	97.9	Very high	15 Å²	15	28.3 Å²	28.3	12%	0.124	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-61.2	-22.3	-168.7	0	0	0	0	0	113.8	I94 S95 D102 F103 N153 G253	A92-I94 PolarHBondContact O-N 2.92Å; A92-I94 VanDerWaalsContact O-N 3.13Å; A92-S95 PolarHBondContact O-N 3.08Å; A92-D102 HydrophobicContact CB-CB 3.9Å; A92-F103 HydrophobicContact CB-CD2 4.05Å; A92-F103 HydrophobicContact CB-CE2 3.95Å; A92-F103 HydrophobicContact CB-CZ 4.39Å; A92-N153 WeakPolarHBondContact CA-OD1 3.46Å; A92-N153 PolarHBondContact N-OD1 2.9Å; A92-G253 PolarHBondContact N-O 3.19Å
93	G	98.5	Very high	97.7	Very high	15 Å²	15	25 Å²	25	16%	0.155	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-61.5	-18.7	178	0	0	0	0	0	114.5	G91 S95 T96 G253	G91-G93 PolarHBondContact O-N 3.23Å; G93-S95 VanDerWaalsContact C-N 3.29Å; G93-T96 PolarHBondContact O-OG1 2.88Å; G93-T96 VanDerWaalsContact O-OG1 3.07Å; G93-G253 WeakPolarHBondContact CA-O 3.34Å; G93-G253 PolarHBondContact N-O 3.01Å
94	I	98.8	Very high	97.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-80.4	-10.8	174.7	73.7	157.7	0	0	0	113.9	G91 A92 S131 T133 H134 H158 L252 V297	G91-I94 WeakPolarHBondContact O-CG1 3.21Å; G91-I94 PolarHBondContact O-N 3.04Å; G91-I94 VanDerWaalsContact O-N 3.17Å; A92-I94 PolarHBondContact O-N 2.92Å; A92-I94 VanDerWaalsContact O-N 3.13Å; I94-S131 WeakPolarHBondContact O-CB 3.37Å; I94-S131 PolarHBondContact O-OG 3.28Å; I94-T133 HydrophobicContact CB-CG2 3.99Å; I94-T133 HydrophobicContact CG2-CG2 3.9Å; I94-H134 VanDerWaalsContact CD1-CE1 3.47Å; I94-H134 WeakPolarHBondContact CD1-CE1 3.28Å; I94-H134 VanDerWaalsContact CD1-NE2 3.34Å; I94-H134 WeakPolarHBondContact CD1-NE2 3.36Å; I94-H134 PolarHBondContact O-CE1 2.98Å; I94-H158 WeakPolarHBondContact CD1-CE1 3.27Å; I94-H158 WeakPolarHBondContact CD1-NE2 3.45Å; I94-L252 HydrophobicContact CG2-CB 3.68Å; I94-V297 HydrophobicContact CB-CG2 4.41Å; I94-V297 HydrophobicContact CG2-CG2 4.2Å
95	S	98.5	Very high	97.6	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	-108.4	-3.2	-176.8	-54.4	0	0	0	0	112.7	A92 G93 S97 S98 I100 H134 N153 D155	A92-S95 PolarHBondContact O-N 3.08Å; G93-S95 VanDerWaalsContact C-N 3.29Å; S95-S97 PolarHBondContact O-N 3.22Å; S95-S98 WeakPolarHBondContact O-CA 3.18Å; S95-S98 VanDerWaalsContact O-CB 3.3Å; S95-S98 WeakPolarHBondContact O-CB 3.46Å; S95-S98 PolarHBondContact O-N 3.43Å; S95-I100 CarbonylContact C-O 3.22Å; S95-I100 PolarHBondContact O-N 3.27Å; S95-H134 PolarHBondContact OG-CE1 3.38Å; S95-N153 PolarHBondContact OG-ND2 2.96Å; S95-D155 WeakPolarHBondContact CB-OD2 3.26Å; S95-D155 PolarHBondContact OG-OD2 2.99Å
96	T	97.9	Very high	97.5	Very high	61 Å²	61	18 Å²	18	37%	0.374	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-64.8	-39.1	-179.9	54.4	0	0	0	0	112.7	G93 S98 G99 I100 D102	G93-T96 PolarHBondContact O-OG1 2.88Å; G93-T96 VanDerWaalsContact O-OG1 3.07Å; T96-S98 PolarHBondContact O-N 3.01Å; T96-G99 PolarHBondContact O-N 3.42Å; T96-I100 VanDerWaalsContact CA-O 3.24Å; T96-I100 WeakPolarHBondContact CA-O 3.24Å; T96-D102 HydrophobicContact CG2-CB 3.86Å
97	S	97.5	Very high	97.3	Very high	71 Å²	71	25.9 Å²	25.9	50%	0.497	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-69.4	-12.6	173.4	58.8	0	0	0	0	113.7	S95 G99 S131 D298	S95-S97 PolarHBondContact O-N 3.22Å; S97-G99 VanDerWaalsContact C-N 3.34Å; S97-S131 WeakPolarHBondContact OG-CB 3.13Å; S97-D298 VanDerWaalsContact CB-OD2 3.23Å; S97-D298 WeakPolarHBondContact CB-OD2 3.24Å; S97-D298 PolarHBondContact OG-OD2 2.84Å
98	S	96.8	Very high	97.1	Very high	20 Å²	20	25.9 Å²	25.9	14%	0.14	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-88.9	2.7	171.6	-61.6	0	0	0	0	113.2	S95 T96 T123 R129 S131	S95-S98 WeakPolarHBondContact O-CA 3.18Å; S95-S98 VanDerWaalsContact O-CB 3.3Å; S95-S98 WeakPolarHBondContact O-CB 3.46Å; S95-S98 PolarHBondContact O-N 3.43Å; T96-S98 PolarHBondContact O-N 3.01Å; S98-T123 WeakPolarHBondContact O-CG2 3.19Å; S98-R129 VanDerWaalsContact CB-O 3.24Å; S98-R129 WeakPolarHBondContact CB-O 3.08Å; S98-R129 PolarHBondContact OG-O 2.73Å; S98-S131 PolarHBondContact OG-N 2.85Å
99	G	95.3	Very high	96.9	Very high	9 Å²	9	26.2 Å²	26.2	9%	0.093	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	10.7	-179.3	0	0	0	0	0	114.8	T96 S97 D122	T96-G99 PolarHBondContact O-N 3.42Å; S97-G99 VanDerWaalsContact C-N 3.34Å; G99-D122 PolarHBondContact O-N 3.04Å; G99-D122 VanDerWaalsContact O-N 3.15Å
100	I	95.1	Very high	96.7	Very high	13 Å²	13	26.3 Å²	26.3	7%	0.067	15%	0.15	C	C	.	.			trans	-100.8	116.6	175.7	-57.1	174.3	0	0	0	108.3	S95 T96 T123 F125 A128 D155 L157	S95-I100 CarbonylContact C-O 3.22Å; S95-I100 PolarHBondContact O-N 3.27Å; T96-I100 VanDerWaalsContact CA-O 3.24Å; T96-I100 WeakPolarHBondContact CA-O 3.24Å; I100-T123 HydrophobicContact CG1-CG2 4.06Å; I100-F125 HydrophobicContact CD1-CD1 3.88Å; I100-F125 HydrophobicContact CD1-CE1 4.01Å; I100-F125 HydrophobicContact CG2-CE1 4.06Å; I100-A128 HydrophobicContact CD1-CB 3.79Å; I100-A128 HydrophobicContact CG1-CB 4.29Å; I100-D155 HydrophobicContact CD1-CB 3.78Å; I100-L157 HydrophobicContact CD1-CD1 3.92Å
101	P	94.8	Very high	96.5	Very high	19 Å²	19	26.6 Å²	26.6	12%	0.123	15%	0.152	C	C	.	.			trans	-63.3	148.5	-179.9	28.7	-34.6	0	0	0	111.2	V109 P119 F121	P101-V109 HydrophobicContact CG-CG2 4.19Å; P101-P119 HydrophobicContact CB-CB 4.49Å; P101-P119 HydrophobicContact CG-CB 4.2Å; P101-F121 HydrophobicContact CG-CD1 3.61Å; P101-F121 HydrophobicContact CG-CD2 4.49Å; P101-F121 HydrophobicContact CG-CE1 3.33Å; P101-F121 HydrophobicContact CG-CE2 4.27Å; P101-F121 HydrophobicContact CG-CG 4.2Å; P101-F121 HydrophobicContact CG-CZ 3.7Å
102	D	96.5	Very high	96.3	Very high	31 Å²	31	27.2 Å²	27.2	17%	0.166	16%	0.155	C	C	.	.			trans	-76.5	-173.8	169	77.1	20.2	0	0	0	111.7	A92 T96 R104 G105 G108 V109	A92-D102 HydrophobicContact CB-CB 3.9Å; T96-D102 HydrophobicContact CG2-CB 3.86Å; D102-R104 PolarHBondContact OD1-N 3.21Å; D102-G105 VanDerWaalsContact CG-N 3.34Å; D102-G105 VanDerWaalsContact OD1-CA 3.27Å; D102-G105 WeakPolarHBondContact OD1-CA 3.49Å; D102-G105 PolarHBondContact OD1-N 3.49Å; D102-G105 VanDerWaalsContact OD2-CA 3.25Å; D102-G105 WeakPolarHBondContact OD2-CA 3.28Å; D102-G105 PolarHBondContact OD2-N 2.72Å; D102-G108 CarbonylContact O-C 3.56Å; D102-G108 WeakPolarHBondContact O-CA 3.44Å; D102-G108 WeakPolarHBondContact OD1-CA 3.32Å; D102-V109 WeakPolarHBondContact O-CG2 3.04Å; D102-V109 PolarHBondContact O-N 3.08Å
103	F	95.7	Very high	96	Very high	43 Å²	43	31.2 Å²	31.2	19%	0.189	17%	0.171	C	C	.	.	S	Bend	trans	-94.9	-34.7	-179.9	-61.3	-40.8	0	0	0	114.9	Y44 A92 G108 V109 W110	Y44-F103 HydrophobicContact CD1-CE1 4.3Å; Y44-F103 HydrophobicContact CE1-CD1 4.03Å; Y44-F103 AromaticContact CE1-CE1 3.15Å; Y44-F103 HydrophobicContact CE1-CE1 3.15Å; Y44-F103 AromaticContact CE1-CZ 3.7Å; Y44-F103 HydrophobicContact CE1-CZ 3.7Å; Y44-F103 HydrophobicContact CE2-CE1 4.49Å; Y44-F103 HydrophobicContact CE2-CZ 4.4Å; Y44-F103 AromaticContact CZ-CE1 3.25Å; Y44-F103 AromaticContact CZ-CZ 3.48Å; Y44-F103 VanDerWaalsContact CZ-CZ 3.48Å; Y44-F103 WeakPolarHBondContact OH-CD1 3.38Å; Y44-F103 WeakPolarHBondContact OH-CE1 3.45Å; Y44-F103 WeakPolarHBondContact OH-CZ 3.37Å; A92-F103 HydrophobicContact CB-CD2 4.05Å; A92-F103 HydrophobicContact CB-CE2 3.95Å; A92-F103 HydrophobicContact CB-CZ 4.39Å; F103-G108 CarbonylContact O-C 3.55Å; F103-V109 HydrophobicContact CD1-CB 4.26Å; F103-V109 HydrophobicContact CD1-CG2 4.2Å; F103-V109 PolarHBondContact O-N 2.73Å; F103-W110 HydrophobicContact CB-CG 4.47Å; F103-W110 AromaticContact CG-NE1 3.85Å; F103-W110 VanDerWaalsContact O-CB 3.31Å; F103-W110 WeakPolarHBondContact O-CB 3.41Å; F103-W110 PolarHBondContact O-N 3.36Å
104	R	97.4	Very high	95.7	Very high	20 Å²	20	36.6 Å²	36.6	8%	0.075	19%	0.19	C	C	.	.	S	Bend	trans	-132.5	-0.4	-164.1	-62.8	-176.9	-178.9	85.2	4.6	113.9	K54 V56 G58 D102 T111 I258 Q281	K54-R104 PolarHBondContact O-NE 2.9Å; K54-R104 PolarHBondContact O-NH2 2.9Å; V56-R104 WeakPolarHBondContact O-CD 3.31Å; G58-R104 PolarHBondContact N-O 3.02Å; D102-R104 PolarHBondContact OD1-N 3.21Å; R104-T111 PolarHBondContact O-OG1 2.82Å; R104-I258 VanDerWaalsContact NH2-CD1 3.3Å; R104-Q281 PolarHBondContact O-NE2 2.97Å; R104-Q281 VanDerWaalsContact O-NE2 3.13Å; R104-Q281 PolarHBondContact O-OE1 3.47Å
105	G	96.9	Very high	95.4	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.01	22%	0.216	C	C	.	.	S	Bend	trans	-58.7	174.4	170.3	0	0	0	0	0	111.9	D102 K107 G108 T111	D102-G105 VanDerWaalsContact CG-N 3.34Å; D102-G105 VanDerWaalsContact OD1-CA 3.27Å; D102-G105 WeakPolarHBondContact OD1-CA 3.49Å; D102-G105 PolarHBondContact OD1-N 3.49Å; D102-G105 VanDerWaalsContact OD2-CA 3.25Å; D102-G105 WeakPolarHBondContact OD2-CA 3.28Å; D102-G105 PolarHBondContact OD2-N 2.72Å; G105-K107 PolarHBondContact O-N 2.89Å; G105-K107 VanDerWaalsContact O-N 3.08Å; G105-G108 PolarHBondContact O-N 2.82Å; G105-T111 VanDerWaalsContact O-CB 3.24Å; G105-T111 WeakPolarHBondContact O-CB 3.33Å; G105-T111 PolarHBondContact O-OG1 3.24Å
106	P	96.4	Very high	95.1	Very high	51 Å²	51	46 Å²	46	33%	0.331	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-31.3	178.4	-27.2	35.9	0	0	0	114	E61 T111	E61-P106 HydrophobicContact CG-CG 3.96Å; E61-P106 VanDerWaalsContact OE1-CD 3.3Å; E61-P106 WeakPolarHBondContact OE1-CD 3.03Å; P106-T111 WeakPolarHBondContact O-CG2 3.37Å
107	K	94.6	Very high	94.7	Very high	169 Å²	169	48.1 Å²	48.1	74%	0.735	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	20.2	176.2	-59.1	-176.3	-179.2	179.4	0	113	G105 L112	G105-K107 PolarHBondContact O-N 2.89Å; G105-K107 VanDerWaalsContact O-N 3.08Å; K107-L112 HydrophobicContact CB-CD1 4.42Å; K107-L112 VanDerWaalsContact O-CD1 3.26Å; K107-L112 WeakPolarHBondContact O-CD1 3.21Å
108	G	94.8	Very high	94.2	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.269	C	S	.	.			trans	-68.4	156.6	-179.6	0	0	0	0	0	112.6	D102 F103 G105 W110 T111 L112	D102-G108 CarbonylContact O-C 3.56Å; D102-G108 WeakPolarHBondContact O-CA 3.44Å; D102-G108 WeakPolarHBondContact OD1-CA 3.32Å; F103-G108 CarbonylContact O-C 3.55Å; G105-G108 PolarHBondContact O-N 2.82Å; G108-W110 VanDerWaalsContact C-N 3.35Å; G108-W110 PolarHBondContact O-N 2.87Å; G108-T111 WeakPolarHBondContact O-CB 3.26Å; G108-T111 PolarHBondContact O-N 2.93Å; G108-L112 PolarHBondContact O-N 2.84Å
109	V	94.1	Very high	93.6	Very high	6 Å²	6	49.9 Å²	49.9	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-50.4	-50.6	-176.6	178.6	0	0	0	0	112.4	A45 P101 D102 F103 L112 E113 P119	A45-V109 HydrophobicContact CB-CG1 3.5Å; P101-V109 HydrophobicContact CG-CG2 4.19Å; D102-V109 WeakPolarHBondContact O-CG2 3.04Å; D102-V109 PolarHBondContact O-N 3.08Å; F103-V109 HydrophobicContact CD1-CB 4.26Å; F103-V109 HydrophobicContact CD1-CG2 4.2Å; F103-V109 PolarHBondContact O-N 2.73Å; V109-L112 PolarHBondContact O-N 2.8Å; V109-E113 WeakPolarHBondContact O-CB 3.27Å; V109-E113 PolarHBondContact O-N 2.89Å; V109-P119 HydrophobicContact CB-CG 4.41Å; V109-P119 HydrophobicContact CG1-CG 4.23Å; V109-P119 HydrophobicContact CG2-CB 4.09Å; V109-P119 HydrophobicContact CG2-CG 4.02Å
110	W	94.8	Very high	93	Very high	6 Å²	6	56.2 Å²	56.2	2%	0.023	30%	0.297	C	S	.	.	H	α-helix	trans	-75.4	-26.1	-179.3	-49.3	138.1	0	0	0	113	Y44 A45 L48 K54 F103 G108 K114 W227	Y44-W110 VanDerWaalsContact OH-CZ2 3.3Å; Y44-W110 WeakPolarHBondContact OH-CZ2 3.38Å; A45-W110 HydrophobicContact CB-CH2 3.32Å; A45-W110 HydrophobicContact CB-CZ2 4.23Å; A45-W110 HydrophobicContact CB-CZ3 3.56Å; L48-W110 HydrophobicContact CD1-CH2 4.02Å; L48-W110 HydrophobicContact CD1-CZ2 4.2Å; K54-W110 HydrophobicContact CB-CB 3.98Å; K54-W110 HydrophobicContact CB-CG 4.07Å; K54-W110 HydrophobicContact CD-CD2 3.99Å; K54-W110 HydrophobicContact CD-CE3 4.09Å; K54-W110 HydrophobicContact CD-CG 4.31Å; K54-W110 HydrophobicContact CD-CZ3 4.49Å; K54-W110 HydrophobicContact CG-CB 4.37Å; K54-W110 HydrophobicContact CG-CD2 4.45Å; K54-W110 HydrophobicContact CG-CG 4.34Å; F103-W110 HydrophobicContact CB-CG 4.47Å; F103-W110 AromaticContact CG-NE1 3.85Å; F103-W110 VanDerWaalsContact O-CB 3.31Å; F103-W110 WeakPolarHBondContact O-CB 3.41Å; F103-W110 PolarHBondContact O-N 3.36Å; G108-W110 VanDerWaalsContact C-N 3.35Å; G108-W110 PolarHBondContact O-N 2.87Å; W110-K114 WeakPolarHBondContact O-CG 3.3Å; W110-K114 PolarHBondContact O-N 3.18Å; W110-W227 AromaticContact CH2-CZ2 3.95Å; W110-W227 HydrophobicContact CH2-CZ2 3.95Å; W110-W227 AromaticContact CZ2-CH2 3.99Å; W110-W227 HydrophobicContact CZ2-CH2 3.99Å; W110-W227 AromaticContact CZ2-CZ2 3.58Å; W110-W227 HydrophobicContact CZ2-CZ2 3.58Å
111	T	95.3	Very high	92.4	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.043	30%	0.302	C	S	.	.	H	α-helix	trans	-68	-42	174.4	-55.1	0	0	0	0	110.9	C57 G58 R104 G105 P106 G108 K115	C57-T111 WeakPolarHBondContact CB-OG1 3.38Å; G58-T111 PolarHBondContact N-OG1 2.98Å; R104-T111 PolarHBondContact O-OG1 2.82Å; G105-T111 VanDerWaalsContact O-CB 3.24Å; G105-T111 WeakPolarHBondContact O-CB 3.33Å; G105-T111 PolarHBondContact O-OG1 3.24Å; P106-T111 WeakPolarHBondContact O-CG2 3.37Å; G108-T111 WeakPolarHBondContact O-CB 3.26Å; G108-T111 PolarHBondContact O-N 2.93Å; T111-K115 WeakPolarHBondContact O-CG 3.32Å
112	L	94.1	Very high	91.9	Very high	14 Å²	14	62.5 Å²	62.5	7%	0.073	33%	0.327	C	S	.	.	H	α-helix	trans	-75.8	-39.7	179.1	-65.7	176.1	0	0	0	111.7	K107 G108 V109 K114 K115 G116 E117 P119	K107-L112 HydrophobicContact CB-CD1 4.42Å; K107-L112 VanDerWaalsContact O-CD1 3.26Å; K107-L112 WeakPolarHBondContact O-CD1 3.21Å; G108-L112 PolarHBondContact O-N 2.84Å; V109-L112 PolarHBondContact O-N 2.8Å; L112-K114 VanDerWaalsContact C-N 3.28Å; L112-K114 PolarHBondContact O-N 2.92Å; L112-K115 CarbonylContact O-C 3.49Å; L112-K115 WeakPolarHBondContact O-CA 3.47Å; L112-K115 WeakPolarHBondContact O-CB 3.37Å; L112-K115 PolarHBondContact O-N 3.36Å; L112-G116 PolarHBondContact O-N 3.05Å; L112-G116 VanDerWaalsContact O-N 3.15Å; L112-E117 CarbonylContact C-O 3.51Å; L112-E117 VanDerWaalsContact C-O 3.22Å; L112-E117 HydrophobicContact CB-CB 4Å; L112-E117 HydrophobicContact CD2-CB 4.13Å; L112-E117 WeakPolarHBondContact CD2-OE2 3.4Å; L112-E117 PolarHBondContact O-N 3.21Å; L112-P119 VanDerWaalsContact CD1-CA 3.49Å; L112-P119 HydrophobicContact CD1-CB 4.08Å
113	E	91.9	Very high	91.7	Very high	99 Å²	99	62.4 Å²	62.4	46%	0.463	33%	0.328	S	S	.	.	H	α-helix	trans	-54.7	-44.7	173.1	-176.2	-173.6	-154.4	0	0	111.4	V109 K115 G116 E117	V109-E113 WeakPolarHBondContact O-CB 3.27Å; V109-E113 PolarHBondContact O-N 2.89Å; E113-K115 PolarHBondContact O-N 3.42Å; E113-K115 VanDerWaalsContact O-N 3.15Å; E113-G116 PolarHBondContact O-N 3.32Å; E113-E117 PolarHBondContact N-O 3.48Å
114	K	92.2	Very high	91.5	Very high	128 Å²	128	61.1 Å²	61.1	56%	0.557	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-22.3	175.7	-77.9	179.7	-179.8	-178	0	113.9	G55 C57 W110 L112	G55-K114 PolarHBondContact O-NZ 3.49Å; C57-K114 HydrophobicContact CB-CD 4.18Å; C57-K114 PolarHBondContact SG-NZ 3.47Å; C57-K114 VanDerWaalsContact SG-NZ 3.43Å; W110-K114 WeakPolarHBondContact O-CG 3.3Å; W110-K114 PolarHBondContact O-N 3.18Å; L112-K114 VanDerWaalsContact C-N 3.28Å; L112-K114 PolarHBondContact O-N 2.92Å
115	K	93.2	Very high	91.2	Very high	124 Å²	124	60.3 Å²	60.3	54%	0.539	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-2.6	175.7	-63.8	173.5	-178	177.1	0	112.8	T111 L112 E113 E117	T111-K115 WeakPolarHBondContact O-CG 3.32Å; L112-K115 CarbonylContact O-C 3.49Å; L112-K115 WeakPolarHBondContact O-CA 3.47Å; L112-K115 WeakPolarHBondContact O-CB 3.37Å; L112-K115 PolarHBondContact O-N 3.36Å; E113-K115 PolarHBondContact O-N 3.42Å; E113-K115 VanDerWaalsContact O-N 3.15Å; K115-E117 HydrophobicContact CB-CB 4.46Å; K115-E117 HydrophobicContact CB-CG 4.11Å
116	G	91.4	Very high	91.1	Very high	74 Å²	74	62.7 Å²	62.7	76%	0.763	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	19.6	-171.1	0	0	0	0	0	113.3	L112 E113	L112-G116 PolarHBondContact O-N 3.05Å; L112-G116 VanDerWaalsContact O-N 3.15Å; E113-G116 PolarHBondContact O-N 3.32Å
117	E	91.1	Very high	91.1	Very high	106 Å²	106	65.6 Å²	65.6	50%	0.495	34%	0.344	S	S	.	.			trans	-104.2	158.7	179.7	-66.7	175.2	-140.2	0	0	110.6	L112 E113 K115	L112-E117 CarbonylContact C-O 3.51Å; L112-E117 VanDerWaalsContact C-O 3.22Å; L112-E117 HydrophobicContact CB-CB 4Å; L112-E117 HydrophobicContact CD2-CB 4.13Å; L112-E117 WeakPolarHBondContact CD2-OE2 3.4Å; L112-E117 PolarHBondContact O-N 3.21Å; E113-E117 PolarHBondContact N-O 3.48Å; K115-E117 HydrophobicContact CB-CB 4.46Å; K115-E117 HydrophobicContact CB-CG 4.11Å
118	S	85.2	Confident	91.1	Very high	105 Å²	105	57.6 Å²	57.6	73%	0.734	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-103.8	140.2	175.1	-65	0	0	0	0	111
119	P	84.9	Confident	91.3	Very high	23 Å²	23	65 Å²	65	15%	0.149	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-63.8	144.9	173.6	29.2	-36.1	0	0	0	111.9	P101 V109 L112 F121	P101-P119 HydrophobicContact CB-CB 4.49Å; P101-P119 HydrophobicContact CG-CB 4.2Å; V109-P119 HydrophobicContact CB-CG 4.41Å; V109-P119 HydrophobicContact CG1-CG 4.23Å; V109-P119 HydrophobicContact CG2-CB 4.09Å; V109-P119 HydrophobicContact CG2-CG 4.02Å; L112-P119 VanDerWaalsContact CD1-CA 3.49Å; L112-P119 HydrophobicContact CD1-CB 4.08Å; P119-F121 HydrophobicContact CB-CE2 4.17Å; P119-F121 HydrophobicContact CG-CE2 3.75Å; P119-F121 HydrophobicContact CG-CZ 4.26Å
120	H	82.6	Confident	91.5	Very high	142 Å²	142	65.4 Å²	65.4	66%	0.657	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-90.5	135.9	170.2	-166.7	65.8	0	0	0	109.6	D122	H120-D122 IonicContact CD2-OD1 3.13Å; H120-D122 PolarHBondContact CD2-OD1 3.47Å; H120-D122 IonicContact NE2-OD1 3.31Å; H120-D122 PolarHBondContact NE2-OD1 3.23Å
121	F	83.1	Confident	91.7	Very high	41 Å²	41	65.5 Å²	65.5	18%	0.18	34%	0.342	C	S	.	.			trans	-117.8	123.7	174.1	-67.3	-94	0	0	0	108	V42 P101 P119 T123	V42-F121 HydrophobicContact CB-CB 4.34Å; V42-F121 HydrophobicContact CB-CD1 3.38Å; V42-F121 HydrophobicContact CB-CD2 4.3Å; V42-F121 HydrophobicContact CB-CE1 3.55Å; V42-F121 HydrophobicContact CB-CE2 4.44Å; V42-F121 HydrophobicContact CB-CG 3.78Å; V42-F121 HydrophobicContact CB-CZ 4.1Å; V42-F121 HydrophobicContact CG1-CD1 3.29Å; V42-F121 HydrophobicContact CG1-CE1 3.58Å; V42-F121 HydrophobicContact CG1-CG 4.09Å; V42-F121 HydrophobicContact CG2-CB 4.11Å; V42-F121 HydrophobicContact CG2-CD1 4.08Å; V42-F121 HydrophobicContact CG2-CG 4.04Å; V42-F121 WeakPolarHBondContact O-CE1 3.17Å; V42-F121 VanDerWaalsContact O-CZ 3.29Å; V42-F121 WeakPolarHBondContact O-CZ 3.39Å; P101-F121 HydrophobicContact CG-CD1 3.61Å; P101-F121 HydrophobicContact CG-CD2 4.49Å; P101-F121 HydrophobicContact CG-CE1 3.33Å; P101-F121 HydrophobicContact CG-CE2 4.27Å; P101-F121 HydrophobicContact CG-CG 4.2Å; P101-F121 HydrophobicContact CG-CZ 3.7Å; P119-F121 HydrophobicContact CB-CE2 4.17Å; P119-F121 HydrophobicContact CG-CE2 3.75Å; P119-F121 HydrophobicContact CG-CZ 4.26Å; F121-T123 VanDerWaalsContact C-N 3.29Å
122	D	83.8	Confident	91.9	Very high	122 Å²	122	67.8 Å²	67.8	65%	0.652	35%	0.354	S	S	*	.	S	Bend	trans	-84.7	-10	178.4	-58.6	-49.5	0	0	0	111.8	G99 H120	G99-D122 PolarHBondContact O-N 3.04Å; G99-D122 VanDerWaalsContact O-N 3.15Å; H120-D122 IonicContact CD2-OD1 3.13Å; H120-D122 PolarHBondContact CD2-OD1 3.47Å; H120-D122 IonicContact NE2-OD1 3.31Å; H120-D122 PolarHBondContact NE2-OD1 3.23Å
123	T	91.6	Very high	92.1	Very high	29 Å²	29	67.1 Å²	67.1	18%	0.178	35%	0.35	C	S	.	.	S	Bend	trans	-149.4	168	-177.2	-162.6	0	0	0	0	112.2	V42 S98 I100 F121 A128	V42-T123 WeakPolarHBondContact CG2-O 3.44Å; S98-T123 WeakPolarHBondContact O-CG2 3.19Å; I100-T123 HydrophobicContact CG1-CG2 4.06Å; F121-T123 VanDerWaalsContact C-N 3.29Å; T123-A128 HydrophobicContact CG2-CB 3.73Å; T123-A128 PolarHBondContact OG1-N 3.16Å
124	T	91.4	Very high	92.4	Very high	16 Å²	16	62.4 Å²	62.4	10%	0.098	33%	0.328	C	S	.	.			trans	-93.4	162.5	167.2	68.7	0	0	0	0	110.1	A38 E126 D127 A128	A38-T124 HydrophobicContact CB-CG2 3.75Å; T124-E126 PolarHBondContact O-N 2.94Å; T124-D127 PolarHBondContact O-N 3.37Å; T124-D127 WeakPolarHBondContact OG1-CB 3.3Å; T124-D127 PolarHBondContact OG1-N 3.41Å; T124-D127 PolarHBondContact OG1-OD2 2.85Å; T124-A128 VanDerWaalsContact O-CB 3.28Å; T124-A128 WeakPolarHBondContact O-CB 3.33Å; T124-A128 PolarHBondContact O-N 2.84Å
125	F	92.9	Very high	92.8	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.018	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-34.3	174.2	-73.4	-50.1	0	0	0	112.2	S41 V42 I100 D155 M175 F176 V192	S41-F125 WeakPolarHBondContact O-CD2 3.41Å; S41-F125 VanDerWaalsContact O-CE2 3.23Å; S41-F125 WeakPolarHBondContact O-CE2 3.38Å; V42-F125 HydrophobicContact CB-CE2 4.49Å; V42-F125 HydrophobicContact CG1-CD1 4.05Å; V42-F125 HydrophobicContact CG1-CD2 4.12Å; V42-F125 HydrophobicContact CG1-CE1 4.01Å; V42-F125 HydrophobicContact CG1-CE2 4.08Å; V42-F125 HydrophobicContact CG1-CG 4.09Å; V42-F125 HydrophobicContact CG1-CZ 4.02Å; I100-F125 HydrophobicContact CD1-CD1 3.88Å; I100-F125 HydrophobicContact CD1-CE1 4.01Å; I100-F125 HydrophobicContact CG2-CE1 4.06Å; F125-D155 HydrophobicContact CD1-CB 3.91Å; F125-D155 HydrophobicContact CE1-CB 3.77Å; F125-M175 HydrophobicContact CD2-CB 4.36Å; F125-M175 HydrophobicContact CD2-CE 4.12Å; F125-M175 HydrophobicContact CD2-CG 4Å; F125-M175 HydrophobicContact CE2-CE 4.01Å; F125-M175 HydrophobicContact CE2-CG 3.84Å; F125-M175 HydrophobicContact CE2-SD 4.42Å; F125-M175 HydrophobicContact CZ-CG 4.39Å; F125-F176 HydrophobicContact CB-CE2 3.97Å; F125-F176 HydrophobicContact CB-CZ 3.89Å; F125-F176 WeakPolarHBondContact O-CZ 3.48Å; F125-V192 HydrophobicContact CB-CG1 3.79Å; F125-V192 HydrophobicContact CD2-CG1 4.17Å; F125-V192 HydrophobicContact CG-CG1 4.45Å
126	E	94.2	Very high	93	Very high	50 Å²	50	50.9 Å²	50.9	23%	0.234	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-37.2	176.8	-70.5	86.2	170.1	0	0	113.5	S41 T124 R160 F176 V192	S41-E126 PolarHBondContact OG-OE2 3.36Å; T124-E126 PolarHBondContact O-N 2.94Å; E126-R160 PolarHBondContact O-NH2 3.35Å; E126-F176 HydrophobicContact CG-CE1 4.17Å; E126-F176 HydrophobicContact CG-CZ 4.45Å; E126-V192 WeakPolarHBondContact OE1-CG1 3.41Å; E126-V192 VanDerWaalsContact OE1-CG2 3.31Å; E126-V192 WeakPolarHBondContact OE1-CG2 3.48Å; E126-V192 PolarHBondContact OE1-N 3.28Å
127	D	95.4	Very high	93.4	Very high	113 Å²	113	47.4 Å²	47.4	60%	0.604	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-15.2	-177.2	-60.7	-43.5	0	0	0	112.6	T124 R129	T124-D127 PolarHBondContact O-N 3.37Å; T124-D127 WeakPolarHBondContact OG1-CB 3.3Å; T124-D127 PolarHBondContact OG1-N 3.41Å; T124-D127 PolarHBondContact OG1-OD2 2.85Å; D127-R129 PolarHBondContact O-N 2.79Å
128	A	96.3	Very high	93.7	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.008	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-57.6	131.7	176.7	0	0	0	0	0	110.9	I100 T123 T124 L157	I100-A128 HydrophobicContact CD1-CB 3.79Å; I100-A128 HydrophobicContact CG1-CB 4.29Å; T123-A128 HydrophobicContact CG2-CB 3.73Å; T123-A128 PolarHBondContact OG1-N 3.16Å; T124-A128 VanDerWaalsContact O-CB 3.28Å; T124-A128 WeakPolarHBondContact O-CB 3.33Å; T124-A128 PolarHBondContact O-N 2.84Å; A128-L157 HydrophobicContact CB-CD2 3.98Å
129	R	97.9	Very high	94.4	Very high	155 Å²	155	37.9 Å²	37.9	59%	0.585	19%	0.188	S	C	*	.	P	Polyproline II helix	trans	-100.8	140.5	177.7	-54.9	-175.6	62.4	-171.3	0.5	109	S98 D127 S131 W315	S98-R129 VanDerWaalsContact CB-O 3.24Å; S98-R129 WeakPolarHBondContact CB-O 3.08Å; S98-R129 PolarHBondContact OG-O 2.73Å; D127-R129 PolarHBondContact O-N 2.79Å; R129-S131 PolarHBondContact O-N 2.8Å; R129-W315 HydrophobicContact CB-CE3 4.17Å; R129-W315 HydrophobicContact CB-CH2 4.38Å; R129-W315 HydrophobicContact CB-CZ3 3.85Å; R129-W315 HydrophobicContact CG-CE3 4.23Å; R129-W315 HydrophobicContact CG-CH2 4.09Å; R129-W315 HydrophobicContact CG-CZ3 3.51Å
130	P	98.7	Very high	95	Very high	14 Å²	14	36.8 Å²	36.8	9%	0.091	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-54.2	132.6	171.8	-23.4	33.5	0	0	0	110.6	H134 M135 L157 W315	P130-H134 HydrophobicContact CB-CB 3.62Å; P130-M135 HydrophobicContact CB-CG 4.38Å; P130-M135 HydrophobicContact CB-SD 3.9Å; P130-M135 HydrophobicContact CG-SD 4.39Å; P130-L157 HydrophobicContact CG-CD2 4.43Å; P130-W315 VanDerWaalsContact CD-CE2 3.43Å; P130-W315 HydrophobicContact CG-CD2 4.15Å; P130-W315 HydrophobicContact CG-CG 4.12Å; P130-W315 HydrophobicContact CG-CZ2 4.43Å
131	S	98.8	Very high	95.8	Very high	8 Å²	8	31.6 Å²	31.6	6%	0.056	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-67	172.3	176	67.1	0	0	0	0	111.9	I94 S97 S98 R129 T133 H134 M135	I94-S131 WeakPolarHBondContact O-CB 3.37Å; I94-S131 PolarHBondContact O-OG 3.28Å; S97-S131 WeakPolarHBondContact OG-CB 3.13Å; S98-S131 PolarHBondContact OG-N 2.85Å; R129-S131 PolarHBondContact O-N 2.8Å; S131-T133 PolarHBondContact O-N 3.22Å; S131-T133 PolarHBondContact OG-N 2.84Å; S131-H134 PolarHBondContact N-ND1 3.23Å; S131-H134 WeakPolarHBondContact O-CB 3.21Å; S131-H134 PolarHBondContact O-N 3.43Å; S131-H134 VanDerWaalsContact O-N 3.11Å; S131-H134 PolarHBondContact OG-N 3.12Å; S131-H134 PolarHBondContact OG-ND1 2.58Å; S131-M135 PolarHBondContact O-N 3.46Å
132	L	98.8	Very high	96.5	Very high	56 Å²	56	37.7 Å²	37.7	29%	0.293	18%	0.179	S	C	.	.	H	α-helix	trans	-55.3	-42.6	173.3	-177.1	156.4	0	0	0	110.4	H134 M135 A136 D298 M301 K302 I312	L132-H134 PolarHBondContact O-N 2.85Å; L132-M135 PolarHBondContact O-N 3.16Å; L132-A136 HydrophobicContact CD2-CB 4.46Å; L132-A136 WeakPolarHBondContact O-CB 3.15Å; L132-A136 PolarHBondContact O-N 2.9Å; L132-D298 HydrophobicContact CB-CB 4.19Å; L132-D298 WeakPolarHBondContact CD2-O 3.42Å; L132-M301 HydrophobicContact CD2-CB 4.11Å; L132-K302 HydrophobicContact CD1-CB 4.14Å; L132-K302 HydrophobicContact CD1-CD 4.48Å; L132-K302 HydrophobicContact CD1-CG 4.43Å; L132-K302 HydrophobicContact CD2-CB 4.1Å; L132-I312 HydrophobicContact CD1-CD1 4.18Å; L132-I312 HydrophobicContact CD2-CD1 3.61Å; L132-I312 HydrophobicContact CG-CD1 3.8Å
133	T	98.9	Very high	97.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.9	-44.2	176	-65.5	0	0	0	0	112.6	I94 S131 M135 A136 L137 L252 V297 D298 M301	I94-T133 HydrophobicContact CB-CG2 3.99Å; I94-T133 HydrophobicContact CG2-CG2 3.9Å; S131-T133 PolarHBondContact O-N 3.22Å; S131-T133 PolarHBondContact OG-N 2.84Å; T133-M135 VanDerWaalsContact C-N 3.32Å; T133-M135 PolarHBondContact O-N 2.98Å; T133-A136 PolarHBondContact O-N 3.35Å; T133-L137 HydrophobicContact CG2-CD1 4.2Å; T133-L137 VanDerWaalsContact O-CG 3.27Å; T133-L137 WeakPolarHBondContact O-CG 3.4Å; T133-L137 PolarHBondContact O-N 2.92Å; T133-L252 HydrophobicContact CG2-CD1 4Å; T133-V297 PolarHBondContact OG1-O 2.89Å; T133-D298 VanDerWaalsContact CB-OD1 3.29Å; T133-D298 WeakPolarHBondContact CB-OD1 3.28Å; T133-D298 PolarHBondContact N-OD1 3.14Å; T133-D298 PolarHBondContact OG1-N 3.2Å; T133-D298 PolarHBondContact OG1-OD1 3.08Å; T133-M301 HydrophobicContact CG2-CG 3.97Å
134	H	98.9	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.7	-44.4	177	-71	86.4	0	0	0	111.6	I94 S95 P130 S131 L132 L137 L138 L157 H158	I94-H134 VanDerWaalsContact CD1-CE1 3.47Å; I94-H134 WeakPolarHBondContact CD1-CE1 3.28Å; I94-H134 VanDerWaalsContact CD1-NE2 3.34Å; I94-H134 WeakPolarHBondContact CD1-NE2 3.36Å; I94-H134 PolarHBondContact O-CE1 2.98Å; S95-H134 PolarHBondContact OG-CE1 3.38Å; P130-H134 HydrophobicContact CB-CB 3.62Å; S131-H134 PolarHBondContact N-ND1 3.23Å; S131-H134 WeakPolarHBondContact O-CB 3.21Å; S131-H134 PolarHBondContact O-N 3.43Å; S131-H134 VanDerWaalsContact O-N 3.11Å; S131-H134 PolarHBondContact OG-N 3.12Å; S131-H134 PolarHBondContact OG-ND1 2.58Å; L132-H134 PolarHBondContact O-N 2.85Å; H134-L137 PolarHBondContact O-N 3.13Å; H134-L138 PolarHBondContact O-N 3.48Å; H134-L138 VanDerWaalsContact O-N 3.17Å; H134-L157 WeakPolarHBondContact NE2-CB 3.39Å; H134-H158 AromaticContact CD2-CE1 3.44Å; H134-H158 PolarHBondContact CD2-CE1 3.48Å; H134-H158 VanDerWaalsContact CD2-CE1 3.44Å; H134-H158 AromaticContact CD2-CG 3.99Å; H134-H158 AromaticContact CD2-ND1 3.35Å; H134-H158 PolarHBondContact CD2-ND1 3.08Å; H134-H158 VanDerWaalsContact CD2-ND1 3.35Å; H134-H158 AromaticContact NE2-CE1 3.86Å
135	M	98.9	Very high	97.8	Very high	10 Å²	10	37 Å²	37	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-71.2	-35.8	179.7	-60.8	-48.7	-62.5	0	0	112	P130 S131 L132 T133 L137 L138 G139 I312 P313 W315	P130-M135 HydrophobicContact CB-CG 4.38Å; P130-M135 HydrophobicContact CB-SD 3.9Å; P130-M135 HydrophobicContact CG-SD 4.39Å; S131-M135 PolarHBondContact O-N 3.46Å; L132-M135 PolarHBondContact O-N 3.16Å; T133-M135 VanDerWaalsContact C-N 3.32Å; T133-M135 PolarHBondContact O-N 2.98Å; M135-L137 VanDerWaalsContact C-N 3.34Å; M135-L137 PolarHBondContact O-N 3.26Å; M135-L138 HydrophobicContact CE-CD2 3.83Å; M135-L138 WeakPolarHBondContact O-CB 3.29Å; M135-L138 PolarHBondContact O-N 3.37Å; M135-G139 PolarHBondContact O-N 2.92Å; M135-I312 HydrophobicContact CB-CG2 3.56Å; M135-P313 HydrophobicContact CE-CB 4.05Å; M135-P313 WeakPolarHBondContact CE-O 3.28Å; M135-P313 WeakPolarHBondContact O-CD 3.33Å; M135-W315 HydrophobicContact CE-CB 3.96Å; M135-W315 HydrophobicContact CG-CB 4.49Å; M135-W315 HydrophobicContact SD-CB 3.88Å; M135-W315 HydrophobicContact SD-CG 4.33Å
136	A	98.9	Very high	98.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.6	-40.5	173.8	0	0	0	0	0	111.5	L132 T133 L138 G139 L140 M301 M305 I312	L132-A136 HydrophobicContact CD2-CB 4.46Å; L132-A136 WeakPolarHBondContact O-CB 3.15Å; L132-A136 PolarHBondContact O-N 2.9Å; T133-A136 PolarHBondContact O-N 3.35Å; A136-L138 VanDerWaalsContact C-N 3.34Å; A136-L138 PolarHBondContact O-N 3.23Å; A136-G139 WeakPolarHBondContact O-CA 3.47Å; A136-G139 PolarHBondContact O-N 3.41Å; A136-G139 VanDerWaalsContact O-N 3.13Å; A136-L140 WeakPolarHBondContact O-CG 3.24Å; A136-L140 PolarHBondContact O-N 3.19Å; A136-M301 HydrophobicContact CB-CB 4.05Å; A136-M301 HydrophobicContact CB-CE 3.75Å; A136-M305 HydrophobicContact CB-CG 3.79Å; A136-M305 HydrophobicContact CB-SD 4.13Å; A136-I312 HydrophobicContact CB-CD1 4.37Å; A136-I312 HydrophobicContact CB-CG1 4.41Å
137	L	98.9	Very high	98.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.1	-38.6	174.3	-68.3	171	0	0	0	112.3	V88 T133 H134 M135 L140 Q141 L146 L149 F163 L252 M301	V88-L137 HydrophobicContact CB-CD2 4.19Å; V88-L137 HydrophobicContact CG1-CD1 4.37Å; V88-L137 HydrophobicContact CG1-CD2 3.81Å; V88-L137 HydrophobicContact CG2-CD2 3.86Å; T133-L137 HydrophobicContact CG2-CD1 4.2Å; T133-L137 VanDerWaalsContact O-CG 3.27Å; T133-L137 WeakPolarHBondContact O-CG 3.4Å; T133-L137 PolarHBondContact O-N 2.92Å; H134-L137 PolarHBondContact O-N 3.13Å; M135-L137 VanDerWaalsContact C-N 3.34Å; M135-L137 PolarHBondContact O-N 3.26Å; L137-L140 HydrophobicContact CD2-CD1 4.37Å; L137-L140 PolarHBondContact O-N 3.45Å; L137-Q141 WeakPolarHBondContact O-CB 3.43Å; L137-Q141 PolarHBondContact O-N 3.17Å; L137-L146 HydrophobicContact CB-CD2 4.2Å; L137-L146 HydrophobicContact CD2-CD2 3.92Å; L137-L149 HydrophobicContact CD1-CD1 4.29Å; L137-F163 HydrophobicContact CB-CE2 4.47Å; L137-L252 HydrophobicContact CD1-CD1 4.32Å; L137-L252 HydrophobicContact CD2-CD1 4.05Å; L137-M301 HydrophobicContact CD2-CE 4.11Å; L137-M301 HydrophobicContact CG-CE 4.41Å
138	L	98.8	Very high	98.5	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-62	-43.7	171	178.3	64	0	0	0	111.5	H134 M135 A136 Q141 R142 S161 P313	H134-L138 PolarHBondContact O-N 3.48Å; H134-L138 VanDerWaalsContact O-N 3.17Å; M135-L138 HydrophobicContact CE-CD2 3.83Å; M135-L138 WeakPolarHBondContact O-CB 3.29Å; M135-L138 PolarHBondContact O-N 3.37Å; A136-L138 VanDerWaalsContact C-N 3.34Å; A136-L138 PolarHBondContact O-N 3.23Å; L138-Q141 PolarHBondContact O-N 3.46Å; L138-R142 HydrophobicContact CD1-CG 4.35Å; L138-R142 WeakPolarHBondContact O-CB 3.21Å; L138-R142 WeakPolarHBondContact O-CG 3.41Å; L138-R142 PolarHBondContact O-N 3.31Å; L138-S161 WeakPolarHBondContact CD2-O 3.39Å; L138-P313 HydrophobicContact CD2-CB 4.4Å; L138-P313 HydrophobicContact CD2-CG 4.45Å; L138-P313 HydrophobicContact CG-CG 4.46Å
139	G	98.6	Very high	98.6	Very high	7 Å²	7	33.4 Å²	33.4	7%	0.072	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-48.8	175	0	0	0	0	0	112.5	M135 A136 Q141 R142 A143	M135-G139 PolarHBondContact O-N 2.92Å; A136-G139 WeakPolarHBondContact O-CA 3.47Å; A136-G139 PolarHBondContact O-N 3.41Å; A136-G139 VanDerWaalsContact O-N 3.13Å; G139-Q141 VanDerWaalsContact C-N 3.33Å; G139-Q141 PolarHBondContact O-N 2.96Å; G139-R142 PolarHBondContact O-N 2.8Å; G139-A143 WeakPolarHBondContact O-CB 3.37Å; G139-A143 PolarHBondContact O-N 3.37Å
140	L	98.8	Very high	98.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.3	-40	176.4	-73.5	171.9	0	0	0	112.7	A136 L137 G144 Y145 L146 M301 M305 L308 L310	A136-L140 WeakPolarHBondContact O-CG 3.24Å; A136-L140 PolarHBondContact O-N 3.19Å; L137-L140 HydrophobicContact CD2-CD1 4.37Å; L137-L140 PolarHBondContact O-N 3.45Å; L140-G144 PolarHBondContact O-N 3.13Å; L140-Y145 HydrophobicContact CD2-CD2 4.33Å; L140-Y145 HydrophobicContact CD2-CG 4.44Å; L140-Y145 PolarHBondContact O-N 2.87Å; L140-L146 HydrophobicContact CB-CB 3.91Å; L140-L146 PolarHBondContact O-N 3.34Å; L140-M301 HydrophobicContact CD1-CE 3.67Å; L140-M305 HydrophobicContact CD2-SD 3.99Å; L140-M305 HydrophobicContact CG-SD 3.82Å; L140-L308 HydrophobicContact CD2-CD1 3.53Å; L140-L310 HydrophobicContact CD2-CD1 3.84Å
141	Q	98.6	Very high	98.7	Very high	33 Å²	33	25.7 Å²	25.7	15%	0.154	13%	0.13	C	C	.	.	H	α-helix	trans	-66.1	-47.3	177.2	-174.2	-75.4	-61.6	0	0	110.5	L137 L138 G139 A143 G144 L146 F163 P164	L137-Q141 WeakPolarHBondContact O-CB 3.43Å; L137-Q141 PolarHBondContact O-N 3.17Å; L138-Q141 PolarHBondContact O-N 3.46Å; G139-Q141 VanDerWaalsContact C-N 3.33Å; G139-Q141 PolarHBondContact O-N 2.96Å; Q141-A143 VanDerWaalsContact C-N 3.3Å; Q141-A143 PolarHBondContact O-N 3.42Å; Q141-G144 WeakPolarHBondContact O-CA 3.4Å; Q141-G144 PolarHBondContact O-N 3.09Å; Q141-L146 HydrophobicContact CB-CB 4.26Å; Q141-L146 HydrophobicContact CB-CD2 4.44Å; Q141-F163 HydrophobicContact CB-CE2 3.77Å; Q141-F163 HydrophobicContact CB-CZ 4.12Å; Q141-F163 HydrophobicContact CG-CE2 4.09Å; Q141-F163 HydrophobicContact CG-CZ 3.97Å; Q141-P164 HydrophobicContact CG-CG 4.03Å; Q141-P164 VanDerWaalsContact OE1-CG 3.3Å
142	R	97.6	Very high	98.7	Very high	170 Å²	170	26.3 Å²	26.3	64%	0.642	13%	0.132	S	C	*	.	H	α-helix	trans	-62.6	-36	178.2	-74.4	179.2	174.5	-176.4	-0.3	112.8	L138 G139 G144	L138-R142 HydrophobicContact CD1-CG 4.35Å; L138-R142 WeakPolarHBondContact O-CB 3.21Å; L138-R142 WeakPolarHBondContact O-CG 3.41Å; L138-R142 PolarHBondContact O-N 3.31Å; G139-R142 PolarHBondContact O-N 2.8Å; R142-G144 PolarHBondContact O-N 3.44Å
143	A	98.1	Very high	98.6	Very high	46 Å²	46	23.9 Å²	23.9	38%	0.38	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.1	174	0	0	0	0	0	113.4	G139 Q141 Y145 L310	G139-A143 WeakPolarHBondContact O-CB 3.37Å; G139-A143 PolarHBondContact O-N 3.37Å; Q141-A143 VanDerWaalsContact C-N 3.3Å; Q141-A143 PolarHBondContact O-N 3.42Å; A143-Y145 VanDerWaalsContact C-N 3.35Å; A143-Y145 HydrophobicContact CB-CD2 3.85Å; A143-Y145 HydrophobicContact CB-CE2 4.24Å; A143-Y145 PolarHBondContact O-N 2.91Å; A143-L310 HydrophobicContact CB-CD1 3.82Å; A143-L310 HydrophobicContact CB-CD2 3.64Å; A143-L310 HydrophobicContact CB-CG 4.4Å
144	G	97.9	Very high	98.5	Very high	34 Å²	34	24.5 Å²	24.5	35%	0.351	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	2.1	176.3	0	0	0	0	0	115.2	L140 Q141 R142 K147	L140-G144 PolarHBondContact O-N 3.13Å; Q141-G144 WeakPolarHBondContact O-CA 3.4Å; Q141-G144 PolarHBondContact O-N 3.09Å; R142-G144 PolarHBondContact O-N 3.44Å; G144-K147 WeakPolarHBondContact O-CE 3.44Å; G144-K147 PolarHBondContact O-NZ 3.48Å
145	Y	98.6	Very high	98.5	Very high	71 Å²	71	24.8 Å²	24.8	28%	0.278	13%	0.125	S	C	.	.			trans	-70.3	-53.2	175	-72.8	-77.9	0	0	0	111	I80 L86 L140 A143 K147 L310	I80-Y145 HydrophobicContact CG2-CD1 3.57Å; I80-Y145 HydrophobicContact CG2-CE1 4.21Å; I80-Y145 HydrophobicContact CG2-CG 4.04Å; L86-Y145 WeakPolarHBondContact CB-O 3.33Å; L140-Y145 HydrophobicContact CD2-CD2 4.33Å; L140-Y145 HydrophobicContact CD2-CG 4.44Å; L140-Y145 PolarHBondContact O-N 2.87Å; A143-Y145 VanDerWaalsContact C-N 3.35Å; A143-Y145 HydrophobicContact CB-CD2 3.85Å; A143-Y145 HydrophobicContact CB-CE2 4.24Å; A143-Y145 PolarHBondContact O-N 2.91Å; Y145-K147 PolarHBondContact O-N 2.83Å; Y145-L310 HydrophobicContact CD2-CD1 3.82Å; Y145-L310 HydrophobicContact CE2-CD1 3.84Å; Y145-L310 HydrophobicContact CE2-CD2 4.46Å
146	L	98.8	Very high	98.4	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	113.4	-176.9	177.3	56.7	0	0	0	111.4	L86 V88 L137 L140 Q141 Y148 F163	L86-L146 HydrophobicContact CD2-CB 4.47Å; L86-L146 HydrophobicContact CD2-CD1 4.4Å; L86-L146 HydrophobicContact CG-CD1 4.16Å; V88-L146 HydrophobicContact CB-CD1 3.82Å; V88-L146 HydrophobicContact CG2-CD1 3.48Å; V88-L146 VanDerWaalsContact CG2-CD1 3.48Å; V88-L146 HydrophobicContact CG2-CD2 4.29Å; L137-L146 HydrophobicContact CB-CD2 4.2Å; L137-L146 HydrophobicContact CD2-CD2 3.92Å; L140-L146 HydrophobicContact CB-CB 3.91Å; L140-L146 PolarHBondContact O-N 3.34Å; Q141-L146 HydrophobicContact CB-CB 4.26Å; Q141-L146 HydrophobicContact CB-CD2 4.44Å; L146-Y148 WeakPolarHBondContact CD1-O 3.49Å; L146-F163 HydrophobicContact CD2-CE2 3.77Å; L146-F163 HydrophobicContact CD2-CZ 3.9Å; L146-F163 HydrophobicContact CG-CZ 4.47Å
147	K	98.8	Very high	98.4	Very high	78 Å²	78	24.4 Å²	24.4	34%	0.339	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-32.4	-178.9	-56	-51.3	-174.8	-171.8	0	113.4	E84 Y85 L86 G144 Y145	E84-K147 WeakPolarHBondContact O-CE 3.49Å; Y85-K147 HydrophobicContact CD1-CB 4.11Å; Y85-K147 HydrophobicContact CD1-CG 4.32Å; Y85-K147 HydrophobicContact CD2-CB 4.02Å; Y85-K147 HydrophobicContact CD2-CG 3.75Å; Y85-K147 HydrophobicContact CE1-CB 3.95Å; Y85-K147 HydrophobicContact CE2-CB 3.81Å; Y85-K147 HydrophobicContact CE2-CG 4.02Å; Y85-K147 HydrophobicContact CG-CB 4.18Å; Y85-K147 HydrophobicContact CG-CG 3.92Å; L86-K147 PolarHBondContact O-N 2.92Å; G144-K147 WeakPolarHBondContact O-CE 3.44Å; G144-K147 PolarHBondContact O-NZ 3.48Å; Y145-K147 PolarHBondContact O-N 2.83Å
148	Y	98.9	Very high	98.4	Very high	13 Å²	13	24.6 Å²	24.6	5%	0.051	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	142.7	-177.5	-152.2	-97.4	0	0	0	112.1	V87 V88 L146 I150 K167 L168 S169 R238 A242	V87-Y148 WeakPolarHBondContact CA-O 3.4Å; V88-Y148 PolarHBondContact N-O 3.46Å; L146-Y148 WeakPolarHBondContact CD1-O 3.49Å; Y148-I150 HydrophobicContact CD1-CD1 4.33Å; Y148-I150 HydrophobicContact CD1-CG1 3.73Å; Y148-I150 HydrophobicContact CE1-CG1 3.92Å; Y148-K167 HydrophobicContact CD2-CB 4.49Å; Y148-L168 PolarHBondContact OH-O 3.4Å; Y148-S169 WeakPolarHBondContact CE1-OG 3.49Å; Y148-S169 PolarHBondContact OH-OG 3.48Å; Y148-R238 VanDerWaalsContact OH-CB 3.23Å; Y148-R238 WeakPolarHBondContact OH-CB 3.24Å; Y148-R238 PolarHBondContact OH-NE 3.12Å; Y148-R238 PolarHBondContact OH-NH1 3.06Å; Y148-R238 PolarHBondContact OH-NH2 3.05Å; Y148-R238 VanDerWaalsContact OH-NH2 3.08Å; Y148-A242 HydrophobicContact CD1-CB 3.52Å; Y148-A242 HydrophobicContact CD2-CB 4.34Å; Y148-A242 HydrophobicContact CE1-CB 4.22Å; Y148-A242 HydrophobicContact CG-CB 3.6Å
149	L	98.9	Very high	98.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.6	178.2	176.6	60	0	0	0	110.1	V88 L137 H158 F163 K167 L168 S169	V88-L149 HydrophobicContact CB-CD1 3.85Å; V88-L149 HydrophobicContact CG1-CD1 3.63Å; L137-L149 HydrophobicContact CD1-CD1 4.29Å; L149-H158 HydrophobicContact CD2-CB 4.42Å; L149-F163 HydrophobicContact CB-CE1 3.63Å; L149-F163 HydrophobicContact CB-CE2 4.29Å; L149-F163 HydrophobicContact CB-CZ 3.48Å; L149-F163 VanDerWaalsContact CB-CZ 3.48Å; L149-F163 HydrophobicContact CD2-CD1 4.01Å; L149-F163 HydrophobicContact CD2-CD2 3.96Å; L149-F163 HydrophobicContact CD2-CE1 3.83Å; L149-F163 HydrophobicContact CD2-CE2 3.77Å; L149-F163 HydrophobicContact CD2-CG 4.08Å; L149-F163 HydrophobicContact CD2-CZ 3.71Å; L149-F163 HydrophobicContact CG-CE1 4.38Å; L149-F163 HydrophobicContact CG-CZ 4.27Å; L149-K167 PolarHBondContact N-O 3.43Å; L149-L168 HydrophobicContact CB-CD1 4.13Å; L149-L168 HydrophobicContact CD2-CD1 3.86Å; L149-L168 HydrophobicContact CG-CD1 3.73Å; L149-L168 CarbonylContact O-C 3.52Å; L149-L168 WeakPolarHBondContact O-CA 3.44Å; L149-S169 PolarHBondContact O-N 3.11Å
150	I	98.9	Very high	98.4	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.6	179.3	-58.9	166.7	0	0	0	107.2	V87 V88 H89 S90 Y148 L171 A239 S243 L264	V87-I150 HydrophobicContact CG1-CD1 3.62Å; V87-I150 HydrophobicContact CG1-CG1 4.21Å; V88-I150 PolarHBondContact O-N 3.34Å; H89-I150 CarbonylContact C-O 3.51Å; H89-I150 VanDerWaalsContact CA-O 3.24Å; H89-I150 WeakPolarHBondContact CA-O 3.34Å; H89-I150 VanDerWaalsContact CE1-CD1 3.49Å; H89-I150 WeakPolarHBondContact CE1-CD1 3.29Å; S90-I150 PolarHBondContact N-O 3.49Å; Y148-I150 HydrophobicContact CD1-CD1 4.33Å; Y148-I150 HydrophobicContact CD1-CG1 3.73Å; Y148-I150 HydrophobicContact CE1-CG1 3.92Å; I150-L171 HydrophobicContact CG2-CD1 3.49Å; I150-L171 VanDerWaalsContact CG2-CD1 3.49Å; I150-L171 HydrophobicContact CG2-CG 3.94Å; I150-A239 HydrophobicContact CD1-CB 3.73Å; I150-A239 WeakPolarHBondContact CD1-O 3.35Å; I150-A239 HydrophobicContact CG1-CB 3.82Å; I150-A239 HydrophobicContact CG2-CB 3.92Å; I150-S243 VanDerWaalsContact CD1-OG 3.31Å; I150-S243 WeakPolarHBondContact CD1-OG 3.39Å; I150-L264 HydrophobicContact CG2-CD1 3.98Å
151	S	98.9	Very high	98.4	Very high	2 Å²	2	25 Å²	25	1%	0.014	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.9	-176.8	-158.8	0	0	0	0	112.4	S90 N153 H158 S169 L171	S90-S151 PolarHBondContact OG-OG 3.39Å; S151-N153 WeakPolarHBondContact OG-CB 3.43Å; S151-N153 PolarHBondContact OG-N 3.15Å; S151-N153 VanDerWaalsContact OG-N 3.15Å; S151-H158 PolarHBondContact OG-CD2 3.25Å; S151-S169 PolarHBondContact N-O 3.19Å; S151-L171 PolarHBondContact O-N 3.23Å
152	Q	98.6	Very high	98.4	Very high	21 Å²	21	23.7 Å²	23.7	10%	0.098	12%	0.12	C	C	.	.			trans	-95.8	-4	166.2	-68.5	165	83.5	0	0	111.6	S90 H172 T254	S90-Q152 PolarHBondContact O-N 2.76Å; S90-Q152 VanDerWaalsContact O-N 3.08Å; Q152-H172 PolarHBondContact O-ND1 3.11Å; Q152-T254 PolarHBondContact NE2-OG1 3.08Å
153	N	98.1	Very high	98.4	Very high	6 Å²	6	15.6 Å²	15.6	3%	0.032	9%	0.089	C	C	.	.			trans	-81.2	139.7	-173.7	-66.5	3.5	0	0	0	110.5	G91 A92 S95 S151 D155	G91-N153 WeakPolarHBondContact CA-OD1 3.17Å; G91-N153 PolarHBondContact O-ND2 3.16Å; G91-N153 VanDerWaalsContact O-ND2 3.13Å; G91-N153 PolarHBondContact O-OD1 2.9Å; A92-N153 WeakPolarHBondContact CA-OD1 3.46Å; A92-N153 PolarHBondContact N-OD1 2.9Å; S95-N153 PolarHBondContact OG-ND2 2.96Å; S151-N153 WeakPolarHBondContact OG-CB 3.43Å; S151-N153 PolarHBondContact OG-N 3.15Å; S151-N153 VanDerWaalsContact OG-N 3.15Å; N153-D155 WeakPolarHBondContact CB-OD2 3.49Å; N153-D155 PolarHBondContact ND2-OD2 3.32Å
154	V	97.2	Very high	98.4	Very high	12 Å²	12	13.5 Å²	13.5	7%	0.073	7%	0.072	C	C	.	.			trans	-100.6	-5.2	174.3	-60	0	0	0	0	112.8	Y44 G156 H172 M175 I224	Y44-V154 HydrophobicContact CD2-CG2 4.21Å; Y44-V154 HydrophobicContact CG-CG2 4.29Å; V154-G156 PolarHBondContact O-N 3.08Å; V154-G156 VanDerWaalsContact O-N 3.14Å; V154-H172 HydrophobicContact CG1-CB 3.94Å; V154-H172 VanDerWaalsContact CG1-O 3.3Å; V154-H172 WeakPolarHBondContact CG1-O 3.36Å; V154-M175 HydrophobicContact CB-CG 4.24Å; V154-M175 HydrophobicContact CG2-CG 4.17Å; V154-M175 WeakPolarHBondContact O-CB 3.27Å; V154-M175 WeakPolarHBondContact O-CG 3.34Å; V154-M175 PolarHBondContact O-N 2.84Å; V154-I224 HydrophobicContact CB-CD1 3.7Å; V154-I224 HydrophobicContact CG1-CD1 3.83Å
155	D	97.3	Very high	98.4	Very high	7 Å²	7	13.1 Å²	13.1	4%	0.037	6%	0.06	C	C	.	.	S	Bend	trans	-64.9	-15.3	-175.1	58.9	38.4	0	0	0	114.5	S95 I100 F125 N153 L157 F176	S95-D155 WeakPolarHBondContact CB-OD2 3.26Å; S95-D155 PolarHBondContact OG-OD2 2.99Å; I100-D155 HydrophobicContact CD1-CB 3.78Å; F125-D155 HydrophobicContact CD1-CB 3.91Å; F125-D155 HydrophobicContact CE1-CB 3.77Å; N153-D155 WeakPolarHBondContact CB-OD2 3.49Å; N153-D155 PolarHBondContact ND2-OD2 3.32Å; D155-L157 HydrophobicContact CB-CG 4.22Å; D155-L157 PolarHBondContact O-N 2.84Å; D155-L157 WeakPolarHBondContact OD1-CB 3.36Å; D155-L157 PolarHBondContact OD1-N 3.04Å; D155-F176 WeakPolarHBondContact O-CE2 3.34Å
156	G	97.9	Very high	98.4	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.01	6%	0.059	C	C	.	.			trans	69.4	9.1	179.9	0	0	0	0	0	115.5	V154 H158 V159 R160 N174	V154-G156 PolarHBondContact O-N 3.08Å; V154-G156 VanDerWaalsContact O-N 3.14Å; G156-H158 VanDerWaalsContact C-N 3.32Å; G156-H158 PolarHBondContact O-N 2.86Å; G156-V159 PolarHBondContact O-N 2.93Å; G156-R160 WeakPolarHBondContact O-CB 3.45Å; G156-R160 VanDerWaalsContact O-CG 3.32Å; G156-R160 WeakPolarHBondContact O-CG 3.4Å; G156-R160 PolarHBondContact O-N 3.4Å; G156-N174 VanDerWaalsContact CA-ND2 3.33Å; G156-N174 WeakPolarHBondContact CA-ND2 3.44Å; G156-N174 WeakPolarHBondContact CA-OD1 3.49Å
157	L	98.6	Very high	98.4	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-67.2	-30.2	-176.1	-70.7	-179.5	0	0	0	113	I100 A128 P130 H134 D155 S161	I100-L157 HydrophobicContact CD1-CD1 3.92Å; A128-L157 HydrophobicContact CB-CD2 3.98Å; P130-L157 HydrophobicContact CG-CD2 4.43Å; H134-L157 WeakPolarHBondContact NE2-CB 3.39Å; D155-L157 HydrophobicContact CB-CG 4.22Å; D155-L157 PolarHBondContact O-N 2.84Å; D155-L157 WeakPolarHBondContact OD1-CB 3.36Å; D155-L157 PolarHBondContact OD1-N 3.04Å; L157-S161 VanDerWaalsContact O-CB 3.26Å; L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 2.82Å; L157-S161 PolarHBondContact O-OG 3.19Å
158	H	98.8	Very high	98.4	Very high	4 Å²	4	12 Å²	12	2%	0.019	6%	0.058	C	C	.	.	H	α-helix	trans	-63.2	-47.7	171.5	-73.4	-49.7	0	0	0	112	S90 I94 H134 L149 S151 G156 S161 F163 L168	S90-H158 PolarHBondContact OG-NE2 2.76Å; I94-H158 WeakPolarHBondContact CD1-CE1 3.27Å; I94-H158 WeakPolarHBondContact CD1-NE2 3.45Å; H134-H158 AromaticContact CD2-CE1 3.44Å; H134-H158 PolarHBondContact CD2-CE1 3.48Å; H134-H158 VanDerWaalsContact CD2-CE1 3.44Å; H134-H158 AromaticContact CD2-CG 3.99Å; H134-H158 AromaticContact CD2-ND1 3.35Å; H134-H158 PolarHBondContact CD2-ND1 3.08Å; H134-H158 VanDerWaalsContact CD2-ND1 3.35Å; H134-H158 AromaticContact NE2-CE1 3.86Å; L149-H158 HydrophobicContact CD2-CB 4.42Å; S151-H158 PolarHBondContact OG-CD2 3.25Å; G156-H158 VanDerWaalsContact C-N 3.32Å; G156-H158 PolarHBondContact O-N 2.86Å; H158-S161 PolarHBondContact O-N 2.87Å; H158-S161 PolarHBondContact O-OG 3.4Å; H158-F163 WeakPolarHBondContact O-CB 3.36Å; H158-F163 PolarHBondContact O-N 3.05Å; H158-L168 HydrophobicContact CB-CD1 4.36Å; H158-L168 HydrophobicContact CB-CD2 3.93Å
159	V	98.6	Very high	98.4	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.006	6%	0.056	C	C	.	.	H	α-helix	trans	-63.6	-47.1	177.2	174.7	0	0	0	0	109.9	G156 S161 G162 R165 L168 E170 V188 V320	G156-V159 PolarHBondContact O-N 2.93Å; V159-S161 VanDerWaalsContact C-N 3.29Å; V159-S161 PolarHBondContact O-N 3.18Å; V159-G162 PolarHBondContact O-N 3.01Å; V159-G162 VanDerWaalsContact O-N 3.11Å; V159-R165 HydrophobicContact CG1-CG 4.5Å; V159-R165 HydrophobicContact CG2-CG 4.29Å; V159-L168 HydrophobicContact CG2-CD2 3.82Å; V159-E170 WeakPolarHBondContact CG2-OE1 3.42Å; V159-V188 HydrophobicContact CG1-CG1 4.05Å; V159-V188 HydrophobicContact CG1-CG2 4.48Å; V159-V320 HydrophobicContact CG1-CG1 4.21Å; V159-V320 HydrophobicContact CG1-CG2 4.17Å
160	R	98.4	Very high	98.4	Very high	14 Å²	14	12.2 Å²	12.2	5%	0.053	6%	0.06	C	C	.	.	H	α-helix	trans	-70.8	-18.2	-176.6	-68.1	164.1	55.9	96.1	0.7	114.1	E126 G156 G162 W315 P318 T319	E126-R160 PolarHBondContact O-NH2 3.35Å; G156-R160 WeakPolarHBondContact O-CB 3.45Å; G156-R160 VanDerWaalsContact O-CG 3.32Å; G156-R160 WeakPolarHBondContact O-CG 3.4Å; G156-R160 PolarHBondContact O-N 3.4Å; R160-G162 PolarHBondContact O-N 2.76Å; R160-W315 PolarHBondContact O-NE1 3.14Å; R160-W315 VanDerWaalsContact O-NE1 3.07Å; R160-P318 WeakPolarHBondContact O-CA 3.49Å; R160-T319 PolarHBondContact O-N 3.47Å; R160-T319 VanDerWaalsContact O-N 3.08Å
161	S	98.5	Very high	98.4	Very high	5 Å²	5	12 Å²	12	4%	0.035	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-13.3	172	74.4	0	0	0	0	112.7	L138 L157 H158 V159 F163	L138-S161 WeakPolarHBondContact CD2-O 3.39Å; L157-S161 VanDerWaalsContact O-CB 3.26Å; L157-S161 WeakPolarHBondContact O-CB 3.34Å; L157-S161 PolarHBondContact O-N 2.82Å; L157-S161 PolarHBondContact O-OG 3.19Å; H158-S161 PolarHBondContact O-N 2.87Å; H158-S161 PolarHBondContact O-OG 3.4Å; V159-S161 VanDerWaalsContact C-N 3.29Å; V159-S161 PolarHBondContact O-N 3.18Å; S161-F163 PolarHBondContact OG-N 3.1Å
162	G	98.3	Very high	98.3	Very high	6 Å²	6	13.5 Å²	13.5	6%	0.062	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91	13.5	-171.7	0	0	0	0	0	113.6	V159 R160 T319 C321	V159-G162 PolarHBondContact O-N 3.01Å; V159-G162 VanDerWaalsContact O-N 3.11Å; R160-G162 PolarHBondContact O-N 2.76Å; G162-T319 VanDerWaalsContact CA-O 3.29Å; G162-T319 WeakPolarHBondContact CA-O 3.47Å; G162-T319 PolarHBondContact N-O 3.27Å; G162-C321 WeakPolarHBondContact O-CB 3.5Å
163	F	98.6	Very high	98.2	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	133	173.3	-162.5	-83.1	0	0	0	110.4	L137 Q141 L146 L149 H158 S161 R165 K167 L168	L137-F163 HydrophobicContact CB-CE2 4.47Å; Q141-F163 HydrophobicContact CB-CE2 3.77Å; Q141-F163 HydrophobicContact CB-CZ 4.12Å; Q141-F163 HydrophobicContact CG-CE2 4.09Å; Q141-F163 HydrophobicContact CG-CZ 3.97Å; L146-F163 HydrophobicContact CD2-CE2 3.77Å; L146-F163 HydrophobicContact CD2-CZ 3.9Å; L146-F163 HydrophobicContact CG-CZ 4.47Å; L149-F163 HydrophobicContact CB-CE1 3.63Å; L149-F163 HydrophobicContact CB-CE2 4.29Å; L149-F163 HydrophobicContact CB-CZ 3.48Å; L149-F163 VanDerWaalsContact CB-CZ 3.48Å; L149-F163 HydrophobicContact CD2-CD1 4.01Å; L149-F163 HydrophobicContact CD2-CD2 3.96Å; L149-F163 HydrophobicContact CD2-CE1 3.83Å; L149-F163 HydrophobicContact CD2-CE2 3.77Å; L149-F163 HydrophobicContact CD2-CG 4.08Å; L149-F163 HydrophobicContact CD2-CZ 3.71Å; L149-F163 HydrophobicContact CG-CE1 4.38Å; L149-F163 HydrophobicContact CG-CZ 4.27Å; H158-F163 WeakPolarHBondContact O-CB 3.36Å; H158-F163 PolarHBondContact O-N 3.05Å; S161-F163 PolarHBondContact OG-N 3.1Å; F163-R165 PolarHBondContact O-N 3.39Å; F163-K167 HydrophobicContact CE1-CB 4.06Å; F163-L168 HydrophobicContact CD1-CB 4.1Å; F163-L168 HydrophobicContact CE1-CB 4.26Å
164	P	98.4	Very high	98.2	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.013	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.1	-173.8	28	-35.7	0	0	0	112.3	Q141 D166 K167 L168 C321	Q141-P164 HydrophobicContact CG-CG 4.03Å; Q141-P164 VanDerWaalsContact OE1-CG 3.3Å; P164-D166 VanDerWaalsContact C-N 3.31Å; P164-D166 WeakPolarHBondContact CB-OD1 3.29Å; P164-D166 PolarHBondContact O-N 3.06Å; P164-K167 HydrophobicContact CG-CB 4.18Å; P164-K167 HydrophobicContact CG-CG 4.17Å; P164-K167 PolarHBondContact O-N 3.5Å; P164-L168 PolarHBondContact O-N 3.21Å; P164-C321 WeakPolarHBondContact CA-O 3.29Å
165	R	98.3	Very high	98.2	Very high	26 Å²	26	12 Å²	12	10%	0.098	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-66.4	-28.7	-174	-65.3	-177.2	72.6	-138.5	-0.5	113.5	V159 F163 K167 L168 R238 C321 E322	V159-R165 HydrophobicContact CG1-CG 4.5Å; V159-R165 HydrophobicContact CG2-CG 4.29Å; F163-R165 PolarHBondContact O-N 3.39Å; R165-K167 PolarHBondContact O-N 2.87Å; R165-L168 PolarHBondContact O-N 3.46Å; R165-R238 PolarHBondContact O-NH2 2.85Å; R165-C321 WeakPolarHBondContact CG-O 3.28Å; R165-C321 PolarHBondContact N-O 2.82Å; R165-E322 IonicContact CZ-OE2 3.14Å; R165-E322 IonicContact NH1-OE1 2.78Å; R165-E322 PolarHBondContact NH1-OE1 3.47Å; R165-E322 IonicContact NH1-OE2 2.69Å; R165-E322 PolarHBondContact NH1-OE2 3.43Å
166	D	97.9	Very high	98.2	Very high	50 Å²	50	11.8 Å²	11.8	27%	0.267	6%	0.058	S	C	.	.	G	3₁₀ helix	trans	-68.1	-10.9	172.5	70.5	-23.5	0	0	0	113.8	P164 R238 E322 S323 S324	P164-D166 VanDerWaalsContact C-N 3.31Å; P164-D166 WeakPolarHBondContact CB-OD1 3.29Å; P164-D166 PolarHBondContact O-N 3.06Å; D166-R238 PolarHBondContact O-NH2 2.87Å; D166-E322 PolarHBondContact N-O 2.82Å; D166-S323 VanDerWaalsContact CG-CA 3.48Å; D166-S323 WeakPolarHBondContact OD1-CA 3.3Å; D166-S323 PolarHBondContact OD2-OG 3.07Å; D166-S324 VanDerWaalsContact CG-N 3.27Å; D166-S324 WeakPolarHBondContact OD1-CB 3.38Å; D166-S324 PolarHBondContact OD1-N 3.32Å; D166-S324 PolarHBondContact OD1-OG 2.98Å; D166-S324 PolarHBondContact OD2-N 3.45Å; D166-S324 PolarHBondContact OD2-OG 3.37Å
167	K	98.6	Very high	98.2	Very high	74 Å²	74	11.8 Å²	11.8	32%	0.322	6%	0.057	S	C	.	.	G	3₁₀ helix	trans	-113.3	11.1	172.6	-55.3	-59.1	-178.2	177.1	0	113.9	Y148 L149 F163 P164 R165 S324	Y148-K167 HydrophobicContact CD2-CB 4.49Å; L149-K167 PolarHBondContact N-O 3.43Å; F163-K167 HydrophobicContact CE1-CB 4.06Å; P164-K167 HydrophobicContact CG-CB 4.18Å; P164-K167 HydrophobicContact CG-CG 4.17Å; P164-K167 PolarHBondContact O-N 3.5Å; R165-K167 PolarHBondContact O-N 2.87Å; K167-S324 WeakPolarHBondContact CE-OG 3.37Å
168	L	98.8	Very high	98.1	Very high	3 Å²	3	11.8 Å²	11.8	2%	0.016	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.5	-179.3	179	62.6	0	0	0	111	Y148 L149 H158 V159 F163 P164 R165 E170 R238	Y148-L168 PolarHBondContact OH-O 3.4Å; L149-L168 HydrophobicContact CB-CD1 4.13Å; L149-L168 HydrophobicContact CD2-CD1 3.86Å; L149-L168 HydrophobicContact CG-CD1 3.73Å; L149-L168 CarbonylContact O-C 3.52Å; L149-L168 WeakPolarHBondContact O-CA 3.44Å; H158-L168 HydrophobicContact CB-CD1 4.36Å; H158-L168 HydrophobicContact CB-CD2 3.93Å; V159-L168 HydrophobicContact CG2-CD2 3.82Å; F163-L168 HydrophobicContact CD1-CB 4.1Å; F163-L168 HydrophobicContact CE1-CB 4.26Å; P164-L168 PolarHBondContact O-N 3.21Å; R165-L168 PolarHBondContact O-N 3.46Å; L168-E170 HydrophobicContact CD1-CG 4.39Å; L168-E170 HydrophobicContact CD2-CG 3.7Å; L168-E170 HydrophobicContact CG-CG 3.79Å; L168-R238 PolarHBondContact O-NH1 3.44Å; L168-R238 PolarHBondContact O-NH2 3.14Å
169	S	98.8	Very high	98	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	119.7	161.8	-75.6	0	0	0	0	110.5	Y148 L149 S151 D235	Y148-S169 WeakPolarHBondContact CE1-OG 3.49Å; Y148-S169 PolarHBondContact OH-OG 3.48Å; L149-S169 PolarHBondContact O-N 3.11Å; S151-S169 PolarHBondContact N-O 3.19Å; S169-D235 WeakPolarHBondContact CA-OD1 3.24Å; S169-D235 WeakPolarHBondContact CB-O 3.13Å; S169-D235 PolarHBondContact OG-O 3.34Å
170	E	98.6	Very high	98	Very high	19 Å²	19	14.2 Å²	14.2	9%	0.089	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	83.2	178.1	-59.1	-175.3	107.1	0	0	109.2	V159 L168 H172 G173 N174 D235	V159-E170 WeakPolarHBondContact CG2-OE1 3.42Å; L168-E170 HydrophobicContact CD1-CG 4.39Å; L168-E170 HydrophobicContact CD2-CG 3.7Å; L168-E170 HydrophobicContact CG-CG 3.79Å; E170-H172 VanDerWaalsContact C-N 3.27Å; E170-H172 PolarHBondContact O-N 3.13Å; E170-G173 PolarHBondContact O-N 2.85Å; E170-N174 WeakPolarHBondContact OE1-CB 3.27Å; E170-N174 PolarHBondContact OE1-ND2 3.33Å; E170-D235 PolarHBondContact N-OD1 3.26Å; E170-D235 VanDerWaalsContact N-OD1 3.13Å
171	L	98.5	Very high	97.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.5	-165.1	-64.2	-176.3	0	0	0	114.1	I150 S151 L225 L231 P232 D235 L236 A239 L264	I150-L171 HydrophobicContact CG2-CD1 3.49Å; I150-L171 VanDerWaalsContact CG2-CD1 3.49Å; I150-L171 HydrophobicContact CG2-CG 3.94Å; S151-L171 PolarHBondContact O-N 3.23Å; L171-L225 WeakPolarHBondContact O-CD1 3.49Å; L171-L231 HydrophobicContact CB-CD2 4.05Å; L171-L231 HydrophobicContact CD1-CD2 4.41Å; L171-L231 HydrophobicContact CD2-CD2 4.43Å; L171-P232 VanDerWaalsContact O-CD 3.3Å; L171-P232 WeakPolarHBondContact O-CD 3.27Å; L171-D235 HydrophobicContact CD2-CB 4.34Å; L171-L236 HydrophobicContact CD2-CB 4.48Å; L171-A239 HydrophobicContact CD2-CB 3.99Å; L171-L264 HydrophobicContact CD1-CD1 3.56Å
172	H	97.7	Very high	97.6	Very high	33 Å²	33	23.7 Å²	23.7	15%	0.153	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	10.6	-178	-59.7	161.9	0	0	0	112.7	Q152 V154 E170 S261	Q152-H172 PolarHBondContact O-ND1 3.11Å; V154-H172 HydrophobicContact CG1-CB 3.94Å; V154-H172 VanDerWaalsContact CG1-O 3.3Å; V154-H172 WeakPolarHBondContact CG1-O 3.36Å; E170-H172 VanDerWaalsContact C-N 3.27Å; E170-H172 PolarHBondContact O-N 3.13Å; H172-S261 PolarHBondContact NE2-OG 2.93Å; H172-S261 VanDerWaalsContact NE2-OG 3.08Å
173	G	97.1	Very high	97.4	Very high	4 Å²	4	26.2 Å²	26.2	4%	0.041	13%	0.127	C	C	.	.			trans	88.7	-173.3	-176.1	0	0	0	0	0	113.6	E170 T223	E170-G173 PolarHBondContact O-N 2.85Å; G173-T223 WeakPolarHBondContact CA-O 3.44Å
174	N	97.7	Very high	97.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.143	C	C	.	.			trans	-145.4	131.3	178.8	176.7	-29.1	0	0	0	109.7	G156 E170 F176 V177 T223	G156-N174 VanDerWaalsContact CA-ND2 3.33Å; G156-N174 WeakPolarHBondContact CA-ND2 3.44Å; G156-N174 WeakPolarHBondContact CA-OD1 3.49Å; E170-N174 WeakPolarHBondContact OE1-CB 3.27Å; E170-N174 PolarHBondContact OE1-ND2 3.33Å; N174-F176 PolarHBondContact O-N 3.25Å; N174-F176 WeakPolarHBondContact OD1-CB 3.47Å; N174-F176 PolarHBondContact OD1-N 3.23Å; N174-V177 HydrophobicContact CB-CB 4.01Å; N174-V177 HydrophobicContact CB-CG2 3.69Å; N174-V177 PolarHBondContact O-N 3.39Å; N174-T223 PolarHBondContact N-OG1 3.09Å; N174-T223 PolarHBondContact O-OG1 3.08Å; N174-T223 VanDerWaalsContact O-OG1 3.12Å
175	M	96.1	Very high	96.9	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-19	-175.6	-73.2	-63.8	-67.8	0	0	113.6	F125 V154 V192 I193 M196 I224	F125-M175 HydrophobicContact CD2-CB 4.36Å; F125-M175 HydrophobicContact CD2-CE 4.12Å; F125-M175 HydrophobicContact CD2-CG 4Å; F125-M175 HydrophobicContact CE2-CE 4.01Å; F125-M175 HydrophobicContact CE2-CG 3.84Å; F125-M175 HydrophobicContact CE2-SD 4.42Å; F125-M175 HydrophobicContact CZ-CG 4.39Å; V154-M175 HydrophobicContact CB-CG 4.24Å; V154-M175 HydrophobicContact CG2-CG 4.17Å; V154-M175 WeakPolarHBondContact O-CB 3.27Å; V154-M175 WeakPolarHBondContact O-CG 3.34Å; V154-M175 PolarHBondContact O-N 2.84Å; M175-V192 HydrophobicContact CB-CB 4.49Å; M175-V192 HydrophobicContact CB-CG1 4.06Å; M175-V192 HydrophobicContact CE-CB 4.34Å; M175-V192 HydrophobicContact CE-CG1 4.47Å; M175-V192 CarbonylContact O-C 3.54Å; M175-V192 VanDerWaalsContact O-CA 3.32Å; M175-V192 WeakPolarHBondContact O-CA 3.39Å; M175-I193 WeakPolarHBondContact O-CG1 3.33Å; M175-I193 PolarHBondContact O-N 3.13Å; M175-M196 HydrophobicContact CE-CE 3.84Å; M175-M196 HydrophobicContact SD-CE 4.37Å; M175-I224 HydrophobicContact CG-CD1 4.05Å; M175-I224 HydrophobicContact SD-CD1 3.67Å; M175-I224 HydrophobicContact SD-CG1 3.68Å
176	F	97.2	Very high	96.9	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-2.9	179.3	-63	-90.8	0	0	0	113.4	F125 E126 D155 N174 R189 E190 V192	F125-F176 HydrophobicContact CB-CE2 3.97Å; F125-F176 HydrophobicContact CB-CZ 3.89Å; F125-F176 WeakPolarHBondContact O-CZ 3.48Å; E126-F176 HydrophobicContact CG-CE1 4.17Å; E126-F176 HydrophobicContact CG-CZ 4.45Å; D155-F176 WeakPolarHBondContact O-CE2 3.34Å; N174-F176 PolarHBondContact O-N 3.25Å; N174-F176 WeakPolarHBondContact OD1-CB 3.47Å; N174-F176 PolarHBondContact OD1-N 3.23Å; F176-R189 WeakPolarHBondContact CD1-O 3.46Å; F176-R189 PolarHBondContact O-N 3.5Å; F176-E190 WeakPolarHBondContact CE1-O 3.48Å; F176-V192 HydrophobicContact CE1-CG1 4.02Å; F176-V192 HydrophobicContact CE2-CG1 4.18Å; F176-V192 HydrophobicContact CZ-CG1 3.81Å
177	V	97.9	Very high	96.8	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.6	-173.4	-176.2	0	0	0	0	111.1	N174 Q186 Y187 V188 T223	N174-V177 HydrophobicContact CB-CB 4.01Å; N174-V177 HydrophobicContact CB-CG2 3.69Å; N174-V177 PolarHBondContact O-N 3.39Å; V177-Q186 HydrophobicContact CG1-CB 4Å; V177-Q186 HydrophobicContact CG1-CG 4.19Å; V177-Y187 WeakPolarHBondContact CA-O 3.34Å; V177-V188 HydrophobicContact CG2-CG2 4.18Å; V177-T223 HydrophobicContact CB-CG2 4.3Å; V177-T223 HydrophobicContact CG1-CG2 3.89Å; V177-T223 WeakPolarHBondContact O-CG2 3.12Å; V177-T223 PolarHBondContact O-N 3.1Å; V177-T223 PolarHBondContact O-OG1 3.08Å
178	E	97.7	Very high	96.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.3	166.8	62.9	-175.5	171.5	0	0	110.9	Q186 Y187 R189 I193 T201 R203 L220 I221	E178-Q186 CarbonylContact O-C 3.57Å; E178-Q186 WeakPolarHBondContact O-CA 3.3Å; E178-Y187 PolarHBondContact N-O 3.42Å; E178-Y187 VanDerWaalsContact N-O 3.16Å; E178-Y187 PolarHBondContact O-N 2.64Å; E178-R189 IonicContact OE1-CZ 3.28Å; E178-R189 IonicContact OE1-NE 3.2Å; E178-R189 PolarHBondContact OE1-NE 2.86Å; E178-R189 IonicContact OE1-NH2 2.84Å; E178-R189 PolarHBondContact OE1-NH2 2.74Å; E178-I193 HydrophobicContact CB-CD1 3.88Å; E178-I193 HydrophobicContact CB-CG1 4.26Å; E178-I193 HydrophobicContact CG-CD1 3.94Å; E178-T201 HydrophobicContact CB-CG2 4.02Å; E178-T201 VanDerWaalsContact OE2-CB 3.29Å; E178-T201 WeakPolarHBondContact OE2-CB 3.28Å; E178-T201 WeakPolarHBondContact OE2-CG2 3.42Å; E178-T201 PolarHBondContact OE2-OG1 3.41Å; E178-R203 VanDerWaalsContact CD-NE 3.28Å; E178-R203 IonicContact OE1-CZ 3.63Å; E178-R203 IonicContact OE1-NE 2.82Å; E178-R203 PolarHBondContact OE1-NE 3.48Å; E178-R203 IonicContact OE1-NH2 3.6Å; E178-R203 IonicContact OE2-CZ 3.21Å; E178-R203 IonicContact OE2-NE 2.93Å; E178-R203 PolarHBondContact OE2-NE 3.2Å; E178-R203 IonicContact OE2-NH2 2.7Å; E178-R203 PolarHBondContact OE2-NH2 3.18Å; E178-L220 HydrophobicContact CB-CB 4.32Å; E178-L220 VanDerWaalsContact CD-CD1 3.42Å; E178-L220 HydrophobicContact CG-CB 4.15Å; E178-L220 HydrophobicContact CG-CD1 3.99Å; E178-L220 VanDerWaalsContact OE1-CD1 3.23Å; E178-L220 WeakPolarHBondContact OE1-CD1 3.23Å; E178-I221 CarbonylContact C-O 3.49Å; E178-I221 WeakPolarHBondContact CA-O 3.32Å; E178-I221 VanDerWaalsContact CB-O 3.3Å; E178-I221 WeakPolarHBondContact CB-O 3.47Å
179	E	97.4	Very high	96.7	Very high	56 Å²	56	35.3 Å²	35.3	26%	0.262	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	142.9	-175.9	-172	170.3	120.4	0	0	111.4	E181 Q186 L220 I221 T223	E179-E181 PolarHBondContact O-N 2.77Å; E179-Q186 HydrophobicContact CB-CG 4.07Å; E179-Q186 HydrophobicContact CG-CG 3.9Å; E179-Q186 VanDerWaalsContact OE2-CG 3.27Å; E179-Q186 WeakPolarHBondContact OE2-CG 3.33Å; E179-Q186 PolarHBondContact OE2-NE2 3.11Å; E179-L220 CarbonylContact O-C 3.52Å; E179-L220 WeakPolarHBondContact O-CA 3.32Å; E179-I221 PolarHBondContact N-O 3.04Å; E179-I221 WeakPolarHBondContact O-CG1 3.21Å; E179-I221 PolarHBondContact O-N 3.43Å; E179-T223 HydrophobicContact CB-CG2 4.08Å
180	C	97.1	Very high	96.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.9	172.8	179.9	0	0	0	0	112	K182 C183 G184 R185 C205 L220	C180-K182 PolarHBondContact O-N 3.31Å; C180-K182 PolarHBondContact SG-N 2.97Å; C180-C183 PolarHBondContact O-N 2.95Å; C180-G184 WeakPolarHBondContact O-CA 3.42Å; C180-G184 PolarHBondContact O-N 3.44Å; C180-R185 PolarHBondContact N-O 3.45Å; C180-C205 HydrophobicContact CB-CB 3.7Å; C180-C205 WeakPolarHBondContact SG-CB 3.36Å; C180-L220 HydrophobicContact CB-CD2 3.65Å
181	E	95.3	Very high	96.2	Very high	100 Å²	100	49.6 Å²	49.6	47%	0.467	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.8	177.5	75.1	-170.7	170.6	0	0	114.3	E179 K219	E179-E181 PolarHBondContact O-N 2.77Å; E181-K219 PolarHBondContact N-O 2.83Å; E181-K219 VanDerWaalsContact OE1-CB 3.3Å; E181-K219 WeakPolarHBondContact OE1-CB 3.44Å; E181-K219 WeakPolarHBondContact OE1-CG 3.24Å; E181-K219 PolarHBondContact OE1-N 2.71Å; E181-K219 VanDerWaalsContact OE1-N 3.09Å
182	K	93.6	Very high	96	Very high	119 Å²	119	51 Å²	51	52%	0.517	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-26.9	-176.3	-68.8	-170.5	-174.2	161.7	0	114.7	C180 R217 G218	C180-K182 PolarHBondContact O-N 3.31Å; C180-K182 PolarHBondContact SG-N 2.97Å; K182-R217 PolarHBondContact NZ-O 3.43Å; K182-R217 VanDerWaalsContact NZ-O 3.16Å; K182-G218 VanDerWaalsContact CD-CA 3.42Å
183	C	93.4	Very high	95.7	Very high	58 Å²	58	50.3 Å²	50.3	39%	0.392	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.6	-0.5	-171.5	68.9	0	0	0	0	114.2	C180 R185 C216	C180-C183 PolarHBondContact O-N 2.95Å; C183-R185 PolarHBondContact O-N 3.35Å; C183-R185 VanDerWaalsContact O-N 3.13Å; C183-C216 VanDerWaalsContact SG-SG 3.61Å
184	G	93.2	Very high	94.9	Very high	32 Å²	32	52.7 Å²	52.7	33%	0.33	27%	0.266	S	S	.	.			trans	68	6.7	178.7	0	0	0	0	0	114.7	C180 Q186	C180-G184 WeakPolarHBondContact O-CA 3.42Å; C180-G184 PolarHBondContact O-N 3.44Å; G184-Q186 PolarHBondContact O-N 2.79Å
185	R	94.8	Very high	94.5	Very high	143 Å²	143	54.6 Å²	54.6	54%	0.54	28%	0.277	S	S	.	.			trans	-66.7	123.2	175.6	-176.3	68	174.4	-179.4	0.7	109.2	C180 C183 Y187 V207	C180-R185 PolarHBondContact N-O 3.45Å; C183-R185 PolarHBondContact O-N 3.35Å; C183-R185 VanDerWaalsContact O-N 3.13Å; R185-Y187 HydrophobicContact CB-CE2 4.19Å; R185-Y187 HydrophobicContact CG-CD2 4.45Å; R185-Y187 HydrophobicContact CG-CE2 3.82Å; R185-V207 HydrophobicContact CB-CG2 3.81Å; R185-V207 HydrophobicContact CG-CG2 3.59Å
186	Q	96.6	Very high	94.2	Very high	25 Å²	25	55.5 Å²	55.5	12%	0.117	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	147.2	172.9	-69	177.8	-25.3	0	0	111.1	V177 E178 E179 G184	V177-Q186 HydrophobicContact CG1-CB 4Å; V177-Q186 HydrophobicContact CG1-CG 4.19Å; E178-Q186 CarbonylContact O-C 3.57Å; E178-Q186 WeakPolarHBondContact O-CA 3.3Å; E179-Q186 HydrophobicContact CB-CG 4.07Å; E179-Q186 HydrophobicContact CG-CG 3.9Å; E179-Q186 VanDerWaalsContact OE2-CG 3.27Å; E179-Q186 WeakPolarHBondContact OE2-CG 3.33Å; E179-Q186 PolarHBondContact OE2-NE2 3.11Å; G184-Q186 PolarHBondContact O-N 2.79Å
187	Y	96.8	Very high	93.9	Very high	31 Å²	31	56 Å²	56	12%	0.122	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	120.8	175.4	-61.1	-100.1	0	0	0	108.4	V177 E178 R185 C205 E206 L220	V177-Y187 WeakPolarHBondContact CA-O 3.34Å; E178-Y187 PolarHBondContact N-O 3.42Å; E178-Y187 VanDerWaalsContact N-O 3.16Å; E178-Y187 PolarHBondContact O-N 2.64Å; R185-Y187 HydrophobicContact CB-CE2 4.19Å; R185-Y187 HydrophobicContact CG-CD2 4.45Å; R185-Y187 HydrophobicContact CG-CE2 3.82Å; Y187-C205 PolarHBondContact OH-SG 3.13Å; Y187-E206 PolarHBondContact OH-N 3.03Å; Y187-E206 VanDerWaalsContact OH-N 3.1Å; Y187-L220 HydrophobicContact CD2-CD1 4.04Å; Y187-L220 HydrophobicContact CD2-CD2 4.01Å; Y187-L220 HydrophobicContact CE2-CD1 4.18Å; Y187-L220 HydrophobicContact CE2-CD2 3.71Å
188	V	97.7	Very high	93.8	Very high	39 Å²	39	58.9 Å²	58.9	24%	0.236	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127	171	-169.9	0	0	0	0	108	V159 V177 V320	V159-V188 HydrophobicContact CG1-CG1 4.05Å; V159-V188 HydrophobicContact CG1-CG2 4.48Å; V177-V188 HydrophobicContact CG2-CG2 4.18Å; V188-V320 HydrophobicContact CB-CG1 4.5Å; V188-V320 HydrophobicContact CB-CG2 4.29Å; V188-V320 HydrophobicContact CG1-CG2 3.83Å; V188-V320 HydrophobicContact CG2-CG1 4.16Å
189	R	96.6	Very high	93.6	Very high	76 Å²	76	64.3 Å²	64.3	29%	0.287	33%	0.326	S	S	.	.			trans	-107.3	159.6	-178.9	-57.2	-55.6	-172.8	179.4	-0	110.8	F176 E178 K191 I193	F176-R189 WeakPolarHBondContact CD1-O 3.46Å; F176-R189 PolarHBondContact O-N 3.5Å; E178-R189 IonicContact OE1-CZ 3.28Å; E178-R189 IonicContact OE1-NE 3.2Å; E178-R189 PolarHBondContact OE1-NE 2.86Å; E178-R189 IonicContact OE1-NH2 2.84Å; E178-R189 PolarHBondContact OE1-NH2 2.74Å; R189-K191 WeakPolarHBondContact CB-O 3.19Å; R189-I193 HydrophobicContact CB-CD1 4.16Å; R189-I193 HydrophobicContact CG-CD1 3.52Å
190	E	93.8	Very high	93.6	Very high	171 Å²	171	65.2 Å²	65.2	80%	0.799	34%	0.337	S	S	*	.	S	Bend	trans	-75.3	-29.2	175.9	-65.6	178.4	177	0	0	112.7	F176	F176-E190 WeakPolarHBondContact CE1-O 3.48Å
191	K	94.3	Very high	93.5	Very high	149 Å²	149	66.1 Å²	66.1	65%	0.648	34%	0.343	S	S	*	.	S	Bend	trans	-114.1	158.1	-179.7	-61.7	-175.1	-179.9	-177.8	0	110.5	R189	R189-K191 WeakPolarHBondContact CB-O 3.19Å
192	V	94.2	Very high	93.5	Very high	28 Å²	28	64.5 Å²	64.5	17%	0.17	35%	0.353	C	S	.	.			trans	-61.5	145.8	175.7	-58.5	0	0	0	0	111.2	F125 E126 M175 F176 G194	F125-V192 HydrophobicContact CB-CG1 3.79Å; F125-V192 HydrophobicContact CD2-CG1 4.17Å; F125-V192 HydrophobicContact CG-CG1 4.45Å; E126-V192 WeakPolarHBondContact OE1-CG1 3.41Å; E126-V192 VanDerWaalsContact OE1-CG2 3.31Å; E126-V192 WeakPolarHBondContact OE1-CG2 3.48Å; E126-V192 PolarHBondContact OE1-N 3.28Å; M175-V192 HydrophobicContact CB-CB 4.49Å; M175-V192 HydrophobicContact CB-CG1 4.06Å; M175-V192 HydrophobicContact CE-CB 4.34Å; M175-V192 HydrophobicContact CE-CG1 4.47Å; M175-V192 CarbonylContact O-C 3.54Å; M175-V192 VanDerWaalsContact O-CA 3.32Å; M175-V192 WeakPolarHBondContact O-CA 3.39Å; F176-V192 HydrophobicContact CE1-CG1 4.02Å; F176-V192 HydrophobicContact CE2-CG1 4.18Å; F176-V192 HydrophobicContact CZ-CG1 3.81Å; V192-G194 VanDerWaalsContact C-N 3.25Å; V192-G194 PolarHBondContact O-N 3.23Å
193	I	92.4	Very high	93.7	Very high	19 Å²	19	63.3 Å²	63.3	10%	0.097	35%	0.345	C	S	.	.			trans	-67.6	-29.2	178.9	-60.2	-60.6	0	0	0	111.4	M175 E178 R189 V195 T201 R203	M175-I193 WeakPolarHBondContact O-CG1 3.33Å; M175-I193 PolarHBondContact O-N 3.13Å; E178-I193 HydrophobicContact CB-CD1 3.88Å; E178-I193 HydrophobicContact CB-CG1 4.26Å; E178-I193 HydrophobicContact CG-CD1 3.94Å; R189-I193 HydrophobicContact CB-CD1 4.16Å; R189-I193 HydrophobicContact CG-CD1 3.52Å; I193-V195 VanDerWaalsContact C-N 3.29Å; I193-V195 HydrophobicContact CG2-CB 4.37Å; I193-V195 PolarHBondContact O-N 3.26Å; I193-T201 HydrophobicContact CG2-CG2 3.29Å; I193-R203 VanDerWaalsContact CD1-NH2 3.31Å
194	G	79.9	Confident	93.8	Very high	55 Å²	55	67 Å²	67	57%	0.567	35%	0.352	S	S	*	.			trans	73.9	14.5	175.6	0	0	0	0	0	114.9	V192	V192-G194 VanDerWaalsContact C-N 3.25Å; V192-G194 PolarHBondContact O-N 3.23Å
195	V	88.4	Confident	94	Very high	41 Å²	41	65.6 Å²	65.6	25%	0.248	34%	0.337	C	S	.	.			trans	-136.1	141.1	-178.5	179.7	0	0	0	0	109.3	I193 K199 S222	I193-V195 VanDerWaalsContact C-N 3.29Å; I193-V195 HydrophobicContact CG2-CB 4.37Å; I193-V195 PolarHBondContact O-N 3.26Å; V195-K199 HydrophobicContact CG1-CB 3.42Å; V195-K199 VanDerWaalsContact CG1-CB 3.42Å; V195-S222 WeakPolarHBondContact O-CB 3.3Å; V195-S222 PolarHBondContact O-OG 2.99Å
196	M	89.4	Confident	93.9	Very high	21 Å²	21	65.3 Å²	65.3	10%	0.103	34%	0.341	C	S	.	.			trans	-131.4	165.5	-173.9	-60.6	164.8	-156.6	0	0	111.8	Y44 M175 K199 I224	Y44-M196 VanDerWaalsContact CA-CE 3.42Å; M175-M196 HydrophobicContact CE-CE 3.84Å; M175-M196 HydrophobicContact SD-CE 4.37Å; M196-K199 VanDerWaalsContact O-CD 3.32Å; M196-K199 WeakPolarHBondContact O-CD 3.2Å; M196-K199 WeakPolarHBondContact O-CG 3.38Å; M196-I224 HydrophobicContact CB-CB 4.26Å; M196-I224 HydrophobicContact CB-CG2 4Å; M196-I224 HydrophobicContact CG-CB 4.2Å; M196-I224 HydrophobicContact CG-CG1 4.45Å; M196-I224 HydrophobicContact CG-CG2 3.91Å
197	G	92.4	Very high	93.6	Very high	13 Å²	13	66.6 Å²	66.6	13%	0.134	35%	0.351	C	S	.	.	S	Bend	trans	69.2	44	179.5	0	0	0	0	0	112.6	K199 I224	G197-K199 PolarHBondContact O-N 3.18Å; G197-I224 WeakPolarHBondContact CA-O 2.84Å; G197-I224 PolarHBondContact N-O 3.47Å
198	L	94	Very high	93.2	Very high	61 Å²	61	69.2 Å²	69.2	32%	0.319	37%	0.37	S	S	.	.	S	Bend	trans	54.7	26.2	177.6	-54.1	-179.8	0	0	0	114.9	S222 I224 L225 D229	L198-S222 WeakPolarHBondContact CD2-O 3.24Å; L198-S222 PolarHBondContact N-OG 2.96Å; L198-I224 PolarHBondContact N-O 2.96Å; L198-I224 VanDerWaalsContact N-O 3.1Å; L198-L225 HydrophobicContact CD1-CD2 4.27Å; L198-L225 HydrophobicContact CD2-CD2 3.97Å; L198-L225 HydrophobicContact CG-CD2 4.31Å; L198-D229 HydrophobicContact CD1-CB 4.09Å
199	K	94.7	Very high	92.1	Very high	113 Å²	113	73.2 Å²	73.2	49%	0.491	38%	0.381	S	S	.	.			trans	-81.8	152.8	-176.2	-72.4	170.9	-166.5	164.4	0	112.1	V195 M196 G197 I221 S222	V195-K199 HydrophobicContact CG1-CB 3.42Å; V195-K199 VanDerWaalsContact CG1-CB 3.42Å; M196-K199 VanDerWaalsContact O-CD 3.32Å; M196-K199 WeakPolarHBondContact O-CD 3.2Å; M196-K199 WeakPolarHBondContact O-CG 3.38Å; G197-K199 PolarHBondContact O-N 3.18Å; K199-I221 WeakPolarHBondContact O-CA 3.34Å; K199-S222 PolarHBondContact N-OG 2.76Å; K199-S222 PolarHBondContact O-N 3.48Å
200	P	96.4	Very high	90.6	Very high	75 Å²	75	75.4 Å²	75.4	49%	0.487	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	138.2	176.3	-24.7	34.5	0	0	0	113.4	L220	P200-L220 CarbonylContact C-O 3.05Å; P200-L220 WeakPolarHBondContact CA-O 3.34Å
201	T	95.9	Very high	89.3	Confident	20 Å²	20	78.3 Å²	78.3	12%	0.123	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-4.6	-177.9	71.8	0	0	0	0	113.6	E178 I193 R203 L220	E178-T201 HydrophobicContact CB-CG2 4.02Å; E178-T201 VanDerWaalsContact OE2-CB 3.29Å; E178-T201 WeakPolarHBondContact OE2-CB 3.28Å; E178-T201 WeakPolarHBondContact OE2-CG2 3.42Å; E178-T201 PolarHBondContact OE2-OG1 3.41Å; I193-T201 HydrophobicContact CG2-CG2 3.29Å; T201-R203 VanDerWaalsContact C-N 3.28Å; T201-R203 PolarHBondContact O-N 3.15Å; T201-R203 PolarHBondContact OG1-N 3.2Å; T201-L220 PolarHBondContact N-O 2.94Å; T201-L220 PolarHBondContact OG1-O 3.13Å
202	G	95.9	Very high	88.1	Confident	66 Å²	66	74 Å²	74	68%	0.68	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	83.6	-5.4	-173.1	0	0	0	0	0	114.6
203	R	96.8	Very high	87	Confident	94 Å²	94	79.4 Å²	79.4	36%	0.355	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	165.4	176.8	-69.5	179.7	-70.3	-84	-3.2	112.4	E178 I193 T201 L220	E178-R203 VanDerWaalsContact CD-NE 3.28Å; E178-R203 IonicContact OE1-CZ 3.63Å; E178-R203 IonicContact OE1-NE 2.82Å; E178-R203 PolarHBondContact OE1-NE 3.48Å; E178-R203 IonicContact OE1-NH2 3.6Å; E178-R203 IonicContact OE2-CZ 3.21Å; E178-R203 IonicContact OE2-NE 2.93Å; E178-R203 PolarHBondContact OE2-NE 3.2Å; E178-R203 IonicContact OE2-NH2 2.7Å; E178-R203 PolarHBondContact OE2-NH2 3.18Å; I193-R203 VanDerWaalsContact CD1-NH2 3.31Å; T201-R203 VanDerWaalsContact C-N 3.28Å; T201-R203 PolarHBondContact O-N 3.15Å; T201-R203 PolarHBondContact OG1-N 3.2Å; R203-L220 HydrophobicContact CB-CB 4.3Å; R203-L220 HydrophobicContact CB-CD1 3.78Å; R203-L220 HydrophobicContact CB-CG 4.25Å; R203-L220 PolarHBondContact O-N 2.79Å
204	Y	96.4	Very high	86.5	Confident	136 Å²	136	88.2 Å²	88.2	53%	0.533	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.7	-179.6	-65.6	-88.8	0	0	0	111.5	E206 G218 K219	Y204-E206 PolarHBondContact O-N 2.9Å; Y204-G218 CarbonylContact C-O 3.57Å; Y204-G218 WeakPolarHBondContact CA-O 3.41Å; Y204-K219 HydrophobicContact CD1-CG 4.39Å; Y204-K219 HydrophobicContact CE1-CG 3.91Å
205	C	96.4	Very high	86.8	Confident	2 Å²	2	87.7 Å²	87.7	1%	0.014	46%	0.458	C	S	.	.			trans	-69.3	127.8	-180	-177.3	0	0	0	0	112.5	C180 Y187 C216 R217 G218 L220	C180-C205 HydrophobicContact CB-CB 3.7Å; C180-C205 WeakPolarHBondContact SG-CB 3.36Å; Y187-C205 PolarHBondContact OH-SG 3.13Å; C205-C216 HydrophobicContact CB-CB 4.09Å; C205-R217 PolarHBondContact O-N 3.42Å; C205-G218 PolarHBondContact N-O 3.33Å; C205-L220 HydrophobicContact CB-CD2 3.84Å
206	E	92.3	Very high	87	Confident	136 Å²	136	86.1 Å²	86.1	64%	0.636	45%	0.449	S	S	*	.			trans	-92.4	-9.3	-176.5	-65.8	170.1	-166.1	0	0	113	Y187 Y204 V208	Y187-E206 PolarHBondContact OH-N 3.03Å; Y187-E206 VanDerWaalsContact OH-N 3.1Å; Y204-E206 PolarHBondContact O-N 2.9Å; E206-V208 PolarHBondContact O-N 3.29Å; E206-V208 VanDerWaalsContact O-N 3.13Å
207	V	91.6	Very high	87.1	Confident	52 Å²	52	93.8 Å²	93.8	32%	0.315	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-53.2	122.2	179.1	173.2	0	0	0	0	110.5	R185 A215 C216	R185-V207 HydrophobicContact CB-CG2 3.81Å; R185-V207 HydrophobicContact CG-CG2 3.59Å; V207-A215 CarbonylContact O-C 3.6Å; V207-A215 WeakPolarHBondContact O-CA 3.45Å; V207-C216 HydrophobicContact CB-CB 4.35Å; V207-C216 WeakPolarHBondContact O-CB 3.48Å; V207-C216 PolarHBondContact O-N 2.81Å
208	V	87.3	Confident	87.3	Confident	87 Å²	87	93.2 Å²	93.2	53%	0.527	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-82.7	121.5	174.3	-170.8	0	0	0	0	108.9	E206 G212	E206-V208 PolarHBondContact O-N 3.29Å; E206-V208 VanDerWaalsContact O-N 3.13Å; V208-G212 VanDerWaalsContact CG1-CA 3.46Å
209	R	74.8	Confident	87.5	Confident	123 Å²	123	94.8 Å²	94.8	46%	0.464	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-76.6	162.1	-179.2	-67	-175.4	175.8	-176.6	-4.7	111.2	R211 G212 R214 C216	R209-R211 PolarHBondContact O-N 3.07Å; R209-G212 PolarHBondContact O-N 3.35Å; R209-R214 PolarHBondContact N-O 3.17Å; R209-C216 HydrophobicContact CG-CB 4.48Å; R209-C216 PolarHBondContact NH2-SG 3.13Å
210	S	65.3	Low	87.6	Confident	122 Å²	122	89.4 Å²	89.4	85%	0.853	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	130.1	-174	-32.1	0	0	0	0	112.6
211	R	66.9	Low	87.7	Confident	232 Å²	232	87.4 Å²	87.4	88%	0.875	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	-0.8	-168.3	-53.9	-173.7	-174.7	178.4	2.2	117	R209 L213	R209-R211 PolarHBondContact O-N 3.07Å; R211-L213 HydrophobicContact CB-CD1 4.15Å; R211-L213 HydrophobicContact CB-CG 4.38Å; R211-L213 PolarHBondContact O-N 3.39Å; R211-L213 VanDerWaalsContact O-N 3.1Å
212	G	67.8	Low	87.7	Confident	57 Å²	57	86.5 Å²	86.5	59%	0.588	43%	0.431	S	S	*	.	S	Bend	trans	76.2	-3.4	170.8	0	0	0	0	0	115.1	V208 R209	V208-G212 VanDerWaalsContact CG1-CA 3.46Å; R209-G212 PolarHBondContact O-N 3.35Å
213	L	72.8	Confident	87.8	Confident	143 Å²	143	84.3 Å²	84.3	75%	0.749	40%	0.404	S	S	*	.	S	Bend	trans	-83.3	-26.1	-166.3	-68.8	166.7	0	0	0	114	R211	R211-L213 HydrophobicContact CB-CD1 4.15Å; R211-L213 HydrophobicContact CB-CG 4.38Å; R211-L213 PolarHBondContact O-N 3.39Å; R211-L213 VanDerWaalsContact O-N 3.1Å
214	R	80.4	Confident	87.7	Confident	204 Å²	204	80 Å²	80	77%	0.77	39%	0.388	S	S	*	.			trans	-147.3	134.9	-177.5	-73.3	-171	-78.7	168.2	-4.6	112.8	R209	R209-R214 PolarHBondContact N-O 3.17Å
215	A	86.1	Confident	87.6	Confident	43 Å²	43	74.6 Å²	74.6	36%	0.355	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-67.3	151.4	167.3	0	0	0	0	0	111.3	V207 R217	V207-A215 CarbonylContact O-C 3.6Å; V207-A215 WeakPolarHBondContact O-CA 3.45Å; A215-R217 HydrophobicContact CB-CG 3.99Å; A215-R217 PolarHBondContact O-N 2.97Å
216	C	93.4	Very high	87.5	Confident	8 Å²	8	75.7 Å²	75.7	5%	0.054	37%	0.374	C	S	.	.			trans	-59.2	-45.6	180	-178.5	0	0	0	0	111.9	C183 C205 V207 R209 G218	C183-C216 VanDerWaalsContact SG-SG 3.61Å; C205-C216 HydrophobicContact CB-CB 4.09Å; V207-C216 HydrophobicContact CB-CB 4.35Å; V207-C216 WeakPolarHBondContact O-CB 3.48Å; V207-C216 PolarHBondContact O-N 2.81Å; R209-C216 HydrophobicContact CG-CB 4.48Å; R209-C216 PolarHBondContact NH2-SG 3.13Å; C216-G218 PolarHBondContact O-N 3.4Å; C216-G218 VanDerWaalsContact O-N 3.09Å
217	R	92.4	Very high	87.4	Confident	183 Å²	183	71.9 Å²	71.9	69%	0.691	35%	0.354	S	S	*	.			trans	51	32.5	179.8	-53.7	178.5	74.5	-177.5	4	113.1	K182 C205 A215	K182-R217 PolarHBondContact NZ-O 3.43Å; K182-R217 VanDerWaalsContact NZ-O 3.16Å; C205-R217 PolarHBondContact O-N 3.42Å; A215-R217 HydrophobicContact CB-CG 3.99Å; A215-R217 PolarHBondContact O-N 2.97Å
218	G	95.9	Very high	87.4	Confident	0 Å²	0	78 Å²	78	0%	0	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-75.3	148.8	165.3	0	0	0	0	0	109.9	K182 Y204 C205 C216	K182-G218 VanDerWaalsContact CD-CA 3.42Å; Y204-G218 CarbonylContact C-O 3.57Å; Y204-G218 WeakPolarHBondContact CA-O 3.41Å; C205-G218 PolarHBondContact N-O 3.33Å; C216-G218 PolarHBondContact O-N 3.4Å; C216-G218 VanDerWaalsContact O-N 3.09Å
219	K	97.4	Very high	87.7	Confident	95 Å²	95	76.4 Å²	76.4	41%	0.413	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	143.1	174	-60.5	173	-179.5	175.7	0	108.7	E181 Y204	E181-K219 PolarHBondContact N-O 2.83Å; E181-K219 VanDerWaalsContact OE1-CB 3.3Å; E181-K219 WeakPolarHBondContact OE1-CB 3.44Å; E181-K219 WeakPolarHBondContact OE1-CG 3.24Å; E181-K219 PolarHBondContact OE1-N 2.71Å; E181-K219 VanDerWaalsContact OE1-N 3.09Å; Y204-K219 HydrophobicContact CD1-CG 4.39Å; Y204-K219 HydrophobicContact CE1-CG 3.91Å
220	L	98	Very high	88.7	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	134.1	168.1	-57.3	-174.6	0	0	0	108	E178 E179 C180 Y187 P200 T201 R203 C205	E178-L220 HydrophobicContact CB-CB 4.32Å; E178-L220 VanDerWaalsContact CD-CD1 3.42Å; E178-L220 HydrophobicContact CG-CB 4.15Å; E178-L220 HydrophobicContact CG-CD1 3.99Å; E178-L220 VanDerWaalsContact OE1-CD1 3.23Å; E178-L220 WeakPolarHBondContact OE1-CD1 3.23Å; E179-L220 CarbonylContact O-C 3.52Å; E179-L220 WeakPolarHBondContact O-CA 3.32Å; C180-L220 HydrophobicContact CB-CD2 3.65Å; Y187-L220 HydrophobicContact CD2-CD1 4.04Å; Y187-L220 HydrophobicContact CD2-CD2 4.01Å; Y187-L220 HydrophobicContact CE2-CD1 4.18Å; Y187-L220 HydrophobicContact CE2-CD2 3.71Å; P200-L220 CarbonylContact C-O 3.05Å; P200-L220 WeakPolarHBondContact CA-O 3.34Å; T201-L220 PolarHBondContact N-O 2.94Å; T201-L220 PolarHBondContact OG1-O 3.13Å; R203-L220 HydrophobicContact CB-CB 4.3Å; R203-L220 HydrophobicContact CB-CD1 3.78Å; R203-L220 HydrophobicContact CB-CG 4.25Å; R203-L220 PolarHBondContact O-N 2.79Å; C205-L220 HydrophobicContact CB-CD2 3.84Å
221	I	97.3	Very high	90.2	Very high	33 Å²	33	69.7 Å²	69.7	17%	0.169	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	153.2	177.6	60	166.8	0	0	0	109.5	E178 E179 K199	E178-I221 CarbonylContact C-O 3.49Å; E178-I221 WeakPolarHBondContact CA-O 3.32Å; E178-I221 VanDerWaalsContact CB-O 3.3Å; E178-I221 WeakPolarHBondContact CB-O 3.47Å; E179-I221 PolarHBondContact N-O 3.04Å; E179-I221 WeakPolarHBondContact O-CG1 3.21Å; E179-I221 PolarHBondContact O-N 3.43Å; K199-I221 WeakPolarHBondContact O-CA 3.34Å
222	S	96.4	Very high	91.5	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.007	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	157.8	169.9	66.3	0	0	0	0	111	V195 L198 K199	V195-S222 WeakPolarHBondContact O-CB 3.3Å; V195-S222 PolarHBondContact O-OG 2.99Å; L198-S222 WeakPolarHBondContact CD2-O 3.24Å; L198-S222 PolarHBondContact N-OG 2.96Å; K199-S222 PolarHBondContact N-OG 2.76Å; K199-S222 PolarHBondContact O-N 3.48Å
223	T	97	Very high	92.8	Very high	20 Å²	20	63.6 Å²	63.6	12%	0.123	32%	0.316	C	S	.	.			trans	-98.5	-6	174.7	56.4	0	0	0	0	113.2	G173 N174 V177 E179 L225	G173-T223 WeakPolarHBondContact CA-O 3.44Å; N174-T223 PolarHBondContact N-OG1 3.09Å; N174-T223 PolarHBondContact O-OG1 3.08Å; N174-T223 VanDerWaalsContact O-OG1 3.12Å; V177-T223 HydrophobicContact CB-CG2 4.3Å; V177-T223 HydrophobicContact CG1-CG2 3.89Å; V177-T223 WeakPolarHBondContact O-CG2 3.12Å; V177-T223 PolarHBondContact O-N 3.1Å; V177-T223 PolarHBondContact O-OG1 3.08Å; E179-T223 HydrophobicContact CB-CG2 4.08Å; T223-L225 PolarHBondContact O-N 3.46Å
224	I	96.2	Very high	93.9	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.021	30%	0.3	C	S	.	.			trans	-71.2	124.8	-179.7	-55.1	-58.5	0	0	0	109.8	V154 M175 M196 G197 L198	V154-I224 HydrophobicContact CB-CD1 3.7Å; V154-I224 HydrophobicContact CG1-CD1 3.83Å; M175-I224 HydrophobicContact CG-CD1 4.05Å; M175-I224 HydrophobicContact SD-CD1 3.67Å; M175-I224 HydrophobicContact SD-CG1 3.68Å; M196-I224 HydrophobicContact CB-CB 4.26Å; M196-I224 HydrophobicContact CB-CG2 4Å; M196-I224 HydrophobicContact CG-CB 4.2Å; M196-I224 HydrophobicContact CG-CG1 4.45Å; M196-I224 HydrophobicContact CG-CG2 3.91Å; G197-I224 WeakPolarHBondContact CA-O 2.84Å; G197-I224 PolarHBondContact N-O 3.47Å; L198-I224 PolarHBondContact N-O 2.96Å; L198-I224 VanDerWaalsContact N-O 3.1Å
225	L	94.5	Very high	94.7	Very high	22 Å²	22	52.8 Å²	52.8	12%	0.115	27%	0.265	C	S	.	.			trans	-79.4	140.2	177.5	-53.4	-175.4	0	0	0	111.3	L171 L198 T223 D229 L231	L171-L225 WeakPolarHBondContact O-CD1 3.49Å; L198-L225 HydrophobicContact CD1-CD2 4.27Å; L198-L225 HydrophobicContact CD2-CD2 3.97Å; L198-L225 HydrophobicContact CG-CD2 4.31Å; T223-L225 PolarHBondContact O-N 3.46Å; L225-D229 HydrophobicContact CB-CB 4.08Å; L225-D229 HydrophobicContact CD2-CB 4.07Å; L225-L231 HydrophobicContact CD1-CD1 4.15Å; L225-L231 HydrophobicContact CD1-CG 4.13Å
226	D	93.8	Very high	95.3	Very high	24 Å²	24	52.5 Å²	52.5	13%	0.128	26%	0.258	C	S	.	.			trans	-84	175.6	156.9	-149.1	-19.5	0	0	0	110.5	S49 E228 D229	S49-D226 WeakPolarHBondContact CB-OD1 3.2Å; S49-D226 VanDerWaalsContact CB-OD2 3.28Å; S49-D226 WeakPolarHBondContact CB-OD2 3.3Å; S49-D226 PolarHBondContact N-OD1 2.88Å; S49-D226 PolarHBondContact N-OD2 3.07Å; S49-D226 PolarHBondContact OG-OD2 2.95Å; D226-E228 VanDerWaalsContact C-N 3.31Å; D226-E228 PolarHBondContact O-N 3.16Å; D226-D229 WeakPolarHBondContact CB-OD2 3.25Å; D226-D229 PolarHBondContact N-OD2 3.45Å; D226-D229 PolarHBondContact O-N 3.09Å
227	W	90.3	Very high	95.5	Very high	57 Å²	57	57 Å²	57	22%	0.216	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-34.7	-172.9	-66.7	97.7	0	0	0	114.8	L48 S49 Y51 K54 W110	L48-W227 HydrophobicContact CD1-CZ2 4.12Å; S49-W227 PolarHBondContact O-NE1 3.48Å; Y51-W227 VanDerWaalsContact CB-CD1 3.46Å; Y51-W227 VanDerWaalsContact CB-CG 3.5Å; Y51-W227 HydrophobicContact CD1-CB 4.46Å; Y51-W227 AromaticContact CD1-CD2 3.7Å; Y51-W227 HydrophobicContact CD1-CD2 3.7Å; Y51-W227 AromaticContact CD1-CE3 3.58Å; Y51-W227 HydrophobicContact CD1-CE3 3.58Å; Y51-W227 HydrophobicContact CD1-CG 4.09Å; Y51-W227 HydrophobicContact CD1-CZ3 4.11Å; Y51-W227 HydrophobicContact CD2-CB 3.55Å; Y51-W227 HydrophobicContact CD2-CD2 4.28Å; Y51-W227 AromaticContact CD2-CG 3.77Å; Y51-W227 HydrophobicContact CD2-CG 3.77Å; Y51-W227 HydrophobicContact CE1-CD2 4.42Å; Y51-W227 AromaticContact CE1-CE3 3.95Å; Y51-W227 HydrophobicContact CE1-CE3 3.95Å; Y51-W227 HydrophobicContact CE2-CB 3.95Å; Y51-W227 HydrophobicContact CG-CB 3.84Å; Y51-W227 AromaticContact CG-CD2 3.61Å; Y51-W227 HydrophobicContact CG-CD2 3.61Å; Y51-W227 AromaticContact CG-CE3 3.99Å; Y51-W227 HydrophobicContact CG-CE3 3.99Å; Y51-W227 AromaticContact CG-CG 3.52Å; Y51-W227 HydrophobicContact CG-CG 3.52Å; K54-W227 HydrophobicContact CD-CH2 3.76Å; K54-W227 HydrophobicContact CD-CZ2 3.63Å; W110-W227 AromaticContact CH2-CZ2 3.95Å; W110-W227 HydrophobicContact CH2-CZ2 3.95Å; W110-W227 AromaticContact CZ2-CH2 3.99Å; W110-W227 HydrophobicContact CZ2-CH2 3.99Å; W110-W227 AromaticContact CZ2-CZ2 3.58Å; W110-W227 HydrophobicContact CZ2-CZ2 3.58Å
228	E	90.5	Very high	95.8	Very high	181 Å²	181	51.4 Å²	51.4	85%	0.846	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-3.6	-177.4	-60.6	-169.6	156.7	0	0	113.1	D226	D226-E228 VanDerWaalsContact C-N 3.31Å; D226-E228 PolarHBondContact O-N 3.16Å
229	D	94.1	Very high	96	Very high	52 Å²	52	51.4 Å²	51.4	28%	0.278	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-71.6	140.7	179.7	-72.4	-33.2	0	0	0	111.1	L198 L225 D226	L198-D229 HydrophobicContact CD1-CB 4.09Å; L225-D229 HydrophobicContact CB-CB 4.08Å; L225-D229 HydrophobicContact CD2-CB 4.07Å; D226-D229 WeakPolarHBondContact CB-OD2 3.25Å; D226-D229 PolarHBondContact N-OD2 3.45Å; D226-D229 PolarHBondContact O-N 3.09Å
230	A	95.4	Very high	96	Very high	80 Å²	80	49 Å²	49	66%	0.661	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-69.5	145.9	171.8	0	0	0	0	0	110.8
231	L	96.6	Very high	96.1	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.131	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-63.1	148.8	170.8	-87.1	68.7	0	0	0	110.7	L171 L225 D233 L236 P260	L171-L231 HydrophobicContact CB-CD2 4.05Å; L171-L231 HydrophobicContact CD1-CD2 4.41Å; L171-L231 HydrophobicContact CD2-CD2 4.43Å; L225-L231 HydrophobicContact CD1-CD1 4.15Å; L225-L231 HydrophobicContact CD1-CG 4.13Å; L231-D233 PolarHBondContact O-N 2.9Å; L231-D233 VanDerWaalsContact O-N 3.16Å; L231-L236 HydrophobicContact CB-CB 4.43Å; L231-L236 HydrophobicContact CB-CD2 4.15Å; L231-L236 HydrophobicContact CD2-CD1 4.09Å; L231-P260 HydrophobicContact CD2-CG 3.74Å
232	P	95.3	Very high	96.1	Very high	41 Å²	41	51.3 Å²	51.3	27%	0.266	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-62.3	116.2	177.4	23.9	-33.2	0	0	0	111.5	L171 R234 D235 L236	L171-P232 VanDerWaalsContact O-CD 3.3Å; L171-P232 WeakPolarHBondContact O-CD 3.27Å; P232-R234 VanDerWaalsContact C-N 3.26Å; P232-R234 PolarHBondContact O-N 3.16Å; P232-R234 VanDerWaalsContact O-N 3.15Å; P232-D235 HydrophobicContact CB-CB 4.41Å; P232-D235 HydrophobicContact CG-CB 3.99Å; P232-D235 PolarHBondContact O-N 2.97Å; P232-D235 VanDerWaalsContact O-N 3.09Å; P232-L236 WeakPolarHBondContact O-CB 3.3Å; P232-L236 PolarHBondContact O-N 3.27Å
233	D	95.6	Very high	96.2	Very high	119 Å²	119	51.3 Å²	51.3	64%	0.636	27%	0.265	S	S	*	.	H	α-helix	trans	-51.2	-42.8	-176.1	-74.4	-27.7	0	0	0	113	L231 D235 N237	L231-D233 PolarHBondContact O-N 2.9Å; L231-D233 VanDerWaalsContact O-N 3.16Å; D233-D235 PolarHBondContact O-N 2.94Å; D233-N237 WeakPolarHBondContact O-CB 3.04Å; D233-N237 PolarHBondContact O-N 2.86Å; D233-N237 PolarHBondContact O-ND2 2.85Å
234	R	94.8	Very high	96.3	Very high	113 Å²	113	55.6 Å²	55.6	43%	0.426	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-49.9	-179.6	-174	-168.3	73.8	-175.5	7.2	111.5	P232 R238	P232-R234 VanDerWaalsContact C-N 3.26Å; P232-R234 PolarHBondContact O-N 3.16Å; P232-R234 VanDerWaalsContact O-N 3.15Å; R234-R238 WeakPolarHBondContact O-CD 3.49Å; R234-R238 VanDerWaalsContact O-CG 3.26Å; R234-R238 WeakPolarHBondContact O-CG 3.24Å; R234-R238 PolarHBondContact O-N 2.87Å
235	D	97.9	Very high	96.4	Very high	7 Å²	7	62.1 Å²	62.1	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-77.5	-36.3	-174.1	-75	-109.4	0	0	0	110.9	S169 E170 L171 P232 D233 R238 A239	S169-D235 WeakPolarHBondContact CA-OD1 3.24Å; S169-D235 WeakPolarHBondContact CB-O 3.13Å; S169-D235 PolarHBondContact OG-O 3.34Å; E170-D235 PolarHBondContact N-OD1 3.26Å; E170-D235 VanDerWaalsContact N-OD1 3.13Å; L171-D235 HydrophobicContact CD2-CB 4.34Å; P232-D235 HydrophobicContact CB-CB 4.41Å; P232-D235 HydrophobicContact CG-CB 3.99Å; P232-D235 PolarHBondContact O-N 2.97Å; P232-D235 VanDerWaalsContact O-N 3.09Å; D233-D235 PolarHBondContact O-N 2.94Å; D235-R238 IonicContact OD1-NH1 2.73Å; D235-A239 WeakPolarHBondContact O-CB 3.31Å; D235-A239 PolarHBondContact O-N 3.33Å
236	L	98.5	Very high	96.6	Very high	38 Å²	38	61.2 Å²	61.2	20%	0.199	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-45.4	173.7	-179.3	59.5	0	0	0	112	L171 L231 P232 R238 A239 D240 P260 L264	L171-L236 HydrophobicContact CD2-CB 4.48Å; L231-L236 HydrophobicContact CB-CB 4.43Å; L231-L236 HydrophobicContact CB-CD2 4.15Å; L231-L236 HydrophobicContact CD2-CD1 4.09Å; P232-L236 WeakPolarHBondContact O-CB 3.3Å; P232-L236 PolarHBondContact O-N 3.27Å; L236-R238 PolarHBondContact O-N 2.97Å; L236-A239 PolarHBondContact O-N 2.67Å; L236-D240 WeakPolarHBondContact O-CB 3.23Å; L236-D240 PolarHBondContact O-N 3.09Å; L236-P260 HydrophobicContact CD1-CG 3.88Å; L236-P260 HydrophobicContact CD2-CG 4.21Å; L236-L264 HydrophobicContact CD1-CD2 4.47Å
237	N	98.4	Very high	96.9	Very high	103 Å²	103	62.7 Å²	62.7	55%	0.551	31%	0.307	S	S	*	.	H	α-helix	trans	-63.7	-41.8	178.5	-73.7	-36.4	0	0	0	112	D233 A239 D240 D241	D233-N237 WeakPolarHBondContact O-CB 3.04Å; D233-N237 PolarHBondContact O-N 2.86Å; D233-N237 PolarHBondContact O-ND2 2.85Å; N237-A239 VanDerWaalsContact C-N 3.35Å; N237-D240 PolarHBondContact O-N 3.18Å; N237-D241 PolarHBondContact O-N 3.47Å
238	R	98.6	Very high	97.3	Very high	65 Å²	65	60.1 Å²	60.1	25%	0.245	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-39.5	174.6	-69.8	165	66.9	-142.9	2.6	111.8	Y148 R165 D166 L168 R234 D235 L236 A242	Y148-R238 VanDerWaalsContact OH-CB 3.23Å; Y148-R238 WeakPolarHBondContact OH-CB 3.24Å; Y148-R238 PolarHBondContact OH-NE 3.12Å; Y148-R238 PolarHBondContact OH-NH1 3.06Å; Y148-R238 PolarHBondContact OH-NH2 3.05Å; Y148-R238 VanDerWaalsContact OH-NH2 3.08Å; R165-R238 PolarHBondContact O-NH2 2.85Å; D166-R238 PolarHBondContact O-NH2 2.87Å; L168-R238 PolarHBondContact O-NH1 3.44Å; L168-R238 PolarHBondContact O-NH2 3.14Å; R234-R238 WeakPolarHBondContact O-CD 3.49Å; R234-R238 VanDerWaalsContact O-CG 3.26Å; R234-R238 WeakPolarHBondContact O-CG 3.24Å; R234-R238 PolarHBondContact O-N 2.87Å; D235-R238 IonicContact OD1-NH1 2.73Å; L236-R238 PolarHBondContact O-N 2.97Å; R238-A242 VanDerWaalsContact O-CB 3.29Å; R238-A242 WeakPolarHBondContact O-CB 3.29Å; R238-A242 PolarHBondContact O-N 2.64Å
239	A	98.8	Very high	97.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-41.1	177.7	0	0	0	0	0	112	I150 L171 D235 L236 N237 S243 L264	I150-A239 HydrophobicContact CD1-CB 3.73Å; I150-A239 WeakPolarHBondContact CD1-O 3.35Å; I150-A239 HydrophobicContact CG1-CB 3.82Å; I150-A239 HydrophobicContact CG2-CB 3.92Å; L171-A239 HydrophobicContact CD2-CB 3.99Å; D235-A239 WeakPolarHBondContact O-CB 3.31Å; D235-A239 PolarHBondContact O-N 3.33Å; L236-A239 PolarHBondContact O-N 2.67Å; N237-A239 VanDerWaalsContact C-N 3.35Å; A239-S243 VanDerWaalsContact O-CB 3.29Å; A239-S243 WeakPolarHBondContact O-CB 3.3Å; A239-S243 PolarHBondContact O-N 3.4Å; A239-S243 PolarHBondContact O-OG 3.1Å; A239-L264 HydrophobicContact CB-CD1 3.91Å
240	D	98.7	Very high	97.9	Very high	45 Å²	45	49 Å²	49	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-48.7	174.6	178.6	-87.5	0	0	0	111.3	L236 N237 A242 S243 R244 L264 L267	L236-D240 WeakPolarHBondContact O-CB 3.23Å; L236-D240 PolarHBondContact O-N 3.09Å; N237-D240 PolarHBondContact O-N 3.18Å; D240-A242 PolarHBondContact O-N 3.33Å; D240-S243 PolarHBondContact O-N 3.45Å; D240-R244 VanDerWaalsContact CG-NE 3.3Å; D240-R244 WeakPolarHBondContact O-CG 3.42Å; D240-R244 PolarHBondContact O-N 2.92Å; D240-R244 WeakPolarHBondContact OD1-CD 3.46Å; D240-R244 IonicContact OD1-CZ 3.94Å; D240-R244 IonicContact OD1-NE 3.81Å; D240-R244 PolarHBondContact OD1-NE 2.86Å; D240-R244 IonicContact OD1-NH2 2.85Å; D240-R244 PolarHBondContact OD1-NH2 3.27Å; D240-R244 IonicContact OD2-CZ 3.43Å; D240-R244 IonicContact OD2-NE 3.2Å; D240-R244 PolarHBondContact OD2-NE 3.49Å; D240-R244 IonicContact OD2-NH2 3.49Å; D240-R244 PolarHBondContact OD2-NH2 3.3Å; D240-L264 HydrophobicContact CB-CD2 4.47Å; D240-L267 HydrophobicContact CB-CD1 4.4Å; D240-L267 VanDerWaalsContact OD2-CD1 3.24Å; D240-L267 WeakPolarHBondContact OD2-CD1 3.33Å
241	D	98.6	Very high	98.1	Very high	80 Å²	80	45.2 Å²	45.2	43%	0.428	21%	0.212	S	C	.	.	H	α-helix	trans	-57.9	-50.6	176.1	-179.1	65.4	0	0	0	111.5	N237 S243 R244 R245	N237-D241 PolarHBondContact O-N 3.47Å; D241-S243 VanDerWaalsContact C-N 3.33Å; D241-S243 PolarHBondContact O-N 3.37Å; D241-R244 PolarHBondContact O-N 3.42Å; D241-R245 WeakPolarHBondContact O-CB 3.35Å; D241-R245 VanDerWaalsContact O-CG 3.29Å; D241-R245 WeakPolarHBondContact O-CG 3.39Å; D241-R245 PolarHBondContact O-N 2.77Å; D241-R245 WeakPolarHBondContact OD2-CD 3.36Å; D241-R245 IonicContact OD2-NH1 3.26Å; D241-R245 PolarHBondContact OD2-NH1 2.76Å
242	A	98.8	Very high	98.2	Very high	1 Å²	1	44 Å²	44	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-58.8	-45.3	178.6	0	0	0	0	0	111.6	Y85 V87 Y148 R238 D240 R244 R245 A246	Y85-A242 HydrophobicContact CE1-CB 4.41Å; V87-A242 HydrophobicContact CG2-CB 4.13Å; Y148-A242 HydrophobicContact CD1-CB 3.52Å; Y148-A242 HydrophobicContact CD2-CB 4.34Å; Y148-A242 HydrophobicContact CE1-CB 4.22Å; Y148-A242 HydrophobicContact CG-CB 3.6Å; R238-A242 VanDerWaalsContact O-CB 3.29Å; R238-A242 WeakPolarHBondContact O-CB 3.29Å; R238-A242 PolarHBondContact O-N 2.64Å; D240-A242 PolarHBondContact O-N 3.33Å; A242-R244 VanDerWaalsContact C-N 3.33Å; A242-R244 PolarHBondContact O-N 3Å; A242-R245 PolarHBondContact O-N 3.24Å; A242-A246 PolarHBondContact O-N 3.18Å
243	S	98.8	Very high	98.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-35.4	-179.6	-55.3	0	0	0	0	112.3	H89 I150 A239 D240 D241 L264 T268	H89-S243 PolarHBondContact CE1-OG 3.38Å; I150-S243 VanDerWaalsContact CD1-OG 3.31Å; I150-S243 WeakPolarHBondContact CD1-OG 3.39Å; A239-S243 VanDerWaalsContact O-CB 3.29Å; A239-S243 WeakPolarHBondContact O-CB 3.3Å; A239-S243 PolarHBondContact O-N 3.4Å; A239-S243 PolarHBondContact O-OG 3.1Å; D240-S243 PolarHBondContact O-N 3.45Å; D241-S243 VanDerWaalsContact C-N 3.33Å; D241-S243 PolarHBondContact O-N 3.37Å; S243-L264 WeakPolarHBondContact CB-O 3.47Å; S243-T268 VanDerWaalsContact O-CA 3.27Å; S243-T268 WeakPolarHBondContact O-CA 3.38Å; S243-T268 PolarHBondContact O-N 2.61Å; S243-T268 PolarHBondContact O-OG1 2.85Å
244	R	98.6	Very high	98.5	Very high	110 Å²	110	37 Å²	37	42%	0.415	17%	0.168	S	C	.	.	H	α-helix	trans	-73	-29.7	176	-72	177.6	-165.6	-86.8	-7.1	113.5	D240 D241 A242 L267	D240-R244 VanDerWaalsContact CG-NE 3.3Å; D240-R244 WeakPolarHBondContact O-CG 3.42Å; D240-R244 PolarHBondContact O-N 2.92Å; D240-R244 WeakPolarHBondContact OD1-CD 3.46Å; D240-R244 IonicContact OD1-CZ 3.94Å; D240-R244 IonicContact OD1-NE 3.81Å; D240-R244 PolarHBondContact OD1-NE 2.86Å; D240-R244 IonicContact OD1-NH2 2.85Å; D240-R244 PolarHBondContact OD1-NH2 3.27Å; D240-R244 IonicContact OD2-CZ 3.43Å; D240-R244 IonicContact OD2-NE 3.2Å; D240-R244 PolarHBondContact OD2-NE 3.49Å; D240-R244 IonicContact OD2-NH2 3.49Å; D240-R244 PolarHBondContact OD2-NH2 3.3Å; D241-R244 PolarHBondContact O-N 3.42Å; A242-R244 VanDerWaalsContact C-N 3.33Å; A242-R244 PolarHBondContact O-N 3Å; R244-L267 HydrophobicContact CG-CB 4.08Å; R244-L267 HydrophobicContact CG-CD1 4.36Å; R244-L267 HydrophobicContact CG-CD2 4.13Å; R244-L267 HydrophobicContact CG-CG 4.44Å
245	R	98.5	Very high	98.7	Very high	141 Å²	141	32.3 Å²	32.3	53%	0.532	15%	0.152	S	C	.	.	H	α-helix	trans	-81.5	-23.1	178.2	-71.6	170.3	60.4	-172.8	0.2	113	Y85 D241 A242	Y85-R245 HydrophobicContact CD1-CB 4.18Å; Y85-R245 HydrophobicContact CE1-CB 4.02Å; Y85-R245 VanDerWaalsContact CE2-NH2 3.32Å; D241-R245 WeakPolarHBondContact O-CB 3.35Å; D241-R245 VanDerWaalsContact O-CG 3.29Å; D241-R245 WeakPolarHBondContact O-CG 3.39Å; D241-R245 PolarHBondContact O-N 2.77Å; D241-R245 WeakPolarHBondContact OD2-CD 3.36Å; D241-R245 IonicContact OD2-NH1 3.26Å; D241-R245 PolarHBondContact OD2-NH1 2.76Å; A242-R245 PolarHBondContact O-N 3.24Å
246	A	98.8	Very high	98.7	Very high	4 Å²	4	32 Å²	32	3%	0.033	15%	0.151	C	C	.	.			trans	-62.3	138.6	-178.8	0	0	0	0	0	112.5	Y85 V87 A242 T268	Y85-A246 HydrophobicContact CD1-CB 4.11Å; Y85-A246 VanDerWaalsContact O-CA 3.24Å; Y85-A246 WeakPolarHBondContact O-CA 3.34Å; Y85-A246 WeakPolarHBondContact O-CB 3.44Å; V87-A246 HydrophobicContact CB-CB 4.01Å; V87-A246 HydrophobicContact CG2-CB 3.68Å; A242-A246 PolarHBondContact O-N 3.18Å; A246-T268 HydrophobicContact CB-CG2 3.8Å; A246-T268 WeakPolarHBondContact O-CG2 3.48Å
247	D	98.8	Very high	98.7	Very high	54 Å²	54	32 Å²	32	29%	0.289	15%	0.149	S	C	.	.	S	Bend	trans	-95.9	-15.6	163.2	55.2	12	0	0	0	111.5	S83 E84 Y85 G273 K274	S83-D247 WeakPolarHBondContact CB-OD1 3.32Å; S83-D247 PolarHBondContact OG-OD1 3.25Å; E84-D247 PolarHBondContact N-OD2 2.92Å; Y85-D247 VanDerWaalsContact C-OD1 3.29Å; Y85-D247 PolarHBondContact N-OD1 3.28Å; Y85-D247 PolarHBondContact N-OD2 3.45Å; Y85-D247 PolarHBondContact O-N 3.06Å; D247-G273 CarbonylContact O-C 3.45Å; D247-G273 WeakPolarHBondContact O-CA 3.47Å; D247-K274 PolarHBondContact O-N 2.86Å
248	L	98.9	Very high	98.6	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.016	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	122.5	173.9	-176.7	61	0	0	0	111.2	L79 I80 S83 L86 V87 K274 V276	L79-L248 HydrophobicContact CB-CD1 4.38Å; L79-L248 HydrophobicContact CB-CD2 4Å; I80-L248 HydrophobicContact CG1-CD2 3.75Å; S83-L248 WeakPolarHBondContact OG-CB 3.43Å; L86-L248 WeakPolarHBondContact CA-O 3.32Å; L86-L248 HydrophobicContact CD1-CB 4.29Å; L86-L248 HydrophobicContact CD1-CD2 3.88Å; L86-L248 HydrophobicContact CD1-CG 3.86Å; V87-L248 PolarHBondContact N-O 3.41Å; L248-K274 WeakPolarHBondContact CA-O 3.43Å; L248-K274 HydrophobicContact CD1-CB 3.99Å; L248-V276 HydrophobicContact CD1-CG2 3.87Å
249	A	98.9	Very high	98.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.3	167.9	0	0	0	0	0	110	V87 P265 T268 K274 V275 V276	V87-A249 CarbonylContact O-C 3.57Å; V87-A249 WeakPolarHBondContact O-CA 3.02Å; A249-P265 HydrophobicContact CB-CB 4.28Å; A249-T268 HydrophobicContact CB-CG2 3.89Å; A249-K274 PolarHBondContact N-O 2.6Å; A249-V275 HydrophobicContact CB-CG2 4.35Å; A249-V275 CarbonylContact O-C 3.55Å; A249-V275 WeakPolarHBondContact O-CA 3.28Å; A249-V276 PolarHBondContact O-N 3.13Å
250	L	98.9	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.3	175.1	173.7	60.5	0	0	0	109.6	L76 I80 L86 V87 V88 H89 L252 V276 V278	L76-L250 HydrophobicContact CD1-CD1 4.14Å; L76-L250 HydrophobicContact CD1-CD2 4.48Å; L76-L250 HydrophobicContact CD2-CD1 4.26Å; I80-L250 HydrophobicContact CD1-CD2 4.45Å; L86-L250 HydrophobicContact CD1-CB 3.96Å; V87-L250 PolarHBondContact O-N 2.79Å; V88-L250 CarbonylContact C-O 3.56Å; V88-L250 VanDerWaalsContact CA-O 3.28Å; V88-L250 WeakPolarHBondContact CA-O 3.26Å; V88-L250 HydrophobicContact CG2-CB 4.09Å; V88-L250 HydrophobicContact CG2-CD2 4.15Å; V88-L250 HydrophobicContact CG2-CG 4.39Å; H89-L250 PolarHBondContact N-O 2.97Å; L250-L252 HydrophobicContact CD1-CD2 3.9Å; L250-L252 HydrophobicContact CD2-CD1 4.49Å; L250-L252 HydrophobicContact CD2-CD2 4.11Å; L250-L252 HydrophobicContact CD2-CG 4.44Å; L250-L252 HydrophobicContact CG-CD2 3.86Å; L250-L252 HydrophobicContact CG-CG 4.11Å; L250-V276 HydrophobicContact CD1-CB 3.9Å; L250-V276 HydrophobicContact CD1-CG1 3.85Å; L250-V278 HydrophobicContact CD1-CG2 3.81Å
251	T	98.9	Very high	98.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.3	176.3	77.7	0	0	0	0	110.5	H89 M256 P265 V276 I277 V278	H89-T251 HydrophobicContact CB-CG2 4.12Å; H89-T251 CarbonylContact O-C 3.59Å; H89-T251 VanDerWaalsContact O-CA 3.32Å; H89-T251 WeakPolarHBondContact O-CA 3.22Å; T251-M256 HydrophobicContact CG2-SD 3.83Å; T251-P265 HydrophobicContact CG2-CB 3.86Å; T251-P265 HydrophobicContact CG2-CG 3.6Å; T251-V276 PolarHBondContact N-O 3.08Å; T251-I277 WeakPolarHBondContact OG1-CA 2.98Å; T251-V278 PolarHBondContact O-N 2.68Å
252	L	98.9	Very high	98.2	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	117.3	-175.5	-58.6	178.6	0	0	0	109.7	V88 H89 S90 G91 I94 T133 L137 L250 T254 V278 V297 M301	V88-L252 HydrophobicContact CG1-CD1 3.87Å; V88-L252 HydrophobicContact CG1-CG 4.25Å; H89-L252 PolarHBondContact O-N 3.05Å; S90-L252 WeakPolarHBondContact CA-O 3.3Å; G91-L252 PolarHBondContact N-O 3.29Å; I94-L252 HydrophobicContact CG2-CB 3.68Å; T133-L252 HydrophobicContact CG2-CD1 4Å; L137-L252 HydrophobicContact CD1-CD1 4.32Å; L137-L252 HydrophobicContact CD2-CD1 4.05Å; L250-L252 HydrophobicContact CD1-CD2 3.9Å; L250-L252 HydrophobicContact CD2-CD1 4.49Å; L250-L252 HydrophobicContact CD2-CD2 4.11Å; L250-L252 HydrophobicContact CD2-CG 4.44Å; L250-L252 HydrophobicContact CG-CD2 3.86Å; L250-L252 HydrophobicContact CG-CG 4.11Å; L252-T254 VanDerWaalsContact C-N 3.35Å; L252-T254 PolarHBondContact O-N 2.84Å; L252-V278 HydrophobicContact CD2-CB 3.73Å; L252-V278 HydrophobicContact CD2-CG1 4.43Å; L252-V278 HydrophobicContact CD2-CG2 3.74Å; L252-V297 HydrophobicContact CB-CG1 4.36Å; L252-M301 HydrophobicContact CD1-SD 4.03Å; L252-M301 HydrophobicContact CD2-SD 4.35Å
253	G	98.6	Very high	98.2	Very high	6 Å²	6	30.6 Å²	30.6	6%	0.062	14%	0.144	C	C	.	.	S	Bend	trans	62.9	35.8	169.4	0	0	0	0	0	114.5	G91 A92 G93 V278 N279	G91-G253 CarbonylContact C-O 3.56Å; G91-G253 VanDerWaalsContact CA-O 3.27Å; G91-G253 WeakPolarHBondContact CA-O 3.23Å; A92-G253 PolarHBondContact N-O 3.19Å; G93-G253 WeakPolarHBondContact CA-O 3.34Å; G93-G253 PolarHBondContact N-O 3.01Å; G253-V278 PolarHBondContact N-O 2.86Å; G253-N279 WeakPolarHBondContact CA-OD1 3.29Å
254	T	98.7	Very high	98.2	Very high	8 Å²	8	31 Å²	31	5%	0.049	15%	0.145	C	C	.	.			trans	-130.7	133.9	175.9	179.8	0	0	0	0	111.2	Q152 L252 M256 N279 T283	Q152-T254 PolarHBondContact NE2-OG1 3.08Å; L252-T254 VanDerWaalsContact C-N 3.35Å; L252-T254 PolarHBondContact O-N 2.84Å; T254-M256 HydrophobicContact CG2-CG 3.7Å; T254-M256 PolarHBondContact O-N 3.38Å; T254-M256 PolarHBondContact OG1-N 3.43Å; T254-N279 PolarHBondContact N-OD1 3.21Å; T254-T283 WeakPolarHBondContact O-CG2 3.46Å
255	S	98.3	Very high	98.2	Very high	13 Å²	13	25.8 Å²	25.8	9%	0.091	13%	0.126	C	C	.	.			trans	-77.4	-7	172.9	67.1	0	0	0	0	113.5	Q257 K284	S255-Q257 PolarHBondContact O-N 3.42Å; S255-Q257 PolarHBondContact OG-NE2 2.9Å; S255-K284 PolarHBondContact O-N 2.93Å
256	M	98.4	Very high	98.2	Very high	2 Å²	2	20.1 Å²	20.1	1%	0.01	11%	0.106	C	C	.	.			trans	55.5	29.3	178.8	-56.8	-166.5	-58.5	0	0	115	T251 T254 P265 I277 T283 K284 H285	T251-M256 HydrophobicContact CG2-SD 3.83Å; T254-M256 HydrophobicContact CG2-CG 3.7Å; T254-M256 PolarHBondContact O-N 3.38Å; T254-M256 PolarHBondContact OG1-N 3.43Å; M256-P265 HydrophobicContact SD-CG 3.91Å; M256-I277 HydrophobicContact CE-CD1 3.68Å; M256-T283 VanDerWaalsContact CE-OG1 3.3Å; M256-T283 WeakPolarHBondContact CE-OG1 3.42Å; M256-K284 HydrophobicContact CB-CB 4.46Å; M256-K284 WeakPolarHBondContact O-CB 2.96Å; M256-K284 WeakPolarHBondContact O-CD 3.23Å; M256-H285 HydrophobicContact CE-CB 3.46Å; M256-H285 VanDerWaalsContact CE-CB 3.46Å
257	Q	98	Very high	98.2	Very high	36 Å²	36	20.4 Å²	20.4	17%	0.168	11%	0.107	C	C	.	.			trans	-80.7	-31.8	-176.9	-66.5	-175.5	42.4	0	0	113.6	V56 S255 K284	V56-Q257 PolarHBondContact O-NE2 3.24Å; S255-Q257 PolarHBondContact O-N 3.42Å; S255-Q257 PolarHBondContact OG-NE2 2.9Å; Q257-K284 PolarHBondContact O-NZ 3.02Å
258	I	96	Very high	98.2	Very high	46 Å²	46	17.8 Å²	17.8	24%	0.236	9%	0.093	C	C	.	.	S	Bend	trans	-79.7	129.3	-175.9	-60	-54.8	0	0	0	110.8	R104 S261 G262	R104-I258 VanDerWaalsContact NH2-CD1 3.3Å; I258-S261 PolarHBondContact O-N 2.94Å; I258-G262 WeakPolarHBondContact O-CA 3.32Å; I258-G262 PolarHBondContact O-N 2.66Å
259	K	95.5	Very high	98.1	Very high	130 Å²	130	21.8 Å²	21.8	57%	0.565	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	147.9	174.8	-66.2	-168.6	176.1	-160.4	0	110.8	D263	K259-D263 VanDerWaalsContact CD-OD2 3.27Å; K259-D263 WeakPolarHBondContact CD-OD2 3.47Å; K259-D263 WeakPolarHBondContact CE-OD2 3.17Å; K259-D263 IonicContact NZ-OD2 3.84Å; K259-D263 PolarHBondContact NZ-OD2 2.82Å
260	P	96.8	Very high	98	Very high	52 Å²	52	29.4 Å²	29.4	34%	0.338	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	cis	-81.2	-9.9	-2.3	33.6	-35.8	0	0	0	114.2	L231 L236 G262 D263 L264	L231-P260 HydrophobicContact CD2-CG 3.74Å; L236-P260 HydrophobicContact CD1-CG 3.88Å; L236-P260 HydrophobicContact CD2-CG 4.21Å; P260-G262 PolarHBondContact O-N 2.69Å; P260-D263 PolarHBondContact O-N 2.78Å; P260-L264 PolarHBondContact O-N 2.82Å
261	S	97.4	Very high	97.9	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.021	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-52.5	-46.3	-170.6	-47.4	0	0	0	0	114.7	H172 I258 D263 L264	H172-S261 PolarHBondContact NE2-OG 2.93Å; H172-S261 VanDerWaalsContact NE2-OG 3.08Å; I258-S261 PolarHBondContact O-N 2.94Å; S261-D263 VanDerWaalsContact C-N 3.28Å; S261-D263 PolarHBondContact O-N 2.7Å; S261-L264 WeakPolarHBondContact O-CB 3.28Å; S261-L264 PolarHBondContact O-N 2.68Å
262	G	97.7	Very high	97.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.01	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-72.2	-16.9	179.4	0	0	0	0	0	114.3	I258 P260 H285	I258-G262 WeakPolarHBondContact O-CA 3.32Å; I258-G262 PolarHBondContact O-N 2.66Å; P260-G262 PolarHBondContact O-N 2.69Å; G262-H285 PolarHBondContact O-CD2 2.82Å; G262-H285 PolarHBondContact O-NE2 3.32Å; G262-H285 VanDerWaalsContact O-NE2 3.14Å
263	D	98.6	Very high	97.8	Very high	34 Å²	34	40.1 Å²	40.1	18%	0.182	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-90.4	-11.4	177.4	-69	-4.1	0	0	0	112	K259 P260 S261 L266 H285	K259-D263 VanDerWaalsContact CD-OD2 3.27Å; K259-D263 WeakPolarHBondContact CD-OD2 3.47Å; K259-D263 WeakPolarHBondContact CE-OD2 3.17Å; K259-D263 IonicContact NZ-OD2 3.84Å; K259-D263 PolarHBondContact NZ-OD2 2.82Å; P260-D263 PolarHBondContact O-N 2.78Å; S261-D263 VanDerWaalsContact C-N 3.28Å; S261-D263 PolarHBondContact O-N 2.7Å; D263-L266 WeakPolarHBondContact O-CB 3.42Å; D263-L266 PolarHBondContact O-N 3.37Å; D263-L266 VanDerWaalsContact O-N 3.14Å; D263-H285 IonicContact OD1-CE1 2.79Å; D263-H285 PolarHBondContact OD1-CE1 2.99Å; D263-H285 IonicContact OD1-NE2 2.84Å; D263-H285 PolarHBondContact OD1-NE2 3.27Å
264	L	98.8	Very high	97.8	Very high	7 Å²	7	43.5 Å²	43.5	4%	0.037	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-43.1	-179.7	-67.7	174.6	0	0	0	114.1	I150 L171 L236 A239 D240 S243 P260 S261 L266 L267	I150-L264 HydrophobicContact CG2-CD1 3.98Å; L171-L264 HydrophobicContact CD1-CD1 3.56Å; L236-L264 HydrophobicContact CD1-CD2 4.47Å; A239-L264 HydrophobicContact CB-CD1 3.91Å; D240-L264 HydrophobicContact CB-CD2 4.47Å; S243-L264 WeakPolarHBondContact CB-O 3.47Å; P260-L264 PolarHBondContact O-N 2.82Å; S261-L264 WeakPolarHBondContact O-CB 3.28Å; S261-L264 PolarHBondContact O-N 2.68Å; L264-L266 PolarHBondContact O-N 2.85Å; L264-L267 HydrophobicContact CD2-CD1 3.62Å; L264-L267 VanDerWaalsContact O-CB 3.23Å; L264-L267 WeakPolarHBondContact O-CB 3.26Å; L264-L267 PolarHBondContact O-N 3.37Å
265	P	98.7	Very high	97.9	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.013	22%	0.221	C	C	.	.	H	α-helix	trans	-57.2	-25.5	175.8	-23.2	32.4	0	0	0	113.5	H89 A249 T251 M256 L267 T268 V275	H89-P265 HydrophobicContact CB-CG 4.28Å; A249-P265 HydrophobicContact CB-CB 4.28Å; T251-P265 HydrophobicContact CG2-CB 3.86Å; T251-P265 HydrophobicContact CG2-CG 3.6Å; M256-P265 HydrophobicContact SD-CG 3.91Å; P265-L267 VanDerWaalsContact C-N 3.26Å; P265-L267 PolarHBondContact O-N 3.31Å; P265-T268 WeakPolarHBondContact O-CB 3.41Å; P265-T268 PolarHBondContact O-N 2.85Å; P265-V275 HydrophobicContact CB-CG1 4.21Å; P265-V275 VanDerWaalsContact O-CG2 3.3Å; P265-V275 WeakPolarHBondContact O-CG2 3.49Å
266	L	98.6	Very high	97.9	Very high	22 Å²	22	42.6 Å²	42.6	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-72.9	-18.7	177.6	-57	-177.3	0	0	0	113	D263 L264 T268 K269 R270 H285 H288	D263-L266 WeakPolarHBondContact O-CB 3.42Å; D263-L266 PolarHBondContact O-N 3.37Å; D263-L266 VanDerWaalsContact O-N 3.14Å; L264-L266 PolarHBondContact O-N 2.85Å; L266-T268 VanDerWaalsContact C-N 3.29Å; L266-K269 PolarHBondContact O-N 3.07Å; L266-R270 WeakPolarHBondContact O-CG 3.39Å; L266-R270 PolarHBondContact O-N 3.04Å; L266-H285 HydrophobicContact CD2-CB 4.03Å; L266-H288 HydrophobicContact CD2-CB 3.66Å
267	L	98.6	Very high	97.9	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-40.9	172.2	-67.5	166.6	0	0	0	111	D240 R244 L264 P265 R270 K271	D240-L267 HydrophobicContact CB-CD1 4.4Å; D240-L267 VanDerWaalsContact OD2-CD1 3.24Å; D240-L267 WeakPolarHBondContact OD2-CD1 3.33Å; R244-L267 HydrophobicContact CG-CB 4.08Å; R244-L267 HydrophobicContact CG-CD1 4.36Å; R244-L267 HydrophobicContact CG-CD2 4.13Å; R244-L267 HydrophobicContact CG-CG 4.44Å; L264-L267 HydrophobicContact CD2-CD1 3.62Å; L264-L267 VanDerWaalsContact O-CB 3.23Å; L264-L267 WeakPolarHBondContact O-CB 3.26Å; L264-L267 PolarHBondContact O-N 3.37Å; P265-L267 VanDerWaalsContact C-N 3.26Å; P265-L267 PolarHBondContact O-N 3.31Å; L267-R270 VanDerWaalsContact CG-NH2 3.26Å; L267-R270 PolarHBondContact O-N 3.41Å; L267-K271 PolarHBondContact O-N 2.99Å
268	T	98.6	Very high	98	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.8	-49.8	174.8	-52.5	0	0	0	0	110.7	S243 A246 A249 P265 L266 R270 K271 G272 G273	S243-T268 VanDerWaalsContact O-CA 3.27Å; S243-T268 WeakPolarHBondContact O-CA 3.38Å; S243-T268 PolarHBondContact O-N 2.61Å; S243-T268 PolarHBondContact O-OG1 2.85Å; A246-T268 HydrophobicContact CB-CG2 3.8Å; A246-T268 WeakPolarHBondContact O-CG2 3.48Å; A249-T268 HydrophobicContact CB-CG2 3.89Å; P265-T268 WeakPolarHBondContact O-CB 3.41Å; P265-T268 PolarHBondContact O-N 2.85Å; L266-T268 VanDerWaalsContact C-N 3.29Å; T268-R270 VanDerWaalsContact C-N 3.35Å; T268-R270 PolarHBondContact O-N 3.19Å; T268-K271 PolarHBondContact O-N 3.33Å; T268-G272 PolarHBondContact O-N 3.04Å; T268-G273 WeakPolarHBondContact O-CA 3.32Å; T268-G273 PolarHBondContact O-N 2.97Å
269	K	97.6	Very high	98.1	Very high	86 Å²	86	39.6 Å²	39.6	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-42.4	176.7	-172.2	167.5	-172	160	0	113.1	L266 K271 G272 G273 V275 H288	L266-K269 PolarHBondContact O-N 3.07Å; K269-K271 PolarHBondContact O-N 3.21Å; K269-K271 VanDerWaalsContact O-N 3.16Å; K269-G272 PolarHBondContact O-N 3.27Å; K269-G273 WeakPolarHBondContact CA-O 3.31Å; K269-V275 HydrophobicContact CB-CG2 3.94Å; K269-H288 HydrophobicContact CD-CB 3.99Å; K269-H288 WeakPolarHBondContact CD-O 3.12Å; K269-H288 PolarHBondContact NZ-O 3.25Å
270	R	97.3	Very high	98.2	Very high	160 Å²	160	34.7 Å²	34.7	60%	0.604	18%	0.182	S	C	*	.	H	α-helix	trans	-62.1	-20.1	178.2	-78.6	-173	-72.4	-100.2	0.7	113.4	L266 L267 T268	L266-R270 WeakPolarHBondContact O-CG 3.39Å; L266-R270 PolarHBondContact O-N 3.04Å; L267-R270 VanDerWaalsContact CG-NH2 3.26Å; L267-R270 PolarHBondContact O-N 3.41Å; T268-R270 VanDerWaalsContact C-N 3.35Å; T268-R270 PolarHBondContact O-N 3.19Å
271	K	96.5	Very high	98.3	Very high	142 Å²	142	32.9 Å²	32.9	62%	0.617	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	7.5	176.9	-67.4	-65.7	-171.1	177.1	0	113.5	L267 T268 K269	L267-K271 PolarHBondContact O-N 2.99Å; T268-K271 PolarHBondContact O-N 3.33Å; K269-K271 PolarHBondContact O-N 3.21Å; K269-K271 VanDerWaalsContact O-N 3.16Å
272	G	97.2	Very high	98.4	Very high	71 Å²	71	35.2 Å²	35.2	73%	0.732	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	92.7	-1.7	179.4	0	0	0	0	0	114.3	T268 K269	T268-G272 PolarHBondContact O-N 3.04Å; K269-G272 PolarHBondContact O-N 3.27Å
273	G	98.6	Very high	98.4	Very high	12 Å²	12	35.8 Å²	35.8	12%	0.124	19%	0.187	C	C	.	.			trans	-72.5	167.7	175	0	0	0	0	0	113.4	D247 T268 K269	D247-G273 CarbonylContact O-C 3.45Å; D247-G273 WeakPolarHBondContact O-CA 3.47Å; T268-G273 WeakPolarHBondContact O-CA 3.32Å; T268-G273 PolarHBondContact O-N 2.97Å; K269-G273 WeakPolarHBondContact CA-O 3.31Å
274	K	98.9	Very high	98.4	Very high	77 Å²	77	38.7 Å²	38.7	34%	0.335	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	149.3	178.6	-67.1	170	-179.8	174.7	0	110.5	L79 D247 L248 A249 H290	L79-K274 HydrophobicContact CD2-CD 3.47Å; L79-K274 VanDerWaalsContact CD2-CD 3.47Å; L79-K274 VanDerWaalsContact CD2-NZ 3.25Å; D247-K274 PolarHBondContact O-N 2.86Å; L248-K274 WeakPolarHBondContact CA-O 3.43Å; L248-K274 HydrophobicContact CD1-CB 3.99Å; A249-K274 PolarHBondContact N-O 2.6Å; K274-H290 HydrophobicContact CB-CB 4.03Å; K274-H290 HydrophobicContact CG-CB 4.28Å
275	V	98.9	Very high	98.4	Very high	3 Å²	3	39 Å²	39	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.9	174.8	-179.7	0	0	0	0	108.4	A249 P265 K269 I277 A289 H290	A249-V275 HydrophobicContact CB-CG2 4.35Å; A249-V275 CarbonylContact O-C 3.55Å; A249-V275 WeakPolarHBondContact O-CA 3.28Å; P265-V275 HydrophobicContact CB-CG1 4.21Å; P265-V275 VanDerWaalsContact O-CG2 3.3Å; P265-V275 WeakPolarHBondContact O-CG2 3.49Å; K269-V275 HydrophobicContact CB-CG2 3.94Å; V275-I277 HydrophobicContact CG1-CG1 4.13Å; V275-A289 CarbonylContact O-C 3.59Å; V275-A289 WeakPolarHBondContact O-CA 3.35Å; V275-H290 PolarHBondContact O-N 3.35Å
276	V	98.9	Very high	98.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	134.8	172.4	-177.1	0	0	0	0	108.6	L76 L79 L248 A249 L250 T251 L291 I293	L76-V276 HydrophobicContact CD1-CB 4.35Å; L76-V276 HydrophobicContact CD1-CG1 4.09Å; L76-V276 HydrophobicContact CD1-CG2 4.2Å; L79-V276 HydrophobicContact CD1-CG2 3.76Å; L248-V276 HydrophobicContact CD1-CG2 3.87Å; A249-V276 PolarHBondContact O-N 3.13Å; L250-V276 HydrophobicContact CD1-CB 3.9Å; L250-V276 HydrophobicContact CD1-CG1 3.85Å; T251-V276 PolarHBondContact N-O 3.08Å; V276-L291 WeakPolarHBondContact CA-O 3.48Å; V276-L291 HydrophobicContact CB-CB 4.5Å; V276-L291 HydrophobicContact CG1-CB 4.03Å; V276-L291 HydrophobicContact CG1-CD2 4.05Å; V276-L291 HydrophobicContact CG1-CG 4.13Å; V276-L291 HydrophobicContact CG2-CB 4.08Å; V276-I293 HydrophobicContact CG1-CD1 4.48Å
277	I	98.9	Very high	98.4	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	121.7	-179.7	-57.3	-176.3	0	0	0	109.2	T251 M256 V275 N279 T283 A289 L291 R292 I293	T251-I277 WeakPolarHBondContact OG1-CA 2.98Å; M256-I277 HydrophobicContact CE-CD1 3.68Å; V275-I277 HydrophobicContact CG1-CG1 4.13Å; I277-N279 HydrophobicContact CG2-CB 4.32Å; I277-T283 HydrophobicContact CG2-CG2 3.61Å; I277-A289 HydrophobicContact CB-CB 4.5Å; I277-A289 HydrophobicContact CD1-CB 3.82Å; I277-A289 HydrophobicContact CG1-CB 3.94Å; I277-L291 PolarHBondContact N-O 3.11Å; I277-R292 HydrophobicContact CB-CG 4.46Å; I277-R292 CarbonylContact O-C 3.56Å; I277-R292 WeakPolarHBondContact O-CA 3.48Å; I277-I293 PolarHBondContact O-N 3.49Å
278	V	98.9	Very high	98.4	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	106.2	172.2	-170.4	0	0	0	0	108.5	L250 T251 L252 G253 I293 V297 V300	L250-V278 HydrophobicContact CD1-CG2 3.81Å; T251-V278 PolarHBondContact O-N 2.68Å; L252-V278 HydrophobicContact CD2-CB 3.73Å; L252-V278 HydrophobicContact CD2-CG1 4.43Å; L252-V278 HydrophobicContact CD2-CG2 3.74Å; G253-V278 PolarHBondContact N-O 2.86Å; V278-I293 WeakPolarHBondContact CA-O 3.25Å; V278-I293 HydrophobicContact CG1-CB 4.29Å; V278-I293 HydrophobicContact CG2-CB 4.15Å; V278-I293 HydrophobicContact CG2-CD1 4.21Å; V278-I293 HydrophobicContact CG2-CG1 4.33Å; V278-V297 HydrophobicContact CB-CG1 4.5Å; V278-V297 HydrophobicContact CG1-CG1 3.94Å; V278-V300 HydrophobicContact CG1-CB 4.18Å; V278-V300 HydrophobicContact CG1-CG1 4.07Å; V278-V300 HydrophobicContact CG1-CG2 3.88Å; V278-V300 HydrophobicContact CG2-CG1 4.24Å
279	N	98.9	Very high	98.4	Very high	17 Å²	17	51 Å²	51	9%	0.091	26%	0.257	C	S	.	.			trans	-158.7	144.5	-179.2	-157.3	60	0	0	0	110.8	G253 T254 I277 Q281 T283 I293 N294	G253-N279 WeakPolarHBondContact CA-OD1 3.29Å; T254-N279 PolarHBondContact N-OD1 3.21Å; I277-N279 HydrophobicContact CG2-CB 4.32Å; N279-Q281 PolarHBondContact ND2-N 2.95Å; N279-Q281 PolarHBondContact ND2-O 3.18Å; N279-T283 HydrophobicContact CB-CG2 3.86Å; N279-I293 PolarHBondContact N-O 2.92Å; N279-I293 VanDerWaalsContact N-O 3.14Å; N279-N294 PolarHBondContact O-ND2 3.19Å
280	L	98.7	Very high	98.4	Very high	26 Å²	26	52.2 Å²	52.2	14%	0.136	26%	0.263	C	S	.	.	S	Bend	trans	-71.6	-40.4	175.5	-69.6	175.5	0	0	0	112	E61 S62 F63 Y296	E61-L280 WeakPolarHBondContact CA-O 3.33Å; E61-L280 HydrophobicContact CB-CB 4.18Å; E61-L280 HydrophobicContact CG-CB 3.95Å; S62-L280 PolarHBondContact N-O 3.41Å; F63-L280 HydrophobicContact CD1-CD2 3.76Å; F63-L280 HydrophobicContact CE1-CD1 4.37Å; F63-L280 HydrophobicContact CE1-CD2 3.45Å; F63-L280 VanDerWaalsContact CE1-CD2 3.45Å; F63-L280 HydrophobicContact CZ-CD2 4.15Å; L280-Y296 HydrophobicContact CD1-CD1 3.86Å; L280-Y296 HydrophobicContact CD1-CE1 3.71Å
281	Q	98.6	Very high	98.5	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.065	24%	0.241	C	C	.	.	S	Bend	trans	-92.8	159.4	179.6	-65.4	179.2	-47.4	0	0	111.8	L59 E61 R104 N279	L59-Q281 PolarHBondContact O-NE2 3.28Å; E61-Q281 HydrophobicContact CG-CG 3.94Å; R104-Q281 PolarHBondContact O-NE2 2.97Å; R104-Q281 VanDerWaalsContact O-NE2 3.13Å; R104-Q281 PolarHBondContact O-OE1 3.47Å; N279-Q281 PolarHBondContact ND2-N 2.95Å; N279-Q281 PolarHBondContact ND2-O 3.18Å
282	P	98.5	Very high	98.6	Very high	52 Å²	52	44.6 Å²	44.6	34%	0.338	23%	0.233	S	C	.	.			trans	-55.4	141.6	167	-23.9	33.8	0	0	0	112.1	L59 P60	L59-P282 HydrophobicContact CD1-CB 4.3Å; L59-P282 HydrophobicContact CD1-CG 4.41Å; P60-P282 WeakPolarHBondContact O-CD 3.38Å
283	T	98.8	Very high	98.7	Very high	13 Å²	13	41.2 Å²	41.2	8%	0.08	20%	0.198	C	C	.	.			trans	-107.5	162.1	174.7	81	0	0	0	0	111.3	T254 M256 I277 N279 H285 D286	T254-T283 WeakPolarHBondContact O-CG2 3.46Å; M256-T283 VanDerWaalsContact CE-OG1 3.3Å; M256-T283 WeakPolarHBondContact CE-OG1 3.42Å; I277-T283 HydrophobicContact CG2-CG2 3.61Å; N279-T283 HydrophobicContact CB-CG2 3.86Å; T283-H285 PolarHBondContact O-N 3.21Å; T283-H285 VanDerWaalsContact O-N 3.12Å; T283-H285 PolarHBondContact OG1-N 3.49Å; T283-D286 WeakPolarHBondContact CA-OD1 3.42Å; T283-D286 VanDerWaalsContact CB-OD1 3.32Å; T283-D286 WeakPolarHBondContact CB-OD1 3.38Å; T283-D286 PolarHBondContact N-OD1 3.42Å; T283-D286 PolarHBondContact O-N 3.06Å; T283-D286 PolarHBondContact OG1-N 3.42Å; T283-D286 PolarHBondContact OG1-OD1 3.41Å
284	K	98.4	Very high	98.7	Very high	95 Å²	95	41.9 Å²	41.9	41%	0.413	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.3	177.7	-171.6	173.7	-173.7	169.9	0	113.6	S255 M256 Q257	S255-K284 PolarHBondContact O-N 2.93Å; M256-K284 HydrophobicContact CB-CB 4.46Å; M256-K284 WeakPolarHBondContact O-CB 2.96Å; M256-K284 WeakPolarHBondContact O-CD 3.23Å; Q257-K284 PolarHBondContact O-NZ 3.02Å
285	H	98.4	Very high	98.7	Very high	15 Å²	15	38.5 Å²	38.5	7%	0.069	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.8	25	-171.6	-49.6	-57.3	0	0	0	114	M256 G262 D263 L266 T283 K287 H288	M256-H285 HydrophobicContact CE-CB 3.46Å; M256-H285 VanDerWaalsContact CE-CB 3.46Å; G262-H285 PolarHBondContact O-CD2 2.82Å; G262-H285 PolarHBondContact O-NE2 3.32Å; G262-H285 VanDerWaalsContact O-NE2 3.14Å; D263-H285 IonicContact OD1-CE1 2.79Å; D263-H285 PolarHBondContact OD1-CE1 2.99Å; D263-H285 IonicContact OD1-NE2 2.84Å; D263-H285 PolarHBondContact OD1-NE2 3.27Å; L266-H285 HydrophobicContact CD2-CB 4.03Å; T283-H285 PolarHBondContact O-N 3.21Å; T283-H285 VanDerWaalsContact O-N 3.12Å; T283-H285 PolarHBondContact OG1-N 3.49Å; H285-K287 PolarHBondContact O-N 3.4Å; H285-K287 VanDerWaalsContact O-N 3.16Å; H285-H288 HydrophobicContact CB-CB 4.44Å; H285-H288 WeakPolarHBondContact O-CA 3.41Å; H285-H288 WeakPolarHBondContact O-CB 3.06Å; H285-H288 PolarHBondContact O-N 3.31Å
286	D	98.6	Very high	98.7	Very high	30 Å²	30	44.4 Å²	44.4	16%	0.16	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-48.5	-42.7	176.7	-88	18.2	0	0	0	113.3	T283 H288 A289 R292	T283-D286 WeakPolarHBondContact CA-OD1 3.42Å; T283-D286 VanDerWaalsContact CB-OD1 3.32Å; T283-D286 WeakPolarHBondContact CB-OD1 3.38Å; T283-D286 PolarHBondContact N-OD1 3.42Å; T283-D286 PolarHBondContact O-N 3.06Å; T283-D286 PolarHBondContact OG1-N 3.42Å; T283-D286 PolarHBondContact OG1-OD1 3.41Å; D286-H288 PolarHBondContact O-N 3.13Å; D286-A289 WeakPolarHBondContact O-CB 3.21Å; D286-A289 PolarHBondContact O-N 3.15Å; D286-A289 VanDerWaalsContact O-N 3.07Å; D286-R292 IonicContact OD2-CZ 3.43Å; D286-R292 IonicContact OD2-NH1 2.87Å; D286-R292 PolarHBondContact OD2-NH1 2.93Å
287	K	98.3	Very high	98.7	Very high	174 Å²	174	45 Å²	45	76%	0.757	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-61.9	-15	178.1	70.2	-177.9	-176.8	-179.3	0	114.3	H285	H285-K287 PolarHBondContact O-N 3.4Å; H285-K287 VanDerWaalsContact O-N 3.16Å
288	H	98.2	Very high	98.7	Very high	58 Å²	58	46.1 Å²	46.1	27%	0.269	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-99.2	-9.4	179.6	-62.6	-67.2	0	0	0	113.1	L266 K269 H285 D286	L266-H288 HydrophobicContact CD2-CB 3.66Å; K269-H288 HydrophobicContact CD-CB 3.99Å; K269-H288 WeakPolarHBondContact CD-O 3.12Å; K269-H288 PolarHBondContact NZ-O 3.25Å; H285-H288 HydrophobicContact CB-CB 4.44Å; H285-H288 WeakPolarHBondContact O-CA 3.41Å; H285-H288 WeakPolarHBondContact O-CB 3.06Å; H285-H288 PolarHBondContact O-N 3.31Å; D286-H288 PolarHBondContact O-N 3.13Å
289	A	98.5	Very high	98.7	Very high	23 Å²	23	49.9 Å²	49.9	19%	0.19	24%	0.238	C	C	.	.			trans	-65.8	139.1	178.9	0	0	0	0	0	111.9	V275 I277 D286 R292	V275-A289 CarbonylContact O-C 3.59Å; V275-A289 WeakPolarHBondContact O-CA 3.35Å; I277-A289 HydrophobicContact CB-CB 4.5Å; I277-A289 HydrophobicContact CD1-CB 3.82Å; I277-A289 HydrophobicContact CG1-CB 3.94Å; D286-A289 WeakPolarHBondContact O-CB 3.21Å; D286-A289 PolarHBondContact O-N 3.15Å; D286-A289 VanDerWaalsContact O-N 3.07Å; A289-R292 HydrophobicContact CB-CG 3.46Å; A289-R292 VanDerWaalsContact CB-CG 3.46Å
290	H	98.8	Very high	98.7	Very high	110 Å²	110	49 Å²	49	51%	0.509	23%	0.234	S	C	.	.	S	Bend	trans	-76.7	-37.2	162.8	179.6	72.7	0	0	0	110.7	K274 V275	K274-H290 HydrophobicContact CB-CB 4.03Å; K274-H290 HydrophobicContact CG-CB 4.28Å; V275-H290 PolarHBondContact O-N 3.35Å
291	L	98.9	Very high	98.7	Very high	26 Å²	26	47.8 Å²	47.8	14%	0.136	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	134.7	177.1	177.8	64.5	0	0	0	109.2	K72 L76 L79 V276 I277 I293	K72-L291 HydrophobicContact CB-CD1 4.23Å; K72-L291 HydrophobicContact CD-CD1 4.45Å; K72-L291 HydrophobicContact CG-CD1 3.97Å; L76-L291 HydrophobicContact CB-CD2 4.2Å; L79-L291 HydrophobicContact CD1-CD2 4.38Å; V276-L291 WeakPolarHBondContact CA-O 3.48Å; V276-L291 HydrophobicContact CB-CB 4.5Å; V276-L291 HydrophobicContact CG1-CB 4.03Å; V276-L291 HydrophobicContact CG1-CD2 4.05Å; V276-L291 HydrophobicContact CG1-CG 4.13Å; V276-L291 HydrophobicContact CG2-CB 4.08Å; I277-L291 PolarHBondContact N-O 3.11Å; L291-I293 HydrophobicContact CD2-CD1 4.05Å; L291-I293 HydrophobicContact CD2-CG1 4.22Å; L291-I293 HydrophobicContact CG-CD1 4.44Å; L291-I293 HydrophobicContact CG-CG1 4.06Å
292	R	98.8	Very high	98.7	Very high	117 Å²	117	52 Å²	52	44%	0.442	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.6	171.1	-65.6	-171.9	-63.5	169.7	1.1	109.2	K72 I277 D286 A289	K72-R292 WeakPolarHBondContact CD-O 3.38Å; K72-R292 VanDerWaalsContact CE-O 3.31Å; K72-R292 WeakPolarHBondContact CE-O 3.22Å; K72-R292 PolarHBondContact NZ-O 3.3Å; K72-R292 VanDerWaalsContact NZ-O 3.16Å; I277-R292 HydrophobicContact CB-CG 4.46Å; I277-R292 CarbonylContact O-C 3.56Å; I277-R292 WeakPolarHBondContact O-CA 3.48Å; D286-R292 IonicContact OD2-CZ 3.43Å; D286-R292 IonicContact OD2-NH1 2.87Å; D286-R292 PolarHBondContact OD2-NH1 2.93Å; A289-R292 HydrophobicContact CB-CG 3.46Å; A289-R292 VanDerWaalsContact CB-CG 3.46Å
293	I	98.9	Very high	98.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.1	178.2	-45.7	-171.8	0	0	0	107.8	L69 K72 L76 V276 I277 V278 N279 L291 V300	L69-I293 HydrophobicContact CD1-CG2 3.44Å; L69-I293 VanDerWaalsContact CD1-CG2 3.44Å; K72-I293 HydrophobicContact CB-CD1 4.1Å; K72-I293 HydrophobicContact CB-CG1 4.02Å; K72-I293 HydrophobicContact CB-CG2 4.46Å; K72-I293 HydrophobicContact CD-CG1 4.4Å; L76-I293 HydrophobicContact CB-CD1 4.2Å; L76-I293 HydrophobicContact CD2-CD1 3.99Å; V276-I293 HydrophobicContact CG1-CD1 4.48Å; I277-I293 PolarHBondContact O-N 3.49Å; V278-I293 WeakPolarHBondContact CA-O 3.25Å; V278-I293 HydrophobicContact CG1-CB 4.29Å; V278-I293 HydrophobicContact CG2-CB 4.15Å; V278-I293 HydrophobicContact CG2-CD1 4.21Å; V278-I293 HydrophobicContact CG2-CG1 4.33Å; N279-I293 PolarHBondContact N-O 2.92Å; N279-I293 VanDerWaalsContact N-O 3.14Å; L291-I293 HydrophobicContact CD2-CD1 4.05Å; L291-I293 HydrophobicContact CD2-CG1 4.22Å; L291-I293 HydrophobicContact CG-CD1 4.44Å; L291-I293 HydrophobicContact CG-CG1 4.06Å; I293-V300 HydrophobicContact CG2-CG2 3.82Å
294	N	98.8	Very high	98.7	Very high	26 Å²	26	51.5 Å²	51.5	14%	0.139	24%	0.237	C	C	.	.			trans	-103.7	86	-177.8	-69.6	87.1	0	0	0	108.2	S62 F63 D64 N279	S62-N294 WeakPolarHBondContact O-CB 3.19Å; F63-N294 CarbonylContact C-O 3.57Å; F63-N294 WeakPolarHBondContact CA-O 3.29Å; D64-N294 PolarHBondContact N-O 3.15Å; D64-N294 PolarHBondContact OD2-N 2.95Å; N279-N294 PolarHBondContact O-ND2 3.19Å
295	G	98.6	Very high	98.7	Very high	6 Å²	6	47 Å²	47	6%	0.062	22%	0.218	C	C	.	.	S	Bend	trans	-162.5	169.5	-178.4	0	0	0	0	0	112.2	V297	G295-V297 PolarHBondContact O-N 3.15Å
296	Y	98.8	Very high	98.7	Very high	126 Å²	126	52.1 Å²	52.1	49%	0.494	24%	0.242	S	C	.	.			trans	-63.3	130.6	172.7	-64.7	-73.9	0	0	0	109.5	F63 L280 D298 D299 V300	F63-Y296 HydrophobicContact CD1-CE2 4.47Å; F63-Y296 AromaticContact CE1-CE2 3.93Å; F63-Y296 HydrophobicContact CE1-CE2 3.93Å; F63-Y296 AromaticContact CE1-CZ 3.87Å; L280-Y296 HydrophobicContact CD1-CD1 3.86Å; L280-Y296 HydrophobicContact CD1-CE1 3.71Å; Y296-D298 PolarHBondContact O-N 2.8Å; Y296-D299 PolarHBondContact O-N 3.02Å; Y296-D299 VanDerWaalsContact O-N 3.13Å; Y296-V300 PolarHBondContact O-N 3.24Å; Y296-V300 VanDerWaalsContact O-N 3.08Å
297	V	98.8	Very high	98.7	Very high	14 Å²	14	53.8 Å²	53.8	9%	0.085	25%	0.25	C	S	.	.	H	α-helix	trans	-60.4	-35	-177.6	-69.8	0	0	0	0	112.2	I94 T133 L252 V278 G295 D299 V300 M301	I94-V297 HydrophobicContact CB-CG2 4.41Å; I94-V297 HydrophobicContact CG2-CG2 4.2Å; T133-V297 PolarHBondContact OG1-O 2.89Å; L252-V297 HydrophobicContact CB-CG1 4.36Å; V278-V297 HydrophobicContact CB-CG1 4.5Å; V278-V297 HydrophobicContact CG1-CG1 3.94Å; G295-V297 PolarHBondContact O-N 3.15Å; V297-D299 PolarHBondContact O-N 3.3Å; V297-V300 PolarHBondContact O-N 2.87Å; V297-M301 VanDerWaalsContact O-CB 3.29Å; V297-M301 WeakPolarHBondContact O-CB 3.07Å; V297-M301 WeakPolarHBondContact O-CG 3.2Å; V297-M301 PolarHBondContact O-N 3.01Å
298	D	98.9	Very high	98.7	Very high	27 Å²	27	46.3 Å²	46.3	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-65.3	-38.8	177	-75.9	-14.3	0	0	0	112.1	S97 L132 T133 Y296 K302	S97-D298 VanDerWaalsContact CB-OD2 3.23Å; S97-D298 WeakPolarHBondContact CB-OD2 3.24Å; S97-D298 PolarHBondContact OG-OD2 2.84Å; L132-D298 HydrophobicContact CB-CB 4.19Å; L132-D298 WeakPolarHBondContact CD2-O 3.42Å; T133-D298 VanDerWaalsContact CB-OD1 3.29Å; T133-D298 WeakPolarHBondContact CB-OD1 3.28Å; T133-D298 PolarHBondContact N-OD1 3.14Å; T133-D298 PolarHBondContact OG1-N 3.2Å; T133-D298 PolarHBondContact OG1-OD1 3.08Å; Y296-D298 PolarHBondContact O-N 2.8Å; D298-K302 WeakPolarHBondContact O-CB 3.29Å; D298-K302 PolarHBondContact O-N 2.95Å
299	D	98.8	Very high	98.8	Very high	78 Å²	78	46.8 Å²	46.8	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-68.1	-43	176.5	-66.2	-28.4	0	0	0	111.5	Y296 V297 Q303	Y296-D299 PolarHBondContact O-N 3.02Å; Y296-D299 VanDerWaalsContact O-N 3.13Å; V297-D299 PolarHBondContact O-N 3.3Å; D299-Q303 WeakPolarHBondContact O-CG 3.2Å; D299-Q303 PolarHBondContact O-N 3.35Å; D299-Q303 VanDerWaalsContact O-N 3.11Å
300	V	98.9	Very high	98.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-49.5	176	168	0	0	0	0	110.9	L69 V73 L76 V278 I293 Y296 V297 Q303 L304	L69-V300 HydrophobicContact CD1-CG2 3.77Å; V73-V300 HydrophobicContact CG2-CB 4.42Å; V73-V300 HydrophobicContact CG2-CG1 4.11Å; V73-V300 HydrophobicContact CG2-CG2 4.28Å; L76-V300 HydrophobicContact CD2-CG1 4.25Å; V278-V300 HydrophobicContact CG1-CB 4.18Å; V278-V300 HydrophobicContact CG1-CG1 4.07Å; V278-V300 HydrophobicContact CG1-CG2 3.88Å; V278-V300 HydrophobicContact CG2-CG1 4.24Å; I293-V300 HydrophobicContact CG2-CG2 3.82Å; Y296-V300 PolarHBondContact O-N 3.24Å; Y296-V300 VanDerWaalsContact O-N 3.08Å; V297-V300 PolarHBondContact O-N 2.87Å; V300-Q303 PolarHBondContact O-N 3.41Å; V300-L304 VanDerWaalsContact O-CB 3.24Å; V300-L304 WeakPolarHBondContact O-CB 3.27Å; V300-L304 PolarHBondContact O-N 2.9Å
301	M	98.9	Very high	98.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-69	-35.1	-177.4	-68	-60.2	-63.6	0	0	111.7	L132 T133 A136 L137 L140 L252 V297 L304 M305	L132-M301 HydrophobicContact CD2-CB 4.11Å; T133-M301 HydrophobicContact CG2-CG 3.97Å; A136-M301 HydrophobicContact CB-CB 4.05Å; A136-M301 HydrophobicContact CB-CE 3.75Å; L137-M301 HydrophobicContact CD2-CE 4.11Å; L137-M301 HydrophobicContact CG-CE 4.41Å; L140-M301 HydrophobicContact CD1-CE 3.67Å; L252-M301 HydrophobicContact CD1-SD 4.03Å; L252-M301 HydrophobicContact CD2-SD 4.35Å; V297-M301 VanDerWaalsContact O-CB 3.29Å; V297-M301 WeakPolarHBondContact O-CB 3.07Å; V297-M301 WeakPolarHBondContact O-CG 3.2Å; V297-M301 PolarHBondContact O-N 3.01Å; M301-L304 HydrophobicContact CE-CD2 4.24Å; M301-L304 PolarHBondContact O-N 3.43Å; M301-L304 HydrophobicContact SD-CD2 3.99Å; M301-M305 WeakPolarHBondContact O-CB 3.32Å; M301-M305 WeakPolarHBondContact O-CG 3.37Å; M301-M305 PolarHBondContact O-N 3.1Å
302	K	98.8	Very high	98.6	Very high	102 Å²	102	50.9 Å²	50.9	44%	0.443	26%	0.261	S	S	.	.	H	α-helix	trans	-60.7	-54.1	173.6	-176.8	-177.1	176.1	-171.2	0	111.4	L132 D298 L304 M305 E306	L132-K302 HydrophobicContact CD1-CB 4.14Å; L132-K302 HydrophobicContact CD1-CD 4.48Å; L132-K302 HydrophobicContact CD1-CG 4.43Å; L132-K302 HydrophobicContact CD2-CB 4.1Å; D298-K302 WeakPolarHBondContact O-CB 3.29Å; D298-K302 PolarHBondContact O-N 2.95Å; K302-L304 VanDerWaalsContact C-N 3.28Å; K302-L304 PolarHBondContact O-N 2.88Å; K302-M305 PolarHBondContact O-N 2.68Å; K302-E306 VanDerWaalsContact CE-OE1 3.28Å; K302-E306 WeakPolarHBondContact CE-OE1 3.34Å; K302-E306 WeakPolarHBondContact O-CG 3.13Å; K302-E306 PolarHBondContact O-N 2.55Å; K302-E306 VanDerWaalsContact O-N 3.08Å
303	Q	98.8	Very high	98.6	Very high	54 Å²	54	46.7 Å²	46.7	25%	0.252	25%	0.249	S	C	.	.	H	α-helix	trans	-60.9	-38.8	178	-72.5	-177.7	54.5	0	0	111.9	V73 D299 V300 E306 L307	V73-Q303 HydrophobicContact CB-CB 4.45Å; V73-Q303 HydrophobicContact CG1-CB 3.81Å; D299-Q303 WeakPolarHBondContact O-CG 3.2Å; D299-Q303 PolarHBondContact O-N 3.35Å; D299-Q303 VanDerWaalsContact O-N 3.11Å; V300-Q303 PolarHBondContact O-N 3.41Å; Q303-E306 PolarHBondContact O-N 2.8Å; Q303-L307 VanDerWaalsContact O-CG 3.32Å; Q303-L307 WeakPolarHBondContact O-CG 3.45Å; Q303-L307 PolarHBondContact O-N 2.81Å
304	L	98.9	Very high	98.5	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-48.5	176.6	175.2	62	0	0	0	111.8	V73 L76 A77 I80 V300 M301 K302 E306 L307 L308	V73-L304 HydrophobicContact CG1-CB 3.97Å; L76-L304 HydrophobicContact CD2-CD2 4.08Å; L76-L304 HydrophobicContact CG-CD1 4.21Å; L76-L304 HydrophobicContact CG-CD2 4.36Å; A77-L304 HydrophobicContact CB-CD1 3.73Å; I80-L304 HydrophobicContact CD1-CD1 3.98Å; I80-L304 HydrophobicContact CD1-CD2 3.64Å; I80-L304 HydrophobicContact CD1-CG 4.38Å; V300-L304 VanDerWaalsContact O-CB 3.24Å; V300-L304 WeakPolarHBondContact O-CB 3.27Å; V300-L304 PolarHBondContact O-N 2.9Å; M301-L304 HydrophobicContact CE-CD2 4.24Å; M301-L304 PolarHBondContact O-N 3.43Å; M301-L304 HydrophobicContact SD-CD2 3.99Å; K302-L304 VanDerWaalsContact C-N 3.28Å; K302-L304 PolarHBondContact O-N 2.88Å; L304-E306 VanDerWaalsContact C-N 3.3Å; L304-E306 PolarHBondContact O-N 2.87Å; L304-L307 PolarHBondContact O-N 3.46Å; L304-L308 HydrophobicContact CD1-CD1 3.85Å; L304-L308 HydrophobicContact CD1-CG 4.02Å; L304-L308 HydrophobicContact CG-CD1 3.96Å; L304-L308 HydrophobicContact CG-CG 4.45Å; L304-L308 WeakPolarHBondContact O-CB 3.48Å; L304-L308 VanDerWaalsContact O-CG 3.29Å; L304-L308 WeakPolarHBondContact O-CG 3.38Å; L304-L308 PolarHBondContact O-N 2.79Å
305	M	98.8	Very high	98.5	Very high	2 Å²	2	56 Å²	56	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-40	179.6	-69.1	-67.5	-72.3	0	0	111.2	A136 L140 M301 K302 L308 G309 L310 D311 I312	A136-M305 HydrophobicContact CB-CG 3.79Å; A136-M305 HydrophobicContact CB-SD 4.13Å; L140-M305 HydrophobicContact CD2-SD 3.99Å; L140-M305 HydrophobicContact CG-SD 3.82Å; M301-M305 WeakPolarHBondContact O-CB 3.32Å; M301-M305 WeakPolarHBondContact O-CG 3.37Å; M301-M305 PolarHBondContact O-N 3.1Å; K302-M305 PolarHBondContact O-N 2.68Å; M305-L308 PolarHBondContact O-N 2.8Å; M305-G309 PolarHBondContact O-N 3.45Å; M305-L310 HydrophobicContact CE-CB 3.49Å; M305-L310 VanDerWaalsContact CE-CB 3.49Å; M305-L310 HydrophobicContact CE-CD1 4.29Å; M305-L310 PolarHBondContact O-N 2.88Å; M305-L310 HydrophobicContact SD-CB 4.11Å; M305-L310 HydrophobicContact SD-CD1 4.22Å; M305-D311 VanDerWaalsContact CE-O 3.3Å; M305-D311 WeakPolarHBondContact CE-O 3.13Å; M305-I312 HydrophobicContact CB-CD1 4.18Å; M305-I312 HydrophobicContact CB-CG1 3.97Å; M305-I312 HydrophobicContact CE-CG1 3.97Å; M305-I312 HydrophobicContact CG-CD1 4.1Å; M305-I312 HydrophobicContact CG-CG1 3.85Å
306	E	98.7	Very high	98.4	Very high	122 Å²	122	64.6 Å²	64.6	57%	0.57	33%	0.325	S	S	*	.	H	α-helix	trans	-59.6	-46.8	173.3	-70.7	170.4	-171.1	0	0	111.9	K302 Q303 L304 L308 G309	K302-E306 VanDerWaalsContact CE-OE1 3.28Å; K302-E306 WeakPolarHBondContact CE-OE1 3.34Å; K302-E306 WeakPolarHBondContact O-CG 3.13Å; K302-E306 PolarHBondContact O-N 2.55Å; K302-E306 VanDerWaalsContact O-N 3.08Å; Q303-E306 PolarHBondContact O-N 2.8Å; L304-E306 VanDerWaalsContact C-N 3.3Å; L304-E306 PolarHBondContact O-N 2.87Å; E306-L308 VanDerWaalsContact C-N 3.31Å; E306-L308 PolarHBondContact O-N 2.83Å; E306-G309 PolarHBondContact O-N 3.34Å
307	L	98.8	Very high	98.2	Very high	65 Å²	65	59.2 Å²	59.2	34%	0.34	31%	0.309	S	S	.	.	H	α-helix	trans	-69.3	-25.4	179	-72	167.6	0	0	0	114.4	V73 E74 A77 K81 Q303 L304 G309	V73-L307 HydrophobicContact CG1-CD1 3.98Å; E74-L307 HydrophobicContact CB-CD1 4.48Å; E74-L307 HydrophobicContact CG-CD1 3.86Å; E74-L307 HydrophobicContact CG-CD2 4.23Å; A77-L307 HydrophobicContact CB-CB 3.94Å; A77-L307 HydrophobicContact CB-CD1 4.19Å; K81-L307 PolarHBondContact NZ-O 2.75Å; Q303-L307 VanDerWaalsContact O-CG 3.32Å; Q303-L307 WeakPolarHBondContact O-CG 3.45Å; Q303-L307 PolarHBondContact O-N 2.81Å; L304-L307 PolarHBondContact O-N 3.46Å; L307-G309 VanDerWaalsContact C-N 3.33Å
308	L	98.5	Very high	98.1	Very high	17 Å²	17	62.6 Å²	62.6	9%	0.089	33%	0.331	C	S	.	.	H	α-helix	trans	-84.4	-9.6	172.6	-65.4	178	0	0	0	112.4	A77 I80 K81 L140 L304 M305 E306 L310	A77-L308 HydrophobicContact CB-CD2 4.32Å; I80-L308 HydrophobicContact CG2-CD1 4.14Å; I80-L308 HydrophobicContact CG2-CD2 4.42Å; K81-L308 HydrophobicContact CD-CD2 4.33Å; K81-L308 HydrophobicContact CG-CD2 3.82Å; L140-L308 HydrophobicContact CD2-CD1 3.53Å; L304-L308 HydrophobicContact CD1-CD1 3.85Å; L304-L308 HydrophobicContact CD1-CG 4.02Å; L304-L308 HydrophobicContact CG-CD1 3.96Å; L304-L308 HydrophobicContact CG-CG 4.45Å; L304-L308 WeakPolarHBondContact O-CB 3.48Å; L304-L308 VanDerWaalsContact O-CG 3.29Å; L304-L308 WeakPolarHBondContact O-CG 3.38Å; L304-L308 PolarHBondContact O-N 2.79Å; M305-L308 PolarHBondContact O-N 2.8Å; E306-L308 VanDerWaalsContact C-N 3.31Å; E306-L308 PolarHBondContact O-N 2.83Å; L308-L310 VanDerWaalsContact C-N 3.32Å; L308-L310 HydrophobicContact CB-CD1 3.92Å; L308-L310 HydrophobicContact CB-CG 3.88Å; L308-L310 HydrophobicContact CD1-CD1 4.14Å
309	G	98.4	Very high	98	Very high	67 Å²	67	64.9 Å²	64.9	69%	0.691	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	34.6	-175.5	0	0	0	0	0	112.7	M305 E306 L307	M305-G309 PolarHBondContact O-N 3.45Å; E306-G309 PolarHBondContact O-N 3.34Å; L307-G309 VanDerWaalsContact C-N 3.33Å
310	L	98.3	Very high	97.9	Very high	39 Å²	39	64.4 Å²	64.4	20%	0.204	35%	0.346	C	S	.	.			trans	-111.6	134.5	-177.2	-63	178.6	0	0	0	111.3	L140 A143 Y145 M305 L308	L140-L310 HydrophobicContact CD2-CD1 3.84Å; A143-L310 HydrophobicContact CB-CD1 3.82Å; A143-L310 HydrophobicContact CB-CD2 3.64Å; A143-L310 HydrophobicContact CB-CG 4.4Å; Y145-L310 HydrophobicContact CD2-CD1 3.82Å; Y145-L310 HydrophobicContact CE2-CD1 3.84Å; Y145-L310 HydrophobicContact CE2-CD2 4.46Å; M305-L310 HydrophobicContact CE-CB 3.49Å; M305-L310 VanDerWaalsContact CE-CB 3.49Å; M305-L310 HydrophobicContact CE-CD1 4.29Å; M305-L310 PolarHBondContact O-N 2.88Å; M305-L310 HydrophobicContact SD-CB 4.11Å; M305-L310 HydrophobicContact SD-CD1 4.22Å; L308-L310 VanDerWaalsContact C-N 3.32Å; L308-L310 HydrophobicContact CB-CD1 3.92Å; L308-L310 HydrophobicContact CB-CG 3.88Å; L308-L310 HydrophobicContact CD1-CD1 4.14Å
311	D	96.9	Very high	97.7	Very high	150 Å²	150	66.4 Å²	66.4	80%	0.802	36%	0.359	S	S	*	.			trans	-74.2	144.2	170.6	-67.7	-38.3	0	0	0	111.4	M305 P313	M305-D311 VanDerWaalsContact CE-O 3.3Å; M305-D311 WeakPolarHBondContact CE-O 3.13Å; D311-P313 WeakPolarHBondContact O-CD 3.44Å
312	I	98.6	Very high	97.4	Very high	57 Å²	57	71.3 Å²	71.3	29%	0.292	38%	0.382	S	S	.	.			trans	-87.9	114.9	170.1	-59.2	178.6	0	0	0	107.8	L132 M135 A136 M305 K314	L132-I312 HydrophobicContact CD1-CD1 4.18Å; L132-I312 HydrophobicContact CD2-CD1 3.61Å; L132-I312 HydrophobicContact CG-CD1 3.8Å; M135-I312 HydrophobicContact CB-CG2 3.56Å; A136-I312 HydrophobicContact CB-CD1 4.37Å; A136-I312 HydrophobicContact CB-CG1 4.41Å; M305-I312 HydrophobicContact CB-CD1 4.18Å; M305-I312 HydrophobicContact CB-CG1 3.97Å; M305-I312 HydrophobicContact CE-CG1 3.97Å; M305-I312 HydrophobicContact CG-CD1 4.1Å; M305-I312 HydrophobicContact CG-CG1 3.85Å; I312-K314 PolarHBondContact O-N 3.45Å
313	P	97.8	Very high	96.9	Very high	29 Å²	29	68.7 Å²	68.7	19%	0.188	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-58.7	140.5	-178.6	-22.7	33	0	0	0	112.1	M135 L138 D311	M135-P313 HydrophobicContact CE-CB 4.05Å; M135-P313 WeakPolarHBondContact CE-O 3.28Å; M135-P313 WeakPolarHBondContact O-CD 3.33Å; L138-P313 HydrophobicContact CD2-CB 4.4Å; L138-P313 HydrophobicContact CD2-CG 4.45Å; L138-P313 HydrophobicContact CG-CG 4.46Å; D311-P313 WeakPolarHBondContact O-CD 3.44Å
314	K	97.6	Very high	96	Very high	181 Å²	181	68.1 Å²	68.1	79%	0.787	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-74.2	137.1	172.8	-172.1	179.1	178.1	-174.4	0	110	I312	I312-K314 PolarHBondContact O-N 3.45Å
315	W	97.9	Very high	94.8	Very high	41 Å²	41	72.9 Å²	72.9	16%	0.155	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-85.6	120.6	172.9	-175.2	66.7	0	0	0	110.7	R129 P130 M135 R160 G317 P318	R129-W315 HydrophobicContact CB-CE3 4.17Å; R129-W315 HydrophobicContact CB-CH2 4.38Å; R129-W315 HydrophobicContact CB-CZ3 3.85Å; R129-W315 HydrophobicContact CG-CE3 4.23Å; R129-W315 HydrophobicContact CG-CH2 4.09Å; R129-W315 HydrophobicContact CG-CZ3 3.51Å; P130-W315 VanDerWaalsContact CD-CE2 3.43Å; P130-W315 HydrophobicContact CG-CD2 4.15Å; P130-W315 HydrophobicContact CG-CG 4.12Å; P130-W315 HydrophobicContact CG-CZ2 4.43Å; M135-W315 HydrophobicContact CE-CB 3.96Å; M135-W315 HydrophobicContact CG-CB 4.49Å; M135-W315 HydrophobicContact SD-CB 3.88Å; M135-W315 HydrophobicContact SD-CG 4.33Å; R160-W315 PolarHBondContact O-NE1 3.14Å; R160-W315 VanDerWaalsContact O-NE1 3.07Å; W315-G317 VanDerWaalsContact CE2-C 3.41Å; W315-G317 VanDerWaalsContact NE1-C 3.31Å; W315-G317 PolarHBondContact NE1-O 2.8Å; W315-P318 HydrophobicContact CZ2-CG 4.03Å
316	E	95.7	Very high	92.2	Very high	185 Å²	185	82 Å²	82	86%	0.864	45%	0.447	S	S	*	.			trans	-98.5	-9.5	-179.1	-61.4	-172.4	161	0	0	113.3
317	G	96.1	Very high	89.2	Confident	14 Å²	14	80.5 Å²	80.5	14%	0.144	45%	0.451	C	S	.	.	S	Bend	trans	144.8	173.2	-179.8	0	0	0	0	0	112	W315 T319	W315-G317 VanDerWaalsContact CE2-C 3.41Å; W315-G317 VanDerWaalsContact NE1-C 3.31Å; W315-G317 PolarHBondContact NE1-O 2.8Å; G317-T319 PolarHBondContact O-N 3.43Å; G317-T319 VanDerWaalsContact O-N 3.08Å; G317-T319 PolarHBondContact O-OG1 2.82Å; G317-T319 VanDerWaalsContact O-OG1 3.04Å
318	P	96.7	Very high	86.3	Confident	84 Å²	84	82.4 Å²	82.4	55%	0.545	47%	0.467	S	S	.	.			trans	-55.7	116.4	179.8	-23.4	33.8	0	0	0	111.1	R160 W315	R160-P318 WeakPolarHBondContact O-CA 3.49Å; W315-P318 HydrophobicContact CZ2-CG 4.03Å
319	T	95.9	Very high	83.3	Confident	75 Å²	75	89.4 Å²	89.4	46%	0.46	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.2	-177	-59.5	0	0	0	0	108.7	R160 G162 G317	R160-T319 PolarHBondContact O-N 3.47Å; R160-T319 VanDerWaalsContact O-N 3.08Å; G162-T319 VanDerWaalsContact CA-O 3.29Å; G162-T319 WeakPolarHBondContact CA-O 3.47Å; G162-T319 PolarHBondContact N-O 3.27Å; G317-T319 PolarHBondContact O-N 3.43Å; G317-T319 VanDerWaalsContact O-N 3.08Å; G317-T319 PolarHBondContact O-OG1 2.82Å; G317-T319 VanDerWaalsContact O-OG1 3.04Å
320	V	96.3	Very high	80.3	Confident	69 Å²	69	93.1 Å²	93.1	42%	0.418	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.5	176.9	-178	0	0	0	0	109.3	V159 V188	V159-V320 HydrophobicContact CG1-CG1 4.21Å; V159-V320 HydrophobicContact CG1-CG2 4.17Å; V188-V320 HydrophobicContact CB-CG1 4.5Å; V188-V320 HydrophobicContact CB-CG2 4.29Å; V188-V320 HydrophobicContact CG1-CG2 3.83Å; V188-V320 HydrophobicContact CG2-CG1 4.16Å
321	C	95.1	Very high	77.1	Confident	41 Å²	41	97.8 Å²	97.8	28%	0.277	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	108.3	175.8	-175.8	0	0	0	0	109.8	G162 P164 R165 S323	G162-C321 WeakPolarHBondContact O-CB 3.5Å; P164-C321 WeakPolarHBondContact CA-O 3.29Å; R165-C321 WeakPolarHBondContact CG-O 3.28Å; R165-C321 PolarHBondContact N-O 2.82Å; C321-S323 PolarHBondContact SG-O 3.06Å
322	E	92	Very high	73.9	Confident	104 Å²	104	94.9 Å²	94.9	49%	0.486	54%	0.536	S	S	.	.			trans	-72.5	-32.1	-177	-66.7	-65.5	171.6	0	0	112.9	R165 D166	R165-E322 IonicContact CZ-OE2 3.14Å; R165-E322 IonicContact NH1-OE1 2.78Å; R165-E322 PolarHBondContact NH1-OE1 3.47Å; R165-E322 IonicContact NH1-OE2 2.69Å; R165-E322 PolarHBondContact NH1-OE2 3.43Å; D166-E322 PolarHBondContact N-O 2.82Å
323	S	88.9	Confident	71.1	Confident	46 Å²	46	99.9 Å²	99.9	32%	0.322	56%	0.563	S	S	.	*			trans	-145.7	146.2	-179.3	-179.3	0	0	0	0	113.9	D166 C321 T325	D166-S323 VanDerWaalsContact CG-CA 3.48Å; D166-S323 WeakPolarHBondContact OD1-CA 3.3Å; D166-S323 PolarHBondContact OD2-OG 3.07Å; C321-S323 PolarHBondContact SG-O 3.06Å; S323-T325 VanDerWaalsContact C-N 3.29Å; S323-T325 PolarHBondContact O-N 2.95Å; S323-T325 PolarHBondContact OG-N 2.92Å; S323-T325 PolarHBondContact OG-OG1 3.28Å; S323-T325 VanDerWaalsContact OG-OG1 3.13Å
324	S	80.4	Confident	67.9	Low	43 Å²	43	105 Å²	105	30%	0.301	59%	0.594	S	S	.	*	S	Bend	trans	-68.7	-17.4	173.8	59.7	0	0	0	0	114.8	D166 K167	D166-S324 VanDerWaalsContact CG-N 3.27Å; D166-S324 WeakPolarHBondContact OD1-CB 3.38Å; D166-S324 PolarHBondContact OD1-N 3.32Å; D166-S324 PolarHBondContact OD1-OG 2.98Å; D166-S324 PolarHBondContact OD2-N 3.45Å; D166-S324 PolarHBondContact OD2-OG 3.37Å; K167-S324 WeakPolarHBondContact CE-OG 3.37Å
325	T	72.5	Confident	64.8	Low	100 Å²	100	105.9 Å²	105.9	61%	0.613	60%	0.598	S	S	*	*	S	Bend	trans	-81.6	124.6	174.9	54.3	0	0	0	0	110.5	S323 S327	S323-T325 VanDerWaalsContact C-N 3.29Å; S323-T325 PolarHBondContact O-N 2.95Å; S323-T325 PolarHBondContact OG-N 2.92Å; S323-T325 PolarHBondContact OG-OG1 3.28Å; S323-T325 VanDerWaalsContact OG-OG1 3.13Å; T325-S327 PolarHBondContact O-N 3.49Å; T325-S327 VanDerWaalsContact O-N 3.14Å
326	F	45.9	Very low	61.6	Low	192 Å²	192	109.2 Å²	109.2	84%	0.842	63%	0.625	S	S	*	*			trans	-59.6	115.5	168.7	-144.6	-93.4	0	0	0	108.3	P328	F326-P328 HydrophobicContact CD1-CB 4.46Å; F326-P328 VanDerWaalsContact O-CD 3.25Å; F326-P328 WeakPolarHBondContact O-CD 3.32Å
327	S	35.3	Very low	58.5	Low	92 Å²	92	106.5 Å²	106.5	64%	0.643	62%	0.623	S	S	*	*			trans	-99.7	99.2	168.3	-161.9	0	0	0	0	107.4	T325 E329	T325-S327 PolarHBondContact O-N 3.49Å; T325-S327 VanDerWaalsContact O-N 3.14Å; S327-E329 PolarHBondContact O-N 3.37Å
328	P	38	Very low	55.5	Low	104 Å²	104	118.4 Å²	118.4	68%	0.675	66%	0.664	S	S	*	*			trans	-78.7	73.1	170.5	33.9	-31.2	0	0	0	108.3	F326	F326-P328 HydrophobicContact CD1-CB 4.46Å; F326-P328 VanDerWaalsContact O-CD 3.25Å; F326-P328 WeakPolarHBondContact O-CD 3.32Å
329	E	34.5	Very low	52.3	Low	164 Å²	164	117.7 Å²	117.7	77%	0.766	67%	0.672	S	S	*	*			trans	-136.2	75	174.6	-73.9	-166.6	175.5	0	0	112.1	S327	S327-E329 PolarHBondContact O-N 3.37Å
330	T	35.1	Very low	49	Very low	145 Å²	145	121.1 Å²	121.1	89%	0.89	69%	0.693	S	S	*	*			trans	-141.1	65.2	136.8	41.9	0	0	0	0	109.4
331	T	30.9	Very low	45.9	Very low	137 Å²	137	122.7 Å²	122.7	84%	0.84	71%	0.707	S	S	*	*	S	Bend	trans	-138.6	137.9	147.5	47.6	0	0	0	0	109.3
332	A	31.5	Very low	42.7	Very low	89 Å²	89	125.5 Å²	125.5	74%	0.736	73%	0.733	S	S	*	*			trans	-63.8	150.9	-166.1	0	0	0	0	0	114.3
333	D	39.7	Very low	39.7	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	75%	0.747	S	S	*	*			trans	18.8	102.1	149.9	-80.3	-45.3	0	0	0	117
334	T	30.9	Very low	36.8	Very low	138 Å²	138	135 Å²	135	85%	0.847	77%	0.774	S	S	*	*			trans	-144.7	111.9	140.8	-29.8	0	0	0	0	110.4
335	K	31.1	Very low	34.3	Very low	198 Å²	198	142.6 Å²	142.6	86%	0.861	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.3	178.7	-139.6	174	-169.3	168.7	0	109.7
336	P	30.6	Very low	32.3	Very low	112 Å²	112	144.9 Å²	144.9	73%	0.727	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.8	149.9	174.1	27.6	-30.6	0	0	0	111.2
337	P	31.1	Very low	31.6	Very low	128 Å²	128	145.1 Å²	145.1	83%	0.831	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-71.4	141.6	-176.3	29.7	-32.2	0	0	0	111.2	G339	P337-G339 PolarHBondContact O-N 3.07Å
338	R	33	Very low	31.3	Very low	263 Å²	263	150.1 Å²	150.1	99%	0.992	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-65.1	120.9	175.7	-78.5	176.8	169.7	176.1	-3.9	110.5
339	G	28.7	Very low	30.9	Very low	69 Å²	69	152.3 Å²	152.3	71%	0.711	83%	0.832	S	S	*	*			trans	-129.8	104	171.3	0	0	0	0	0	111.9	P337	P337-G339 PolarHBondContact O-N 3.07Å
340	V	28.3	Very low	30.7	Very low	148 Å²	148	154 Å²	154	90%	0.897	84%	0.837	S	S	*	*			trans	40.4	121.6	148.9	-163.7	0	0	0	0	120.3
341	S	29.5	Very low	30.5	Very low	102 Å²	102	155.1 Å²	155.1	71%	0.713	84%	0.836	S	S	*	*			trans	-64.7	134.1	170.7	-176.1	0	0	0	0	112.9
342	A	28.5	Very low	30.4	Very low	100 Å²	100	158.8 Å²	158.8	83%	0.826	84%	0.84	S	S	*	*			trans	-133.1	122.6	149.3	0	0	0	0	0	108.3
343	K	28.7	Very low	30.4	Very low	183 Å²	183	162.6 Å²	162.6	80%	0.796	84%	0.843	S	S	*	*			trans	-73.7	139.8	176.7	-66.4	167.9	176.7	169.9	0	108.4
344	D	28.5	Very low	30.1	Very low	166 Å²	166	163.4 Å²	163.4	89%	0.888	84%	0.841	S	S	*	*			trans	-147.1	121.1	141.6	-91.3	-38	0	0	0	111.1
345	K	28.8	Very low	30.2	Very low	203 Å²	203	168.8 Å²	168.8	88%	0.883	85%	0.846	S	S	*	*			trans	-94.3	122.2	173.6	-78.2	179.8	172.8	-178.5	0	107.5
346	V	30.6	Very low	30.2	Very low	147 Å²	147	168.9 Å²	168.9	89%	0.891	85%	0.846	S	S	*	*			trans	-133.4	135.4	156.3	-177.3	0	0	0	0	110.5
347	K	30.1	Very low	30.2	Very low	197 Å²	197	174.6 Å²	174.6	86%	0.857	85%	0.853	S	S	*	*			trans	-66.5	135.7	-162.5	-74.3	169.2	169.1	176.7	0	114.3	D349	K347-D349 PolarHBondContact O-N 3.31Å
348	K	29.6	Very low	30.3	Very low	197 Å²	197	178 Å²	178	86%	0.857	86%	0.858	S	S	*	*			trans	-56	120.8	144.1	-104.3	175.6	171.1	174.9	0	108.2
349	D	29.8	Very low	30.1	Very low	151 Å²	151	169.7 Å²	169.7	81%	0.807	85%	0.846	S	S	*	*			trans	167.3	110.4	142.6	-82.9	-23.5	0	0	0	108.3	K347	K347-D349 PolarHBondContact O-N 3.31Å
350	K	28.8	Very low	30.1	Very low	200 Å²	200	172.9 Å²	172.9	87%	0.87	85%	0.852	S	S	*	*			trans	145.1	99.4	161.3	-84.3	170.4	-176.8	-167.4	0	108.9
351	I	31.9	Very low	30.2	Very low	167 Å²	167	174.4 Å²	174.4	86%	0.856	85%	0.849	S	S	*	*			trans	179.3	73.6	139.6	-77.5	144.3	0	0	0	103.4
352	K	29.8	Very low	30.4	Very low	214 Å²	214	174.7 Å²	174.7	93%	0.93	85%	0.849	S	S	*	*	S	Bend	trans	-145.4	27.6	166.5	-147.2	-177.1	-176.7	-177.4	0	111
353	E	31.6	Very low	30.4	Very low	169 Å²	169	176.8 Å²	176.8	79%	0.79	85%	0.851	S	S	*	*	S	Bend	trans	-140.4	31.1	-173.2	-143.5	175.5	-175.2	0	0	112.9
354	E	32	Very low	30.5	Very low	179 Å²	179	177.1 Å²	177.1	84%	0.836	86%	0.856	S	S	*	*	S	Bend	trans	-123.3	9.2	170.7	-78.9	-175.9	160.6	0	0	113.4
355	R	33.8	Very low	30.4	Very low	252 Å²	252	177 Å²	177	95%	0.951	86%	0.855	S	S	*	*	S	Bend	trans	-109.6	20.4	177	-79.3	-169.5	177	-167.9	-0.4	114.7
356	K	30.9	Very low	30.4	Very low	199 Å²	199	172 Å²	172	87%	0.865	85%	0.851	S	S	*	*	S	Bend	trans	-143.9	26.8	-175.2	-132.5	-177.7	-176.6	-172.8	0	115.9
357	R	31.5	Very low	30.2	Very low	232 Å²	232	168.6 Å²	168.6	88%	0.875	85%	0.846	S	S	*	*	S	Bend	trans	-135.4	61.1	170.7	-69	-171.7	-176.7	-175.3	2.5	110.7
358	E	32.2	Very low	30.2	Very low	200 Å²	200	166.4 Å²	166.4	94%	0.935	85%	0.849	S	S	*	*			trans	-155.8	76.5	159.2	-112.4	172.7	-166.1	0	0	106.9
359	A	28.5	Very low	30.1	Very low	88 Å²	88	166.7 Å²	166.7	73%	0.727	85%	0.85	S	S	*	*			trans	-153.1	135.3	165.5	0	0	0	0	0	107.5
360	T	28.8	Very low	30	Very low	136 Å²	136	167.3 Å²	167.3	83%	0.834	85%	0.853	S	S	*	*			trans	74.2	120.2	177.2	20.5	0	0	0	0	115.4
361	Q	30	Very low	30	Very low	181 Å²	181	166.3 Å²	166.3	85%	0.846	85%	0.852	S	S	*	*			cis	-157.5	174.2	41.7	-102.7	-164.7	0.7	0	0	113.5
362	P	33.6	Very low	29.8	Very low	108 Å²	108	165 Å²	165	70%	0.701	85%	0.852	S	S	*	*			trans	-101.5	163.6	-148.8	40.3	-34.9	0	0	0	115.2
363	T	29.1	Very low	29.7	Very low	144 Å²	144	161 Å²	161	88%	0.883	85%	0.845	S	S	*	*			trans	-135.8	134.3	158	55	0	0	0	0	110.1
364	E	29.9	Very low	29.4	Very low	189 Å²	189	158.1 Å²	158.1	88%	0.883	84%	0.844	S	S	*	*			trans	-74.6	149.1	-178.6	-64.7	176.1	147.5	0	0	112.7
365	D	27.3	Very low	29.2	Very low	165 Å²	165	157.2 Å²	157.2	88%	0.882	84%	0.843	S	S	*	*			trans	107.9	145.3	134.8	-126.5	-3.8	0	0	0	121.4
366	A	29.7	Very low	28.9	Very low	96 Å²	96	154.4 Å²	154.4	79%	0.793	84%	0.838	S	S	*	*			trans	82	92.2	177.2	0	0	0	0	0	117.5
367	G	26.3	Very low	28.8	Very low	76 Å²	76	156.7 Å²	156.7	78%	0.784	84%	0.841	S	S	*	*			trans	-87.7	172.6	-179.8	0	0	0	0	0	116.7
368	V	28.8	Very low	28.7	Very low	152 Å²	152	154.8 Å²	154.8	92%	0.921	84%	0.842	S	S	*	*			trans	-148.3	136.7	147.1	178.3	0	0	0	0	106.8
369	K	27.9	Very low	28.5	Very low	202 Å²	202	156.9 Å²	156.9	88%	0.878	84%	0.841	S	S	*	*			trans	-69.8	141.2	-176.3	-65.1	172.8	176.1	177.8	0	111.7
370	D	27.7	Very low	28.6	Very low	164 Å²	164	157.5 Å²	157.5	88%	0.877	85%	0.846	S	S	*	*			trans	-135.8	131.1	153.3	-148	-2.2	0	0	0	109.4
371	E	28.9	Very low	28.5	Very low	180 Å²	180	158.7 Å²	158.7	84%	0.841	85%	0.847	S	S	*	*			trans	-84.2	119.7	-172.1	-70.8	-178.9	152.3	0	0	110.6
372	T	27.1	Very low	28.4	Very low	138 Å²	138	160.1 Å²	160.1	85%	0.847	85%	0.851	S	S	*	*			trans	-105.1	112.3	164	47.4	0	0	0	0	110.7
373	V	27.4	Very low	28.3	Very low	131 Å²	131	160.2 Å²	160.2	79%	0.794	85%	0.854	S	S	*	*			trans	-71.1	120.2	168.3	174.8	0	0	0	0	109.6
374	S	26.8	Very low	28.5	Very low	109 Å²	109	157.9 Å²	157.9	76%	0.762	85%	0.85	S	S	*	*			trans	-91.2	117.5	173.3	50.8	0	0	0	0	111.1
375	I	27.9	Very low	28.5	Very low	159 Å²	159	158.1 Å²	158.1	82%	0.815	85%	0.851	S	S	*	*			trans	-85.8	113.9	170.8	-62.8	174.7	0	0	0	108.9
376	K	27.5	Very low	28.9	Very low	194 Å²	194	156.9 Å²	156.9	84%	0.843	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-74.7	134	167.2	-83.2	179.7	174.8	176.8	0	109.7
377	R	28.7	Very low	28.8	Very low	247 Å²	247	156 Å²	156	93%	0.932	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-83.5	120.2	164.6	-79	177.5	169.8	171.6	-4	108.7
378	E	28.6	Very low	29.1	Very low	192 Å²	192	159.6 Å²	159.6	90%	0.897	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-89.3	136.7	165.5	-77.8	-177.8	158	0	0	110.5
379	R	27.3	Very low	29.4	Very low	244 Å²	244	160.9 Å²	160.9	92%	0.921	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-88.6	124.7	170.1	-115	175.3	173.2	167.8	-3.8	106.5
380	A	30.9	Very low	29.9	Very low	100 Å²	100	164 Å²	164	83%	0.826	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-84.6	119	169.7	0	0	0	0	0	109.4
381	D	28.1	Very low	30	Very low	161 Å²	161	164.1 Å²	164.1	86%	0.861	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-79.2	135.2	165.9	-85.6	-32.4	0	0	0	109.6
382	F	27.7	Very low	30.1	Very low	211 Å²	211	163.2 Å²	163.2	93%	0.925	86%	0.857	S	S	*	*			trans	-99.4	110.4	175.6	-134.1	-92.3	0	0	0	107.6
383	S	31	Very low	30.3	Very low	111 Å²	111	164.6 Å²	164.6	78%	0.776	86%	0.857	S	S	*	*			trans	-102.1	121	167.9	55.4	0	0	0	0	109.7
384	A	32.4	Very low	30.4	Very low	95 Å²	95	166.6 Å²	166.6	79%	0.785	86%	0.861	S	S	*	*			trans	-78.4	131.5	168.3	0	0	0	0	0	109.7
385	E	30.9	Very low	30.7	Very low	194 Å²	194	170.2 Å²	170.2	91%	0.907	87%	0.867	S	S	*	*			trans	-128.1	135.6	160	-84.1	-172.6	159.9	0	0	110.6
386	T	35.1	Very low	30.9	Very low	138 Å²	138	170.9 Å²	170.9	85%	0.847	87%	0.871	S	S	*	*			trans	-102.4	142.7	-175.5	43.2	0	0	0	0	111.2
387	G	28.3	Very low	31.1	Very low	77 Å²	77	169.3 Å²	169.3	79%	0.794	87%	0.873	S	S	*	*			trans	81.6	159	155.7	0	0	0	0	0	115.6
388	E	32.8	Very low	31.3	Very low	153 Å²	153	163.3 Å²	163.3	72%	0.715	87%	0.868	S	S	*	*			cis	-171.9	147	-12.2	-138.8	-171.2	-156.3	0	0	104.9
389	K	34.6	Very low	31.5	Very low	178 Å²	178	160.9 Å²	160.9	77%	0.774	87%	0.866	S	S	*	*			trans	66.4	142.3	162.3	-59.8	164.9	177.5	140.8	0	116.6
390	E	39	Very low	31.9	Very low	269 Å²	269	153.4 Å²	153.4	100%	1.257	86%	0.861	S	S	*	*			cis	-128.6	0	22	-74.1	177.5	134.6	0	0	112.6

Retrieved 390 of 390 residues in 623.8 ms (Link to these results)

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